BindingDB Reactant_set_id Ligand SMILES Ligand InChI Ligand InChI Key BindingDB MonomerID BindingDB Ligand Name Target Name Target Source Organism According to Curator or DataSource Ki (nM) IC50 (nM) Kd (nM) EC50 (nM) kon (M-1-s-1) koff (s-1) pH Temp (C) Curation/DataSource Article DOI BindingDB Entry DOI PMID PubChem AID Patent Number Authors Date of publication Date in BindingDB Institution Link to Ligand in BindingDB Link to Target in BindingDB Link to Ligand-Target Pair in BindingDB Ligand HET ID in PDB PDB ID(s) for Ligand-Target Complex PubChem CID PubChem SID ChEBI ID of Ligand ChEMBL ID of Ligand DrugBank ID of Ligand IUPHAR_GRAC ID of Ligand KEGG ID of Ligand ZINC ID of Ligand Number of Protein Chains in Target (>1 implies a multichain complex) BindingDB Target Chain Sequence 1 PDB ID(s) of Target Chain 1 UniProt (SwissProt) Recommended Name of Target Chain 1 UniProt (SwissProt) Entry Name of Target Chain 1 UniProt (SwissProt) Primary ID of Target Chain 1 UniProt (SwissProt) Secondary ID(s) of Target Chain 1 UniProt (SwissProt) Alternative ID(s) of Target Chain 1 UniProt (TrEMBL) Submitted Name of Target Chain 1 UniProt (TrEMBL) Entry Name of Target Chain 1 UniProt (TrEMBL) Primary ID of Target Chain 1 UniProt (TrEMBL) Secondary ID(s) of Target Chain 1 UniProt (TrEMBL) Alternative ID(s) of Target Chain 1 BindingDB Target Chain Sequence 2 PDB ID(s) of Target Chain 2 UniProt (SwissProt) Recommended Name of Target Chain 2 UniProt (SwissProt) Entry Name of Target Chain 2 UniProt (SwissProt) Primary ID of Target Chain 2 UniProt (SwissProt) Secondary ID(s) of Target Chain 2 UniProt (SwissProt) Alternative ID(s) of Target Chain 2 UniProt (TrEMBL) Submitted Name of Target Chain 2 UniProt (TrEMBL) Entry Name of Target Chain 2 UniProt (TrEMBL) Primary ID of Target Chain 2 UniProt (TrEMBL) Secondary ID(s) of Target Chain 2 UniProt (TrEMBL) Alternative ID(s) of Target Chain 2 BindingDB Target Chain Sequence 3 PDB ID(s) of Target Chain 3 UniProt (SwissProt) Recommended Name of Target Chain 3 UniProt (SwissProt) Entry Name of Target Chain 3 UniProt (SwissProt) Primary ID of Target Chain 3 UniProt (SwissProt) Secondary ID(s) of Target Chain 3 UniProt (SwissProt) Alternative ID(s) of Target Chain 3 UniProt (TrEMBL) Submitted Name of Target Chain 3 UniProt (TrEMBL) Entry Name of Target Chain 3 UniProt (TrEMBL) Primary ID of Target Chain 3 UniProt (TrEMBL) Secondary ID(s) of Target Chain 3 UniProt (TrEMBL) Alternative ID(s) of Target Chain 3 BindingDB Target Chain Sequence 4 PDB ID(s) of Target Chain 4 UniProt (SwissProt) Recommended Name of Target Chain 4 UniProt (SwissProt) Entry Name of Target Chain 4 UniProt (SwissProt) Primary ID of Target Chain 4 UniProt (SwissProt) Secondary ID(s) of Target Chain 4 UniProt (SwissProt) Alternative ID(s) of Target Chain 4 UniProt (TrEMBL) Submitted Name of Target Chain 4 UniProt (TrEMBL) Entry Name of Target Chain 4 UniProt (TrEMBL) Primary ID of Target Chain 4 UniProt (TrEMBL) Secondary ID(s) of Target Chain 4 UniProt (TrEMBL) Alternative ID(s) of Target Chain 4 BindingDB Target Chain Sequence 5 PDB ID(s) of Target Chain 5 UniProt (SwissProt) Recommended Name of Target Chain 5 UniProt (SwissProt) Entry Name of Target Chain 5 UniProt (SwissProt) Primary ID of Target Chain 5 UniProt (SwissProt) Secondary ID(s) of Target Chain 5 UniProt (SwissProt) Alternative ID(s) of Target Chain 5 UniProt (TrEMBL) Submitted Name of Target Chain 5 UniProt (TrEMBL) Entry Name of Target Chain 5 UniProt (TrEMBL) Primary ID of Target Chain 5 UniProt (TrEMBL) Secondary ID(s) of Target Chain 5 UniProt (TrEMBL) Alternative ID(s) of Target Chain 5 BindingDB Target Chain Sequence 6 PDB ID(s) of Target Chain 6 UniProt (SwissProt) Recommended Name of Target Chain 6 UniProt (SwissProt) Entry Name of Target Chain 6 UniProt (SwissProt) Primary ID of Target Chain 6 UniProt (SwissProt) Secondary ID(s) of Target Chain 6 UniProt (SwissProt) Alternative ID(s) of Target Chain 6 UniProt (TrEMBL) Submitted Name of Target Chain 6 UniProt (TrEMBL) Entry Name of Target Chain 6 UniProt (TrEMBL) Primary ID of Target Chain 6 UniProt (TrEMBL) Secondary ID(s) of Target Chain 6 UniProt (TrEMBL) Alternative ID(s) of Target Chain 6 BindingDB Target Chain Sequence 7 PDB ID(s) of Target Chain 7 UniProt (SwissProt) Recommended Name of Target Chain 7 UniProt (SwissProt) Entry Name of Target Chain 7 UniProt (SwissProt) Primary ID of Target Chain 7 UniProt (SwissProt) Secondary ID(s) of Target Chain 7 UniProt (SwissProt) Alternative ID(s) of Target Chain 7 UniProt (TrEMBL) Submitted Name of Target Chain 7 UniProt (TrEMBL) Entry Name of Target Chain 7 UniProt (TrEMBL) Primary ID of Target Chain 7 UniProt (TrEMBL) Secondary ID(s) of Target Chain 7 UniProt (TrEMBL) Alternative ID(s) of Target Chain 7 BindingDB Target Chain Sequence 8 PDB ID(s) of Target Chain 8 UniProt (SwissProt) Recommended Name of Target Chain 8 UniProt (SwissProt) Entry Name of Target Chain 8 UniProt (SwissProt) Primary ID of Target Chain 8 UniProt (SwissProt) Secondary ID(s) of Target Chain 8 UniProt (SwissProt) Alternative ID(s) of Target Chain 8 UniProt (TrEMBL) Submitted Name of Target Chain 8 UniProt (TrEMBL) Entry Name of Target Chain 8 UniProt (TrEMBL) Primary ID of Target Chain 8 UniProt (TrEMBL) Secondary ID(s) of Target Chain 8 UniProt (TrEMBL) Alternative ID(s) of Target Chain 8 BindingDB Target Chain Sequence 9 PDB ID(s) of Target Chain 9 UniProt (SwissProt) Recommended Name of Target Chain 9 UniProt (SwissProt) Entry Name of Target Chain 9 UniProt (SwissProt) Primary ID of Target Chain 9 UniProt (SwissProt) Secondary ID(s) of Target Chain 9 UniProt (SwissProt) Alternative ID(s) of Target Chain 9 UniProt (TrEMBL) Submitted Name of Target Chain 9 UniProt (TrEMBL) Entry Name of Target Chain 9 UniProt (TrEMBL) Primary ID of Target Chain 9 UniProt (TrEMBL) Secondary ID(s) of Target Chain 9 UniProt (TrEMBL) Alternative ID(s) of Target Chain 9 BindingDB Target Chain Sequence 10 PDB ID(s) of Target Chain 10 UniProt (SwissProt) Recommended Name of Target Chain 10 UniProt (SwissProt) Entry Name of Target Chain 10 UniProt (SwissProt) Primary ID of Target Chain 10 UniProt (SwissProt) Secondary ID(s) of Target Chain 10 UniProt (SwissProt) Alternative ID(s) of Target Chain 10 UniProt (TrEMBL) Submitted Name of Target Chain 10 UniProt (TrEMBL) Entry Name of Target Chain 10 UniProt (TrEMBL) Primary ID of Target Chain 10 UniProt (TrEMBL) Secondary ID(s) of Target Chain 10 UniProt (TrEMBL) Alternative ID(s) of Target Chain 10 BindingDB Target Chain Sequence 11 PDB ID(s) of Target Chain 11 UniProt (SwissProt) Recommended Name of Target Chain 11 UniProt (SwissProt) Entry Name of Target Chain 11 UniProt (SwissProt) Primary ID of Target Chain 11 UniProt (SwissProt) Secondary ID(s) of Target Chain 11 UniProt (SwissProt) Alternative ID(s) of Target Chain 11 UniProt (TrEMBL) Submitted Name of Target Chain 11 UniProt (TrEMBL) Entry Name of Target Chain 11 UniProt (TrEMBL) Primary ID of Target Chain 11 UniProt (TrEMBL) Secondary ID(s) of Target Chain 11 UniProt (TrEMBL) Alternative ID(s) of Target Chain 11 BindingDB Target Chain Sequence 12 PDB ID(s) of Target Chain 12 UniProt (SwissProt) Recommended Name of Target Chain 12 UniProt (SwissProt) Entry Name of Target Chain 12 UniProt (SwissProt) Primary ID of Target Chain 12 UniProt (SwissProt) Secondary ID(s) of Target Chain 12 UniProt (SwissProt) Alternative ID(s) of Target Chain 12 UniProt (TrEMBL) Submitted Name of Target Chain 12 UniProt (TrEMBL) Entry Name of Target Chain 12 UniProt (TrEMBL) Primary ID of Target Chain 12 UniProt (TrEMBL) Secondary ID(s) of Target Chain 12 UniProt (TrEMBL) Alternative ID(s) of Target Chain 12 BindingDB Target Chain Sequence 13 PDB ID(s) of Target Chain 13 UniProt (SwissProt) Recommended Name of Target Chain 13 UniProt (SwissProt) Entry Name of Target Chain 13 UniProt (SwissProt) Primary ID of Target Chain 13 UniProt (SwissProt) Secondary ID(s) of Target Chain 13 UniProt (SwissProt) Alternative ID(s) of Target Chain 13 UniProt (TrEMBL) Submitted Name of Target Chain 13 UniProt (TrEMBL) Entry Name of Target Chain 13 UniProt (TrEMBL) Primary ID of Target Chain 13 UniProt (TrEMBL) Secondary ID(s) of Target Chain 13 UniProt (TrEMBL) Alternative ID(s) of Target Chain 13 BindingDB Target Chain Sequence 14 PDB ID(s) of Target Chain 14 UniProt (SwissProt) Recommended Name of Target Chain 14 UniProt (SwissProt) Entry Name of Target Chain 14 UniProt (SwissProt) Primary ID of Target Chain 14 UniProt (SwissProt) Secondary ID(s) of Target Chain 14 UniProt (SwissProt) Alternative ID(s) of Target Chain 14 UniProt (TrEMBL) Submitted Name of Target Chain 14 UniProt (TrEMBL) Entry Name of Target Chain 14 UniProt (TrEMBL) Primary ID of Target Chain 14 UniProt (TrEMBL) Secondary ID(s) of Target Chain 14 UniProt (TrEMBL) Alternative ID(s) of Target Chain 14 BindingDB Target Chain Sequence 15 PDB ID(s) of Target Chain 15 UniProt (SwissProt) Recommended Name of Target Chain 15 UniProt (SwissProt) Entry Name of Target Chain 15 UniProt (SwissProt) Primary ID of Target Chain 15 UniProt (SwissProt) Secondary ID(s) of Target Chain 15 UniProt (SwissProt) Alternative ID(s) of Target Chain 15 UniProt (TrEMBL) Submitted Name of Target Chain 15 UniProt (TrEMBL) Entry Name of Target Chain 15 UniProt (TrEMBL) Primary ID of Target Chain 15 UniProt (TrEMBL) Secondary ID(s) of Target Chain 15 UniProt (TrEMBL) Alternative ID(s) of Target Chain 15 BindingDB Target Chain Sequence 16 PDB ID(s) of Target Chain 16 UniProt (SwissProt) Recommended Name of Target Chain 16 UniProt (SwissProt) Entry Name of Target Chain 16 UniProt (SwissProt) Primary ID of Target Chain 16 UniProt (SwissProt) Secondary ID(s) of Target Chain 16 UniProt (SwissProt) Alternative ID(s) of Target Chain 16 UniProt (TrEMBL) Submitted Name of Target Chain 16 UniProt (TrEMBL) Entry Name of Target Chain 16 UniProt (TrEMBL) Primary ID of Target Chain 16 UniProt (TrEMBL) Secondary ID(s) of Target Chain 16 UniProt (TrEMBL) Alternative ID(s) of Target Chain 16 BindingDB Target Chain Sequence 17 PDB ID(s) of Target Chain 17 UniProt (SwissProt) Recommended Name of Target Chain 17 UniProt (SwissProt) Entry Name of Target Chain 17 UniProt (SwissProt) Primary ID of Target Chain 17 UniProt (SwissProt) Secondary ID(s) of Target Chain 17 UniProt (SwissProt) Alternative ID(s) of Target Chain 17 UniProt (TrEMBL) Submitted Name of Target Chain 17 UniProt (TrEMBL) Entry Name of Target Chain 17 UniProt (TrEMBL) Primary ID of Target Chain 17 UniProt (TrEMBL) Secondary ID(s) of Target Chain 17 UniProt (TrEMBL) Alternative ID(s) of Target Chain 17 BindingDB Target Chain Sequence 18 PDB ID(s) of Target Chain 18 UniProt (SwissProt) Recommended Name of Target Chain 18 UniProt (SwissProt) Entry Name of Target Chain 18 UniProt (SwissProt) Primary ID of Target Chain 18 UniProt (SwissProt) Secondary ID(s) of Target Chain 18 UniProt (SwissProt) Alternative ID(s) of Target Chain 18 UniProt (TrEMBL) Submitted Name of Target Chain 18 UniProt (TrEMBL) Entry Name of Target Chain 18 UniProt (TrEMBL) Primary ID of Target Chain 18 UniProt (TrEMBL) Secondary ID(s) of Target Chain 18 UniProt (TrEMBL) Alternative ID(s) of Target Chain 18 BindingDB Target Chain Sequence 19 PDB ID(s) of Target Chain 19 UniProt (SwissProt) Recommended Name of Target Chain 19 UniProt (SwissProt) Entry Name of Target Chain 19 UniProt (SwissProt) Primary ID of Target Chain 19 UniProt (SwissProt) Secondary ID(s) of Target Chain 19 UniProt (SwissProt) Alternative ID(s) of Target Chain 19 UniProt (TrEMBL) Submitted Name of Target Chain 19 UniProt (TrEMBL) Entry Name of Target Chain 19 UniProt (TrEMBL) Primary ID of Target Chain 19 UniProt (TrEMBL) Secondary ID(s) of Target Chain 19 UniProt (TrEMBL) Alternative ID(s) of Target Chain 19 BindingDB Target Chain Sequence 20 PDB ID(s) of Target Chain 20 UniProt (SwissProt) Recommended Name of Target Chain 20 UniProt (SwissProt) Entry Name of Target Chain 20 UniProt (SwissProt) Primary ID of Target Chain 20 UniProt (SwissProt) Secondary ID(s) of Target Chain 20 UniProt (SwissProt) Alternative ID(s) of Target Chain 20 UniProt (TrEMBL) Submitted Name of Target Chain 20 UniProt (TrEMBL) Entry Name of Target Chain 20 UniProt (TrEMBL) Primary ID of Target Chain 20 UniProt (TrEMBL) Secondary ID(s) of Target Chain 20 UniProt (TrEMBL) Alternative ID(s) of Target Chain 20 BindingDB Target Chain Sequence 21 PDB ID(s) of Target Chain 21 UniProt (SwissProt) Recommended Name of Target Chain 21 UniProt (SwissProt) Entry Name of Target Chain 21 UniProt (SwissProt) Primary ID of Target Chain 21 UniProt (SwissProt) Secondary ID(s) of Target Chain 21 UniProt (SwissProt) Alternative ID(s) of Target Chain 21 UniProt (TrEMBL) Submitted Name of Target Chain 21 UniProt (TrEMBL) Entry Name of Target Chain 21 UniProt (TrEMBL) Primary ID of Target Chain 21 UniProt (TrEMBL) Secondary ID(s) of Target Chain 21 UniProt (TrEMBL) Alternative ID(s) of Target Chain 21 BindingDB Target Chain Sequence 22 PDB ID(s) of Target Chain 22 UniProt (SwissProt) Recommended Name of Target Chain 22 UniProt (SwissProt) Entry Name of Target Chain 22 UniProt (SwissProt) Primary ID of Target Chain 22 UniProt (SwissProt) Secondary ID(s) of Target Chain 22 UniProt (SwissProt) Alternative ID(s) of Target Chain 22 UniProt (TrEMBL) Submitted Name of Target Chain 22 UniProt (TrEMBL) Entry Name of Target Chain 22 UniProt (TrEMBL) Primary ID of Target Chain 22 UniProt (TrEMBL) Secondary ID(s) of Target Chain 22 UniProt (TrEMBL) Alternative ID(s) of Target Chain 22 BindingDB Target Chain Sequence 23 PDB ID(s) of Target Chain 23 UniProt (SwissProt) Recommended Name of Target Chain 23 UniProt (SwissProt) Entry Name of Target Chain 23 UniProt (SwissProt) Primary ID of Target Chain 23 UniProt (SwissProt) Secondary ID(s) of Target Chain 23 UniProt (SwissProt) Alternative ID(s) of Target Chain 23 UniProt (TrEMBL) Submitted Name of Target Chain 23 UniProt (TrEMBL) Entry Name of Target Chain 23 UniProt (TrEMBL) Primary ID of Target Chain 23 UniProt (TrEMBL) Secondary ID(s) of Target Chain 23 UniProt (TrEMBL) Alternative ID(s) of Target Chain 23 BindingDB Target Chain Sequence 24 PDB ID(s) of Target Chain 24 UniProt (SwissProt) Recommended Name of Target Chain 24 UniProt (SwissProt) Entry Name of Target Chain 24 UniProt (SwissProt) Primary ID of Target Chain 24 UniProt (SwissProt) Secondary ID(s) of Target Chain 24 UniProt (SwissProt) Alternative ID(s) of Target Chain 24 UniProt (TrEMBL) Submitted Name of Target Chain 24 UniProt (TrEMBL) Entry Name of Target Chain 24 UniProt (TrEMBL) Primary ID of Target Chain 24 UniProt (TrEMBL) Secondary ID(s) of Target Chain 24 UniProt (TrEMBL) Alternative ID(s) of Target Chain 24 BindingDB Target Chain Sequence 25 PDB ID(s) of Target Chain 25 UniProt (SwissProt) Recommended Name of Target Chain 25 UniProt (SwissProt) Entry Name of Target Chain 25 UniProt (SwissProt) Primary ID of Target Chain 25 UniProt (SwissProt) Secondary ID(s) of Target Chain 25 UniProt (SwissProt) Alternative ID(s) of Target Chain 25 UniProt (TrEMBL) Submitted Name of Target Chain 25 UniProt (TrEMBL) Entry Name of Target Chain 25 UniProt (TrEMBL) Primary ID of Target Chain 25 UniProt (TrEMBL) Secondary ID(s) of Target Chain 25 UniProt (TrEMBL) Alternative ID(s) of Target Chain 25 BindingDB Target Chain Sequence 26 PDB ID(s) of Target Chain 26 UniProt (SwissProt) Recommended Name of Target Chain 26 UniProt (SwissProt) Entry Name of Target Chain 26 UniProt (SwissProt) Primary ID of Target Chain 26 UniProt (SwissProt) Secondary ID(s) of Target Chain 26 UniProt (SwissProt) Alternative ID(s) of Target Chain 26 UniProt (TrEMBL) Submitted Name of Target Chain 26 UniProt (TrEMBL) Entry Name of Target Chain 26 UniProt (TrEMBL) Primary ID of Target Chain 26 UniProt (TrEMBL) Secondary ID(s) of Target Chain 26 UniProt (TrEMBL) Alternative ID(s) of Target Chain 26 BindingDB Target Chain Sequence 27 PDB ID(s) of Target Chain 27 UniProt (SwissProt) Recommended Name of Target Chain 27 UniProt (SwissProt) Entry Name of Target Chain 27 UniProt (SwissProt) Primary ID of Target Chain 27 UniProt (SwissProt) Secondary ID(s) of Target Chain 27 UniProt (SwissProt) Alternative ID(s) of Target Chain 27 UniProt (TrEMBL) Submitted Name of Target Chain 27 UniProt (TrEMBL) Entry Name of Target Chain 27 UniProt (TrEMBL) Primary ID of Target Chain 27 UniProt (TrEMBL) Secondary ID(s) of Target Chain 27 UniProt (TrEMBL) Alternative ID(s) of Target Chain 27 BindingDB Target Chain Sequence 28 PDB ID(s) of Target Chain 28 UniProt (SwissProt) Recommended Name of Target Chain 28 UniProt (SwissProt) Entry Name of Target Chain 28 UniProt (SwissProt) Primary ID of Target Chain 28 UniProt (SwissProt) Secondary ID(s) of Target Chain 28 UniProt (SwissProt) Alternative ID(s) of Target Chain 28 UniProt (TrEMBL) Submitted Name of Target Chain 28 UniProt (TrEMBL) Entry Name of Target Chain 28 UniProt (TrEMBL) Primary ID of Target Chain 28 UniProt (TrEMBL) Secondary ID(s) of Target Chain 28 UniProt (TrEMBL) Alternative ID(s) of Target Chain 28 BindingDB Target Chain Sequence 29 PDB ID(s) of Target Chain 29 UniProt (SwissProt) Recommended Name of Target Chain 29 UniProt (SwissProt) Entry Name of Target Chain 29 UniProt (SwissProt) Primary ID of Target Chain 29 UniProt (SwissProt) Secondary ID(s) of Target Chain 29 UniProt (SwissProt) Alternative ID(s) of Target Chain 29 UniProt (TrEMBL) Submitted Name of Target Chain 29 UniProt (TrEMBL) Entry Name of Target Chain 29 UniProt (TrEMBL) Primary ID of Target Chain 29 UniProt (TrEMBL) Secondary ID(s) of Target Chain 29 UniProt (TrEMBL) Alternative ID(s) of Target Chain 29 BindingDB Target Chain Sequence 30 PDB ID(s) of Target Chain 30 UniProt (SwissProt) Recommended Name of Target Chain 30 UniProt (SwissProt) Entry Name of Target Chain 30 UniProt (SwissProt) Primary ID of Target Chain 30 UniProt (SwissProt) Secondary ID(s) of Target Chain 30 UniProt (SwissProt) Alternative ID(s) of Target Chain 30 UniProt (TrEMBL) Submitted Name of Target Chain 30 UniProt (TrEMBL) Entry Name of Target Chain 30 UniProt (TrEMBL) Primary ID of Target Chain 30 UniProt (TrEMBL) Secondary ID(s) of Target Chain 30 UniProt (TrEMBL) Alternative ID(s) of Target Chain 30 BindingDB Target Chain Sequence 31 PDB ID(s) of Target Chain 31 UniProt (SwissProt) Recommended Name of Target Chain 31 UniProt (SwissProt) Entry Name of Target Chain 31 UniProt (SwissProt) Primary ID of Target Chain 31 UniProt (SwissProt) Secondary ID(s) of Target Chain 31 UniProt (SwissProt) Alternative ID(s) of Target Chain 31 UniProt (TrEMBL) Submitted Name of Target Chain 31 UniProt (TrEMBL) Entry Name of Target Chain 31 UniProt (TrEMBL) Primary ID of Target Chain 31 UniProt (TrEMBL) Secondary ID(s) of Target Chain 31 UniProt (TrEMBL) Alternative ID(s) of Target Chain 31 BindingDB Target Chain Sequence 32 PDB ID(s) of Target Chain 32 UniProt (SwissProt) Recommended Name of Target Chain 32 UniProt (SwissProt) Entry Name of Target Chain 32 UniProt (SwissProt) Primary ID of Target Chain 32 UniProt (SwissProt) Secondary ID(s) of Target Chain 32 UniProt (SwissProt) Alternative ID(s) of Target Chain 32 UniProt (TrEMBL) Submitted Name of Target Chain 32 UniProt (TrEMBL) Entry Name of Target Chain 32 UniProt (TrEMBL) Primary ID of Target Chain 32 UniProt (TrEMBL) Secondary ID(s) of Target Chain 32 UniProt (TrEMBL) Alternative ID(s) of Target Chain 32 BindingDB Target Chain Sequence 33 PDB ID(s) of Target Chain 33 UniProt (SwissProt) Recommended Name of Target Chain 33 UniProt (SwissProt) Entry Name of Target Chain 33 UniProt (SwissProt) Primary ID of Target Chain 33 UniProt (SwissProt) Secondary ID(s) of Target Chain 33 UniProt (SwissProt) Alternative ID(s) of Target Chain 33 UniProt (TrEMBL) Submitted Name of Target Chain 33 UniProt (TrEMBL) Entry Name of Target Chain 33 UniProt (TrEMBL) Primary ID of Target Chain 33 UniProt (TrEMBL) Secondary ID(s) of Target Chain 33 UniProt (TrEMBL) Alternative ID(s) of Target Chain 33 BindingDB Target Chain Sequence 34 PDB ID(s) of Target Chain 34 UniProt (SwissProt) Recommended Name of Target Chain 34 UniProt (SwissProt) Entry Name of Target Chain 34 UniProt (SwissProt) Primary ID of Target Chain 34 UniProt (SwissProt) Secondary ID(s) of Target Chain 34 UniProt (SwissProt) Alternative ID(s) of Target Chain 34 UniProt (TrEMBL) Submitted Name of Target Chain 34 UniProt (TrEMBL) Entry Name of Target Chain 34 UniProt (TrEMBL) Primary ID of Target Chain 34 UniProt (TrEMBL) Secondary ID(s) of Target Chain 34 UniProt (TrEMBL) Alternative ID(s) of Target Chain 34 BindingDB Target Chain Sequence 35 PDB ID(s) of Target Chain 35 UniProt (SwissProt) Recommended Name of Target Chain 35 UniProt (SwissProt) Entry Name of Target Chain 35 UniProt (SwissProt) Primary ID of Target Chain 35 UniProt (SwissProt) Secondary ID(s) of Target Chain 35 UniProt (SwissProt) Alternative ID(s) of Target Chain 35 UniProt (TrEMBL) Submitted Name of Target Chain 35 UniProt (TrEMBL) Entry Name of Target Chain 35 UniProt (TrEMBL) Primary ID of Target Chain 35 UniProt (TrEMBL) Secondary ID(s) of Target Chain 35 UniProt (TrEMBL) Alternative ID(s) of Target Chain 35 BindingDB Target Chain Sequence 36 PDB ID(s) of Target Chain 36 UniProt (SwissProt) Recommended Name of Target Chain 36 UniProt (SwissProt) Entry Name of Target Chain 36 UniProt (SwissProt) Primary ID of Target Chain 36 UniProt (SwissProt) Secondary ID(s) of Target Chain 36 UniProt (SwissProt) Alternative ID(s) of Target Chain 36 UniProt (TrEMBL) Submitted Name of Target Chain 36 UniProt (TrEMBL) Entry Name of Target Chain 36 UniProt (TrEMBL) Primary ID of Target Chain 36 UniProt (TrEMBL) Secondary ID(s) of Target Chain 36 UniProt (TrEMBL) Alternative ID(s) of Target Chain 36 BindingDB Target Chain Sequence 37 PDB ID(s) of Target Chain 37 UniProt (SwissProt) Recommended Name of Target Chain 37 UniProt (SwissProt) Entry Name of Target Chain 37 UniProt (SwissProt) Primary ID of Target Chain 37 UniProt (SwissProt) Secondary ID(s) of Target Chain 37 UniProt (SwissProt) Alternative ID(s) of Target Chain 37 UniProt (TrEMBL) Submitted Name of Target Chain 37 UniProt (TrEMBL) Entry Name of Target Chain 37 UniProt (TrEMBL) Primary ID of Target Chain 37 UniProt (TrEMBL) Secondary ID(s) of Target Chain 37 UniProt (TrEMBL) Alternative ID(s) of Target Chain 37 BindingDB Target Chain Sequence 38 PDB ID(s) of Target Chain 38 UniProt (SwissProt) Recommended Name of Target Chain 38 UniProt (SwissProt) Entry Name of Target Chain 38 UniProt (SwissProt) Primary ID of Target Chain 38 UniProt (SwissProt) Secondary ID(s) of Target Chain 38 UniProt (SwissProt) Alternative ID(s) of Target Chain 38 UniProt (TrEMBL) Submitted Name of Target Chain 38 UniProt (TrEMBL) Entry Name of Target Chain 38 UniProt (TrEMBL) Primary ID of Target Chain 38 UniProt (TrEMBL) Secondary ID(s) of Target Chain 38 UniProt (TrEMBL) Alternative ID(s) of Target Chain 38 BindingDB Target Chain Sequence 39 PDB ID(s) of Target Chain 39 UniProt (SwissProt) Recommended Name of Target Chain 39 UniProt (SwissProt) Entry Name of Target Chain 39 UniProt (SwissProt) Primary ID of Target Chain 39 UniProt (SwissProt) Secondary ID(s) of Target Chain 39 UniProt (SwissProt) Alternative ID(s) of Target Chain 39 UniProt (TrEMBL) Submitted Name of Target Chain 39 UniProt (TrEMBL) Entry Name of Target Chain 39 UniProt (TrEMBL) Primary ID of Target Chain 39 UniProt (TrEMBL) Secondary ID(s) of Target Chain 39 UniProt (TrEMBL) Alternative ID(s) of Target Chain 39 BindingDB Target Chain Sequence 40 PDB ID(s) of Target Chain 40 UniProt (SwissProt) Recommended Name of Target Chain 40 UniProt (SwissProt) Entry Name of Target Chain 40 UniProt (SwissProt) Primary ID of Target Chain 40 UniProt (SwissProt) Secondary ID(s) of Target Chain 40 UniProt (SwissProt) Alternative ID(s) of Target Chain 40 UniProt (TrEMBL) Submitted Name of Target Chain 40 UniProt (TrEMBL) Entry Name of Target Chain 40 UniProt (TrEMBL) Primary ID of Target Chain 40 UniProt (TrEMBL) Secondary ID(s) of Target Chain 40 UniProt (TrEMBL) Alternative ID(s) of Target Chain 40 BindingDB Target Chain Sequence 41 PDB ID(s) of Target Chain 41 UniProt (SwissProt) Recommended Name of Target Chain 41 UniProt (SwissProt) Entry Name of Target Chain 41 UniProt (SwissProt) Primary ID of Target Chain 41 UniProt (SwissProt) Secondary ID(s) of Target Chain 41 UniProt (SwissProt) Alternative ID(s) of Target Chain 41 UniProt (TrEMBL) Submitted Name of Target Chain 41 UniProt (TrEMBL) Entry Name of Target Chain 41 UniProt (TrEMBL) Primary ID of Target Chain 41 UniProt (TrEMBL) Secondary ID(s) of Target Chain 41 UniProt (TrEMBL) Alternative ID(s) of Target Chain 41 BindingDB Target Chain Sequence 42 PDB ID(s) of Target Chain 42 UniProt (SwissProt) Recommended Name of Target Chain 42 UniProt (SwissProt) Entry Name of Target Chain 42 UniProt (SwissProt) Primary ID of Target Chain 42 UniProt (SwissProt) Secondary ID(s) of Target Chain 42 UniProt (SwissProt) Alternative ID(s) of Target Chain 42 UniProt (TrEMBL) Submitted Name of Target Chain 42 UniProt (TrEMBL) Entry Name of Target Chain 42 UniProt (TrEMBL) Primary ID of Target Chain 42 UniProt (TrEMBL) Secondary ID(s) of Target Chain 42 UniProt (TrEMBL) Alternative ID(s) of Target Chain 42 BindingDB Target Chain Sequence 43 PDB ID(s) of Target Chain 43 UniProt (SwissProt) Recommended Name of Target Chain 43 UniProt (SwissProt) Entry Name of Target Chain 43 UniProt (SwissProt) Primary ID of Target Chain 43 UniProt (SwissProt) Secondary ID(s) of Target Chain 43 UniProt (SwissProt) Alternative ID(s) of Target Chain 43 UniProt (TrEMBL) Submitted Name of Target Chain 43 UniProt (TrEMBL) Entry Name of Target Chain 43 UniProt (TrEMBL) Primary ID of Target Chain 43 UniProt (TrEMBL) Secondary ID(s) of Target Chain 43 UniProt (TrEMBL) Alternative ID(s) of Target Chain 43 BindingDB Target Chain Sequence 44 PDB ID(s) of Target Chain 44 UniProt (SwissProt) Recommended Name of Target Chain 44 UniProt (SwissProt) Entry Name of Target Chain 44 UniProt (SwissProt) Primary ID of Target Chain 44 UniProt (SwissProt) Secondary ID(s) of Target Chain 44 UniProt (SwissProt) Alternative ID(s) of Target Chain 44 UniProt (TrEMBL) Submitted Name of Target Chain 44 UniProt (TrEMBL) Entry Name of Target Chain 44 UniProt (TrEMBL) Primary ID of Target Chain 44 UniProt (TrEMBL) Secondary ID(s) of Target Chain 44 UniProt (TrEMBL) Alternative ID(s) of Target Chain 44 BindingDB Target Chain Sequence 45 PDB ID(s) of Target Chain 45 UniProt (SwissProt) Recommended Name of Target Chain 45 UniProt (SwissProt) Entry Name of Target Chain 45 UniProt (SwissProt) Primary ID of Target Chain 45 UniProt (SwissProt) Secondary ID(s) of Target Chain 45 UniProt (SwissProt) Alternative ID(s) of Target Chain 45 UniProt (TrEMBL) Submitted Name of Target Chain 45 UniProt (TrEMBL) Entry Name of Target Chain 45 UniProt (TrEMBL) Primary ID of Target Chain 45 UniProt (TrEMBL) Secondary ID(s) of Target Chain 45 UniProt (TrEMBL) Alternative ID(s) of Target Chain 45 BindingDB Target Chain Sequence 46 PDB ID(s) of Target Chain 46 UniProt (SwissProt) Recommended Name of Target Chain 46 UniProt (SwissProt) Entry Name of Target Chain 46 UniProt (SwissProt) Primary ID of Target Chain 46 UniProt (SwissProt) Secondary ID(s) of Target Chain 46 UniProt (SwissProt) Alternative ID(s) of Target Chain 46 UniProt (TrEMBL) Submitted Name of Target Chain 46 UniProt (TrEMBL) Entry Name of Target Chain 46 UniProt (TrEMBL) Primary ID of Target Chain 46 UniProt (TrEMBL) Secondary ID(s) of Target Chain 46 UniProt (TrEMBL) Alternative ID(s) of Target Chain 46 BindingDB Target Chain Sequence 47 PDB ID(s) of Target Chain 47 UniProt (SwissProt) Recommended Name of Target Chain 47 UniProt (SwissProt) Entry Name of Target Chain 47 UniProt (SwissProt) Primary ID of Target Chain 47 UniProt (SwissProt) Secondary ID(s) of Target Chain 47 UniProt (SwissProt) Alternative ID(s) of Target Chain 47 UniProt (TrEMBL) Submitted Name of Target Chain 47 UniProt (TrEMBL) Entry Name of Target Chain 47 UniProt (TrEMBL) Primary ID of Target Chain 47 UniProt (TrEMBL) Secondary ID(s) of Target Chain 47 UniProt (TrEMBL) Alternative ID(s) of Target Chain 47 BindingDB Target Chain Sequence 48 PDB ID(s) of Target Chain 48 UniProt (SwissProt) Recommended Name of Target Chain 48 UniProt (SwissProt) Entry Name of Target Chain 48 UniProt (SwissProt) Primary ID of Target Chain 48 UniProt (SwissProt) Secondary ID(s) of Target Chain 48 UniProt (SwissProt) Alternative ID(s) of Target Chain 48 UniProt (TrEMBL) Submitted Name of Target Chain 48 UniProt (TrEMBL) Entry Name of Target Chain 48 UniProt (TrEMBL) Primary ID of Target Chain 48 UniProt (TrEMBL) Secondary ID(s) of Target Chain 48 UniProt (TrEMBL) Alternative ID(s) of Target Chain 48 BindingDB Target Chain Sequence 49 PDB ID(s) of Target Chain 49 UniProt (SwissProt) Recommended Name of Target Chain 49 UniProt (SwissProt) Entry Name of Target Chain 49 UniProt (SwissProt) Primary ID of Target Chain 49 UniProt (SwissProt) Secondary ID(s) of Target Chain 49 UniProt (SwissProt) Alternative ID(s) of Target Chain 49 UniProt (TrEMBL) Submitted Name of Target Chain 49 UniProt (TrEMBL) Entry Name of Target Chain 49 UniProt (TrEMBL) Primary ID of Target Chain 49 UniProt (TrEMBL) Secondary ID(s) of Target Chain 49 UniProt (TrEMBL) Alternative ID(s) of Target Chain 49 BindingDB Target Chain Sequence 50 PDB ID(s) of Target Chain 50 UniProt (SwissProt) Recommended Name of Target Chain 50 UniProt (SwissProt) Entry Name of Target Chain 50 UniProt (SwissProt) Primary ID of Target Chain 50 UniProt (SwissProt) Secondary ID(s) of Target Chain 50 UniProt (SwissProt) Alternative ID(s) of Target Chain 50 UniProt (TrEMBL) Submitted Name of Target Chain 50 UniProt (TrEMBL) Entry Name of Target Chain 50 UniProt (TrEMBL) Primary ID of Target Chain 50 UniProt (TrEMBL) Secondary ID(s) of Target Chain 50 UniProt (TrEMBL) Alternative ID(s) of Target Chain 50 7806 CC(=O)N[C@@H]1[C@@H](N)CC(=C[C@H]1O)C(O)=O |r,c:8| InChI=1S/C9H14N2O4/c1-4(12)11-8-6(10)2-5(9(14)15)3-7(8)13/h3,6-8,13H,2,10H2,1H3,(H,11,12)(H,14,15) TTYVWILEGNYIQI-UHFFFAOYSA-N 4980 (3R,4R,5S)-5-amino-4-acetamido-3-hydroxycyclohex-1-ene-1-carboxylic acid::Carbocyclic Analogue 31 Neuraminidase Influenza A virus (strain A/Puerto Rico/8/1934 H1N1) 6300 6.5000 37.00 C Curated from the literature by BindingDB 10.1021/jm980162u 10.7270/Q2MP51GP 9651151 aid1795723 Kim, CU; Lew, W; Williams, MA; Wu, H; Zhang, L; Chen, X; Escarpe, PA; Mendel, DB; Laver, WG; Stevens, RC 7/2/1998 7/5/2005 Gilead Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=4980 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=753&target=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=4980&enzyme=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search 480263 8034619 1 MNPNQKIITIGSICLVVGLISLILQIGNIISIWISHSIQTGSQNHTGICNQNIITYKNSTWVKDTTSVILTGNSSLCPIRGWAIYSKDNSIRIGSKGDVFVIREPFISCSHLECRTFFLTQGALLNDKHSNGTVKDRSPYRALMSCPVGEAPSPYNSRFESVAWSASACHDGMGWLTIGISGPDNGAVAVLKYNGIITETIKSWRKKILRTQESECACVNGSCFTIMTDGPSDGLASYKIFKIEKGKVTKSIELNAPNSHYEECSCYPDTGKVMCVCRDNWHGSNRPWVSFDQNLDYQIGYICSGVFGDNPRPEDGTGSCGPVYVDGANGVKGFSYRYGNGVWIGRTKSHSSRHGFEMIWDPNGWTETDSKFSVRQDVVAMTDWSGYSGSFVQHPELTGLDCMRPCFWVELIRGRPKEKTIWTSASSISFCGVNSDTVDWSWPDGAELPFSIDK 9GQT,9GQQ Neuraminidase NRAM_I34A1 P03468 A4GXH6 Q20N35 Q84043 Q8JUU4 7807 CO[C@@H]1C=C(C[C@H](N)[C@H]1NC(C)=O)C(O)=O |r,c:3| InChI=1S/C10H16N2O4/c1-5(13)12-9-7(11)3-6(10(14)15)4-8(9)16-2/h4,7-9H,3,11H2,1-2H3,(H,12,13)(H,14,15) MMVFSYQYYBURNA-UHFFFAOYSA-N 4981 (3R,4R,5S)-5-amino-4-acetamido-3-methoxycyclohex-1-ene-1-carboxylic acid::Carbocyclic Analogue 32 Neuraminidase Influenza A virus (strain A/Puerto Rico/8/1934 H1N1) 3700 6.5000 37.00 C Curated from the literature by BindingDB 10.1021/jm980162u 10.7270/Q2MP51GP 9651151 aid1795723 Kim, CU; Lew, W; Williams, MA; Wu, H; Zhang, L; Chen, X; Escarpe, PA; Mendel, DB; Laver, WG; Stevens, RC 7/2/1998 7/5/2005 Gilead Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=4981 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=753&target=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=4981&enzyme=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search 480256 8034620 1 MNPNQKIITIGSICLVVGLISLILQIGNIISIWISHSIQTGSQNHTGICNQNIITYKNSTWVKDTTSVILTGNSSLCPIRGWAIYSKDNSIRIGSKGDVFVIREPFISCSHLECRTFFLTQGALLNDKHSNGTVKDRSPYRALMSCPVGEAPSPYNSRFESVAWSASACHDGMGWLTIGISGPDNGAVAVLKYNGIITETIKSWRKKILRTQESECACVNGSCFTIMTDGPSDGLASYKIFKIEKGKVTKSIELNAPNSHYEECSCYPDTGKVMCVCRDNWHGSNRPWVSFDQNLDYQIGYICSGVFGDNPRPEDGTGSCGPVYVDGANGVKGFSYRYGNGVWIGRTKSHSSRHGFEMIWDPNGWTETDSKFSVRQDVVAMTDWSGYSGSFVQHPELTGLDCMRPCFWVELIRGRPKEKTIWTSASSISFCGVNSDTVDWSWPDGAELPFSIDK 9GQT,9GQQ Neuraminidase NRAM_I34A1 P03468 A4GXH6 Q20N35 Q84043 Q8JUU4 7808 CCO[C@@H]1C=C(C[C@H](N)[C@H]1NC(C)=O)C(O)=O |r,c:4| InChI=1S/C11H18N2O4/c1-3-17-9-5-7(11(15)16)4-8(12)10(9)13-6(2)14/h5,8-10H,3-4,12H2,1-2H3,(H,13,14)(H,15,16) YUHQWGSXKIGZSX-UHFFFAOYSA-N 4982 CHEMBL309419::(3R,4R,5S)-5-amino-4-acetamido-3-ethoxycyclohex-1-ene-1-carboxylic acid::Carbocyclic Analogue 33 Neuraminidase Influenza A virus (strain A/Puerto Rico/8/1934 H1N1) 2000 6.5000 37.00 C Curated from the literature by BindingDB 10.1021/jm980162u 10.7270/Q2MP51GP 9651151 aid1795723 Kim, CU; Lew, W; Williams, MA; Wu, H; Zhang, L; Chen, X; Escarpe, PA; Mendel, DB; Laver, WG; Stevens, RC 7/2/1998 7/5/2005 Gilead Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=4982 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=753&target=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=4982&enzyme=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search 480257 8034621 CHEMBL309419 1 MNPNQKIITIGSICLVVGLISLILQIGNIISIWISHSIQTGSQNHTGICNQNIITYKNSTWVKDTTSVILTGNSSLCPIRGWAIYSKDNSIRIGSKGDVFVIREPFISCSHLECRTFFLTQGALLNDKHSNGTVKDRSPYRALMSCPVGEAPSPYNSRFESVAWSASACHDGMGWLTIGISGPDNGAVAVLKYNGIITETIKSWRKKILRTQESECACVNGSCFTIMTDGPSDGLASYKIFKIEKGKVTKSIELNAPNSHYEECSCYPDTGKVMCVCRDNWHGSNRPWVSFDQNLDYQIGYICSGVFGDNPRPEDGTGSCGPVYVDGANGVKGFSYRYGNGVWIGRTKSHSSRHGFEMIWDPNGWTETDSKFSVRQDVVAMTDWSGYSGSFVQHPELTGLDCMRPCFWVELIRGRPKEKTIWTSASSISFCGVNSDTVDWSWPDGAELPFSIDK 9GQT,9GQQ Neuraminidase NRAM_I34A1 P03468 A4GXH6 Q20N35 Q84043 Q8JUU4 7809 CCCO[C@@H]1C=C(C[C@H](N)[C@H]1NC(C)=O)C(O)=O |r,c:5| InChI=1S/C12H20N2O4/c1-3-4-18-10-6-8(12(16)17)5-9(13)11(10)14-7(2)15/h6,9-11H,3-5,13H2,1-2H3,(H,14,15)(H,16,17) UNJFVQQPDOQFDW-UHFFFAOYSA-N 4983 Carbocyclic Analogue 3::(3R,4R,5S)-5-amino-4-acetamido-3-propoxycyclohex-1-ene-1-carboxylic acid::Carbocyclic Analogue 34 Neuraminidase Influenza A virus (strain A/Puerto Rico/8/1934 H1N1) 180 6.5000 37.00 C Curated from the literature by BindingDB 10.1021/jm980162u 10.7270/Q2MP51GP 9651151 aid1795723 Kim, CU; Lew, W; Williams, MA; Wu, H; Zhang, L; Chen, X; Escarpe, PA; Mendel, DB; Laver, WG; Stevens, RC 7/2/1998 7/5/2005 Gilead Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=4983 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=753&target=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=4983&enzyme=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search 480258 8034622 1 MNPNQKIITIGSICLVVGLISLILQIGNIISIWISHSIQTGSQNHTGICNQNIITYKNSTWVKDTTSVILTGNSSLCPIRGWAIYSKDNSIRIGSKGDVFVIREPFISCSHLECRTFFLTQGALLNDKHSNGTVKDRSPYRALMSCPVGEAPSPYNSRFESVAWSASACHDGMGWLTIGISGPDNGAVAVLKYNGIITETIKSWRKKILRTQESECACVNGSCFTIMTDGPSDGLASYKIFKIEKGKVTKSIELNAPNSHYEECSCYPDTGKVMCVCRDNWHGSNRPWVSFDQNLDYQIGYICSGVFGDNPRPEDGTGSCGPVYVDGANGVKGFSYRYGNGVWIGRTKSHSSRHGFEMIWDPNGWTETDSKFSVRQDVVAMTDWSGYSGSFVQHPELTGLDCMRPCFWVELIRGRPKEKTIWTSASSISFCGVNSDTVDWSWPDGAELPFSIDK 9GQT,9GQQ Neuraminidase NRAM_I34A1 P03468 A4GXH6 Q20N35 Q84043 Q8JUU4 7810 CCCCO[C@@H]1C=C(C[C@H](N)[C@H]1NC(C)=O)C(O)=O |r,c:6| InChI=1S/C13H22N2O4/c1-3-4-5-19-11-7-9(13(17)18)6-10(14)12(11)15-8(2)16/h7,10-12H,3-6,14H2,1-2H3,(H,15,16)(H,17,18) OZPCIPJYBDQSKH-UHFFFAOYSA-N 4984 (3R,4R,5S)-5-amino-3-butoxy-4-acetamidocyclohex-1-ene-1-carboxylic acid::Carbocyclic Analogue 35 Neuraminidase Influenza A virus (strain A/Puerto Rico/8/1934 H1N1) 300 6.5000 37.00 C Curated from the literature by BindingDB 10.1021/jm980162u 10.7270/Q2MP51GP 9651151 aid1795723 Kim, CU; Lew, W; Williams, MA; Wu, H; Zhang, L; Chen, X; Escarpe, PA; Mendel, DB; Laver, WG; Stevens, RC 7/2/1998 7/5/2005 Gilead Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=4984 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=753&target=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=4984&enzyme=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search 480259 8034623 1 MNPNQKIITIGSICLVVGLISLILQIGNIISIWISHSIQTGSQNHTGICNQNIITYKNSTWVKDTTSVILTGNSSLCPIRGWAIYSKDNSIRIGSKGDVFVIREPFISCSHLECRTFFLTQGALLNDKHSNGTVKDRSPYRALMSCPVGEAPSPYNSRFESVAWSASACHDGMGWLTIGISGPDNGAVAVLKYNGIITETIKSWRKKILRTQESECACVNGSCFTIMTDGPSDGLASYKIFKIEKGKVTKSIELNAPNSHYEECSCYPDTGKVMCVCRDNWHGSNRPWVSFDQNLDYQIGYICSGVFGDNPRPEDGTGSCGPVYVDGANGVKGFSYRYGNGVWIGRTKSHSSRHGFEMIWDPNGWTETDSKFSVRQDVVAMTDWSGYSGSFVQHPELTGLDCMRPCFWVELIRGRPKEKTIWTSASSISFCGVNSDTVDWSWPDGAELPFSIDK 9GQT,9GQQ Neuraminidase NRAM_I34A1 P03468 A4GXH6 Q20N35 Q84043 Q8JUU4 7811 CCCCCO[C@@H]1C=C(C[C@H](N)[C@H]1NC(C)=O)C(O)=O |r,c:7| InChI=1S/C14H24N2O4/c1-3-4-5-6-20-12-8-10(14(18)19)7-11(15)13(12)16-9(2)17/h8,11-13H,3-7,15H2,1-2H3,(H,16,17)(H,18,19) QDTOXMHZBDQZIZ-UHFFFAOYSA-N 4985 (3R,4R,5S)-5-amino-4-acetamido-3-(pentyloxy)cyclohex-1-ene-1-carboxylic acid::Carbocyclic Analogue 36 Neuraminidase Influenza A virus (strain A/Puerto Rico/8/1934 H1N1) 200 6.5000 37.00 C Curated from the literature by BindingDB 10.1021/jm980162u 10.7270/Q2MP51GP 9651151 aid1795723 Kim, CU; Lew, W; Williams, MA; Wu, H; Zhang, L; Chen, X; Escarpe, PA; Mendel, DB; Laver, WG; Stevens, RC 7/2/1998 7/5/2005 Gilead Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=4985 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=753&target=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=4985&enzyme=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search 493852 8034624 1 MNPNQKIITIGSICLVVGLISLILQIGNIISIWISHSIQTGSQNHTGICNQNIITYKNSTWVKDTTSVILTGNSSLCPIRGWAIYSKDNSIRIGSKGDVFVIREPFISCSHLECRTFFLTQGALLNDKHSNGTVKDRSPYRALMSCPVGEAPSPYNSRFESVAWSASACHDGMGWLTIGISGPDNGAVAVLKYNGIITETIKSWRKKILRTQESECACVNGSCFTIMTDGPSDGLASYKIFKIEKGKVTKSIELNAPNSHYEECSCYPDTGKVMCVCRDNWHGSNRPWVSFDQNLDYQIGYICSGVFGDNPRPEDGTGSCGPVYVDGANGVKGFSYRYGNGVWIGRTKSHSSRHGFEMIWDPNGWTETDSKFSVRQDVVAMTDWSGYSGSFVQHPELTGLDCMRPCFWVELIRGRPKEKTIWTSASSISFCGVNSDTVDWSWPDGAELPFSIDK 9GQT,9GQQ Neuraminidase NRAM_I34A1 P03468 A4GXH6 Q20N35 Q84043 Q8JUU4 7812 CCCCCCO[C@@H]1C=C(C[C@H](N)[C@H]1NC(C)=O)C(O)=O |r,c:8| InChI=1S/C15H26N2O4/c1-3-4-5-6-7-21-13-9-11(15(19)20)8-12(16)14(13)17-10(2)18/h9,12-14H,3-8,16H2,1-2H3,(H,17,18)(H,19,20) YECXRZFUGGIMCT-UHFFFAOYSA-N 4986 (3R,4R,5S)-4-Acetamido-5-amino-3-(hexyloxy)-1-cyclohexene-1-carboxylic Acid::(3R,4R,5S)-5-amino-4-acetamido-3-(hexyloxy)cyclohex-1-ene-1-carboxylic acid::Carbocyclic Analogue 37 Neuraminidase Influenza A virus (strain A/Puerto Rico/8/1934 H1N1) 150 6.5000 37.00 C Curated from the literature by BindingDB 10.1021/jm980162u 10.7270/Q2MP51GP 9651151 aid1795723 Kim, CU; Lew, W; Williams, MA; Wu, H; Zhang, L; Chen, X; Escarpe, PA; Mendel, DB; Laver, WG; Stevens, RC 7/2/1998 7/5/2005 Gilead Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=4986 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=753&target=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=4986&enzyme=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search 493853 8034625 1 MNPNQKIITIGSICLVVGLISLILQIGNIISIWISHSIQTGSQNHTGICNQNIITYKNSTWVKDTTSVILTGNSSLCPIRGWAIYSKDNSIRIGSKGDVFVIREPFISCSHLECRTFFLTQGALLNDKHSNGTVKDRSPYRALMSCPVGEAPSPYNSRFESVAWSASACHDGMGWLTIGISGPDNGAVAVLKYNGIITETIKSWRKKILRTQESECACVNGSCFTIMTDGPSDGLASYKIFKIEKGKVTKSIELNAPNSHYEECSCYPDTGKVMCVCRDNWHGSNRPWVSFDQNLDYQIGYICSGVFGDNPRPEDGTGSCGPVYVDGANGVKGFSYRYGNGVWIGRTKSHSSRHGFEMIWDPNGWTETDSKFSVRQDVVAMTDWSGYSGSFVQHPELTGLDCMRPCFWVELIRGRPKEKTIWTSASSISFCGVNSDTVDWSWPDGAELPFSIDK 9GQT,9GQQ Neuraminidase NRAM_I34A1 P03468 A4GXH6 Q20N35 Q84043 Q8JUU4 7813 CCCCCCCO[C@@H]1C=C(C[C@H](N)[C@H]1NC(C)=O)C(O)=O |r,c:9| InChI=1S/C16H28N2O4/c1-3-4-5-6-7-8-22-14-10-12(16(20)21)9-13(17)15(14)18-11(2)19/h10,13-15H,3-9,17H2,1-2H3,(H,18,19)(H,20,21) OBZAQDJURYQWDV-UHFFFAOYSA-N 4987 (3R,4R,5S)-5-amino-4-acetamido-3-(heptyloxy)cyclohex-1-ene-1-carboxylic acid::(3R,4R,5S)-4-Acetamido-5-amino-3-(heptyloxy)-1-cyclohexene-1-carboxylic Acid::Carbocyclic Analogue 38 Neuraminidase Influenza A virus (strain A/Puerto Rico/8/1934 H1N1) 270 6.5000 37.00 C Curated from the literature by BindingDB 10.1021/jm980162u 10.7270/Q2MP51GP 9651151 aid1795723 Kim, CU; Lew, W; Williams, MA; Wu, H; Zhang, L; Chen, X; Escarpe, PA; Mendel, DB; Laver, WG; Stevens, RC 7/2/1998 7/5/2005 Gilead Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=4987 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=753&target=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=4987&enzyme=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search 493854 8034626 1 MNPNQKIITIGSICLVVGLISLILQIGNIISIWISHSIQTGSQNHTGICNQNIITYKNSTWVKDTTSVILTGNSSLCPIRGWAIYSKDNSIRIGSKGDVFVIREPFISCSHLECRTFFLTQGALLNDKHSNGTVKDRSPYRALMSCPVGEAPSPYNSRFESVAWSASACHDGMGWLTIGISGPDNGAVAVLKYNGIITETIKSWRKKILRTQESECACVNGSCFTIMTDGPSDGLASYKIFKIEKGKVTKSIELNAPNSHYEECSCYPDTGKVMCVCRDNWHGSNRPWVSFDQNLDYQIGYICSGVFGDNPRPEDGTGSCGPVYVDGANGVKGFSYRYGNGVWIGRTKSHSSRHGFEMIWDPNGWTETDSKFSVRQDVVAMTDWSGYSGSFVQHPELTGLDCMRPCFWVELIRGRPKEKTIWTSASSISFCGVNSDTVDWSWPDGAELPFSIDK 9GQT,9GQQ Neuraminidase NRAM_I34A1 P03468 A4GXH6 Q20N35 Q84043 Q8JUU4 7814 CCCCCCCCO[C@@H]1C=C(C[C@H](N)[C@H]1NC(C)=O)C(O)=O |r,c:10| InChI=1S/C17H30N2O4/c1-3-4-5-6-7-8-9-23-15-11-13(17(21)22)10-14(18)16(15)19-12(2)20/h11,14-16H,3-10,18H2,1-2H3,(H,19,20)(H,21,22) QPGLIZFPRZQICS-UHFFFAOYSA-N 4988 (3R,4R,5S)-5-amino-4-acetamido-3-(octyloxy)cyclohex-1-ene-1-carboxylic acid::(3R,4R,5S)-4-Acetamido-5-amino-3-(octyloxy)-1-cyclohexene-1-carboxylic Acid::Carbocyclic Analogue 39 Neuraminidase Influenza A virus (strain A/Puerto Rico/8/1934 H1N1) 180 6.5000 37.00 C Curated from the literature by BindingDB 10.1021/jm980162u 10.7270/Q2MP51GP 9651151 aid1795723 Kim, CU; Lew, W; Williams, MA; Wu, H; Zhang, L; Chen, X; Escarpe, PA; Mendel, DB; Laver, WG; Stevens, RC 7/2/1998 7/5/2005 Gilead Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=4988 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=753&target=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=4988&enzyme=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search 493855 8034627 1 MNPNQKIITIGSICLVVGLISLILQIGNIISIWISHSIQTGSQNHTGICNQNIITYKNSTWVKDTTSVILTGNSSLCPIRGWAIYSKDNSIRIGSKGDVFVIREPFISCSHLECRTFFLTQGALLNDKHSNGTVKDRSPYRALMSCPVGEAPSPYNSRFESVAWSASACHDGMGWLTIGISGPDNGAVAVLKYNGIITETIKSWRKKILRTQESECACVNGSCFTIMTDGPSDGLASYKIFKIEKGKVTKSIELNAPNSHYEECSCYPDTGKVMCVCRDNWHGSNRPWVSFDQNLDYQIGYICSGVFGDNPRPEDGTGSCGPVYVDGANGVKGFSYRYGNGVWIGRTKSHSSRHGFEMIWDPNGWTETDSKFSVRQDVVAMTDWSGYSGSFVQHPELTGLDCMRPCFWVELIRGRPKEKTIWTSASSISFCGVNSDTVDWSWPDGAELPFSIDK 9GQT,9GQQ Neuraminidase NRAM_I34A1 P03468 A4GXH6 Q20N35 Q84043 Q8JUU4 7815 CCCCCCCCCO[C@@H]1C=C(C[C@H](N)[C@H]1NC(C)=O)C(O)=O |r,c:11| InChI=1S/C18H32N2O4/c1-3-4-5-6-7-8-9-10-24-16-12-14(18(22)23)11-15(19)17(16)20-13(2)21/h12,15-17H,3-11,19H2,1-2H3,(H,20,21)(H,22,23) QYNCJYWGTMZSNV-UHFFFAOYSA-N 4989 (3R,4R,5S)-5-amino-4-acetamido-3-(nonyloxy)cyclohex-1-ene-1-carboxylic acid::(3R,4R,5S)-4-Acetamido-5-amino-3-(nonyloxy)-1-cyclohexene-1-carboxylic Acid::Carbocyclic Analogue 40 Neuraminidase Influenza A virus (strain A/Puerto Rico/8/1934 H1N1) 210 6.5000 37.00 C Curated from the literature by BindingDB 10.1021/jm980162u 10.7270/Q2MP51GP 9651151 aid1795723 Kim, CU; Lew, W; Williams, MA; Wu, H; Zhang, L; Chen, X; Escarpe, PA; Mendel, DB; Laver, WG; Stevens, RC 7/2/1998 7/5/2005 Gilead Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=4989 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=753&target=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=4989&enzyme=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search 493856 8034628 1 MNPNQKIITIGSICLVVGLISLILQIGNIISIWISHSIQTGSQNHTGICNQNIITYKNSTWVKDTTSVILTGNSSLCPIRGWAIYSKDNSIRIGSKGDVFVIREPFISCSHLECRTFFLTQGALLNDKHSNGTVKDRSPYRALMSCPVGEAPSPYNSRFESVAWSASACHDGMGWLTIGISGPDNGAVAVLKYNGIITETIKSWRKKILRTQESECACVNGSCFTIMTDGPSDGLASYKIFKIEKGKVTKSIELNAPNSHYEECSCYPDTGKVMCVCRDNWHGSNRPWVSFDQNLDYQIGYICSGVFGDNPRPEDGTGSCGPVYVDGANGVKGFSYRYGNGVWIGRTKSHSSRHGFEMIWDPNGWTETDSKFSVRQDVVAMTDWSGYSGSFVQHPELTGLDCMRPCFWVELIRGRPKEKTIWTSASSISFCGVNSDTVDWSWPDGAELPFSIDK 9GQT,9GQQ Neuraminidase NRAM_I34A1 P03468 A4GXH6 Q20N35 Q84043 Q8JUU4 7816 CCCCCCCCCCO[C@@H]1C=C(C[C@H](N)[C@H]1NC(C)=O)C(O)=O |r,c:12| InChI=1S/C19H34N2O4/c1-3-4-5-6-7-8-9-10-11-25-17-13-15(19(23)24)12-16(20)18(17)21-14(2)22/h13,16-18H,3-12,20H2,1-2H3,(H,21,22)(H,23,24) VADZKAJAILWNSI-UHFFFAOYSA-N 4990 (3R,4R,5S)-4-Acetamido-5-amino-3-(decyloxy)-1-cyclohexene-1-carboxylic Acid::(3R,4R,5S)-5-amino-3-(decyloxy)-4-acetamidocyclohex-1-ene-1-carboxylic acid::Carbocyclic Analogue 41 Neuraminidase Influenza A virus (strain A/Puerto Rico/8/1934 H1N1) 600 6.5000 37.00 C Curated from the literature by BindingDB 10.1021/jm980162u 10.7270/Q2MP51GP 9651151 aid1795723 Kim, CU; Lew, W; Williams, MA; Wu, H; Zhang, L; Chen, X; Escarpe, PA; Mendel, DB; Laver, WG; Stevens, RC 7/2/1998 7/5/2005 Gilead Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=4990 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=753&target=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=4990&enzyme=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search 493857 8034629 1 MNPNQKIITIGSICLVVGLISLILQIGNIISIWISHSIQTGSQNHTGICNQNIITYKNSTWVKDTTSVILTGNSSLCPIRGWAIYSKDNSIRIGSKGDVFVIREPFISCSHLECRTFFLTQGALLNDKHSNGTVKDRSPYRALMSCPVGEAPSPYNSRFESVAWSASACHDGMGWLTIGISGPDNGAVAVLKYNGIITETIKSWRKKILRTQESECACVNGSCFTIMTDGPSDGLASYKIFKIEKGKVTKSIELNAPNSHYEECSCYPDTGKVMCVCRDNWHGSNRPWVSFDQNLDYQIGYICSGVFGDNPRPEDGTGSCGPVYVDGANGVKGFSYRYGNGVWIGRTKSHSSRHGFEMIWDPNGWTETDSKFSVRQDVVAMTDWSGYSGSFVQHPELTGLDCMRPCFWVELIRGRPKEKTIWTSASSISFCGVNSDTVDWSWPDGAELPFSIDK 9GQT,9GQQ Neuraminidase NRAM_I34A1 P03468 A4GXH6 Q20N35 Q84043 Q8JUU4 7817 CC(C)CO[C@@H]1C=C(C[C@H](N)[C@H]1NC(C)=O)C(O)=O |r,c:6| InChI=1S/C13H22N2O4/c1-7(2)6-19-11-5-9(13(17)18)4-10(14)12(11)15-8(3)16/h5,7,10-12H,4,6,14H2,1-3H3,(H,15,16)(H,17,18) HESMZQCHCXNOIK-UHFFFAOYSA-N 4991 (3R,4R,5S)-5-amino-4-acetamido-3-(2-methylpropoxy)cyclohex-1-ene-1-carboxylic acid::Carbocyclic Analogue 42 Neuraminidase Influenza A virus (strain A/Puerto Rico/8/1934 H1N1) 200 6.5000 37.00 C Curated from the literature by BindingDB 10.1021/jm980162u 10.7270/Q2MP51GP 9651151 aid1795723 Kim, CU; Lew, W; Williams, MA; Wu, H; Zhang, L; Chen, X; Escarpe, PA; Mendel, DB; Laver, WG; Stevens, RC 7/2/1998 7/5/2005 Gilead Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=4991 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=753&target=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=4991&enzyme=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search 480260 8034630 1 MNPNQKIITIGSICLVVGLISLILQIGNIISIWISHSIQTGSQNHTGICNQNIITYKNSTWVKDTTSVILTGNSSLCPIRGWAIYSKDNSIRIGSKGDVFVIREPFISCSHLECRTFFLTQGALLNDKHSNGTVKDRSPYRALMSCPVGEAPSPYNSRFESVAWSASACHDGMGWLTIGISGPDNGAVAVLKYNGIITETIKSWRKKILRTQESECACVNGSCFTIMTDGPSDGLASYKIFKIEKGKVTKSIELNAPNSHYEECSCYPDTGKVMCVCRDNWHGSNRPWVSFDQNLDYQIGYICSGVFGDNPRPEDGTGSCGPVYVDGANGVKGFSYRYGNGVWIGRTKSHSSRHGFEMIWDPNGWTETDSKFSVRQDVVAMTDWSGYSGSFVQHPELTGLDCMRPCFWVELIRGRPKEKTIWTSASSISFCGVNSDTVDWSWPDGAELPFSIDK 9GQT,9GQQ Neuraminidase NRAM_I34A1 P03468 A4GXH6 Q20N35 Q84043 Q8JUU4 7818 CC[C@@H](C)O[C@@H]1C=C(C[C@H](N)[C@H]1NC(C)=O)C(O)=O |r,c:6| InChI=1S/C13H22N2O4/c1-4-7(2)19-11-6-9(13(17)18)5-10(14)12(11)15-8(3)16/h6-7,10-12H,4-5,14H2,1-3H3,(H,15,16)(H,17,18) SNPFQPYAZIIERE-UHFFFAOYSA-N 4992 (3R,4R,5S)-5-amino-3-[(2R)-butan-2-yloxy]-4-acetamidocyclohex-1-ene-1-carboxylic acid::Carbocyclic Analogue 43 Neuraminidase Influenza A virus (strain A/Puerto Rico/8/1934 H1N1) 10 6.5000 37.00 C Curated from the literature by BindingDB 10.1021/jm980162u 10.7270/Q2MP51GP 9651151 aid1795723 Kim, CU; Lew, W; Williams, MA; Wu, H; Zhang, L; Chen, X; Escarpe, PA; Mendel, DB; Laver, WG; Stevens, RC 7/2/1998 7/5/2005 Gilead Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=4992 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=753&target=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=4992&enzyme=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search 480261 8034631 1 MNPNQKIITIGSICLVVGLISLILQIGNIISIWISHSIQTGSQNHTGICNQNIITYKNSTWVKDTTSVILTGNSSLCPIRGWAIYSKDNSIRIGSKGDVFVIREPFISCSHLECRTFFLTQGALLNDKHSNGTVKDRSPYRALMSCPVGEAPSPYNSRFESVAWSASACHDGMGWLTIGISGPDNGAVAVLKYNGIITETIKSWRKKILRTQESECACVNGSCFTIMTDGPSDGLASYKIFKIEKGKVTKSIELNAPNSHYEECSCYPDTGKVMCVCRDNWHGSNRPWVSFDQNLDYQIGYICSGVFGDNPRPEDGTGSCGPVYVDGANGVKGFSYRYGNGVWIGRTKSHSSRHGFEMIWDPNGWTETDSKFSVRQDVVAMTDWSGYSGSFVQHPELTGLDCMRPCFWVELIRGRPKEKTIWTSASSISFCGVNSDTVDWSWPDGAELPFSIDK 9GQT,9GQQ Neuraminidase NRAM_I34A1 P03468 A4GXH6 Q20N35 Q84043 Q8JUU4 7824 CC[C@H](C)O[C@@H]1C=C(C[C@H](N)[C@H]1NC(C)=O)C(O)=O |r,c:6| InChI=1S/C13H22N2O4/c1-4-7(2)19-11-6-9(13(17)18)5-10(14)12(11)15-8(3)16/h6-7,10-12H,4-5,14H2,1-3H3,(H,15,16)(H,17,18) SNPFQPYAZIIERE-UHFFFAOYSA-N 4993 (3R,4R,5S)-5-amino-3-[(2S)-butan-2-yloxy]-4-acetamidocyclohex-1-ene-1-carboxylic acid::Carbocyclic Analogue 44 Neuraminidase Influenza A virus (strain A/Puerto Rico/8/1934 H1N1) 9 Curated from the literature by BindingDB 10.1021/jm980162u 10.7270/Q2MP51GP 9651151 aid1795723 Kim, CU; Lew, W; Williams, MA; Wu, H; Zhang, L; Chen, X; Escarpe, PA; Mendel, DB; Laver, WG; Stevens, RC 7/2/1998 7/5/2005 Gilead Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=4993 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=753&target=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=4993&enzyme=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search 480300 8034632 1 MNPNQKIITIGSICLVVGLISLILQIGNIISIWISHSIQTGSQNHTGICNQNIITYKNSTWVKDTTSVILTGNSSLCPIRGWAIYSKDNSIRIGSKGDVFVIREPFISCSHLECRTFFLTQGALLNDKHSNGTVKDRSPYRALMSCPVGEAPSPYNSRFESVAWSASACHDGMGWLTIGISGPDNGAVAVLKYNGIITETIKSWRKKILRTQESECACVNGSCFTIMTDGPSDGLASYKIFKIEKGKVTKSIELNAPNSHYEECSCYPDTGKVMCVCRDNWHGSNRPWVSFDQNLDYQIGYICSGVFGDNPRPEDGTGSCGPVYVDGANGVKGFSYRYGNGVWIGRTKSHSSRHGFEMIWDPNGWTETDSKFSVRQDVVAMTDWSGYSGSFVQHPELTGLDCMRPCFWVELIRGRPKEKTIWTSASSISFCGVNSDTVDWSWPDGAELPFSIDK 9GQT,9GQQ Neuraminidase NRAM_I34A1 P03468 A4GXH6 Q20N35 Q84043 Q8JUU4 7825 CCC(CC)O[C@@H]1C=C(C[C@H](N)[C@H]1NC(C)=O)C(O)=O |r,c:7| InChI=1S/C14H24N2O4/c1-4-10(5-2)20-12-7-9(14(18)19)6-11(15)13(12)16-8(3)17/h7,10-13H,4-6,15H2,1-3H3,(H,16,17)(H,18,19) NENPYTRHICXVCS-UHFFFAOYSA-N 4994 CHEMBL674::(3R,4R,5S)-5-amino-4-acetamido-3-(pentan-3-yloxy)cyclohex-1-ene-1-carboxylic acid::GS4071::Oseltamivir carboxylate Neuraminidase Influenza A virus (strain A/Puerto Rico/8/1934 H1N1) 1 Curated from the literature by BindingDB 10.1021/jm980162u 10.7270/Q2MP51GP 9651151 aid1795723 Kim, CU; Lew, W; Williams, MA; Wu, H; Zhang, L; Chen, X; Escarpe, PA; Mendel, DB; Laver, WG; Stevens, RC 7/2/1998 7/5/2005 Gilead Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=4994 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=753&target=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=4994&enzyme=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search 449381 8034633 CHEMBL674 1 MNPNQKIITIGSICLVVGLISLILQIGNIISIWISHSIQTGSQNHTGICNQNIITYKNSTWVKDTTSVILTGNSSLCPIRGWAIYSKDNSIRIGSKGDVFVIREPFISCSHLECRTFFLTQGALLNDKHSNGTVKDRSPYRALMSCPVGEAPSPYNSRFESVAWSASACHDGMGWLTIGISGPDNGAVAVLKYNGIITETIKSWRKKILRTQESECACVNGSCFTIMTDGPSDGLASYKIFKIEKGKVTKSIELNAPNSHYEECSCYPDTGKVMCVCRDNWHGSNRPWVSFDQNLDYQIGYICSGVFGDNPRPEDGTGSCGPVYVDGANGVKGFSYRYGNGVWIGRTKSHSSRHGFEMIWDPNGWTETDSKFSVRQDVVAMTDWSGYSGSFVQHPELTGLDCMRPCFWVELIRGRPKEKTIWTSASSISFCGVNSDTVDWSWPDGAELPFSIDK 9GQT,9GQQ Neuraminidase NRAM_I34A1 P03468 A4GXH6 Q20N35 Q84043 Q8JUU4 7826 CC[C@@H](CC=C)O[C@@H]1C=C(C[C@H](N)[C@H]1NC(C)=O)C(O)=O |r,c:8| InChI=1S/C15H24N2O4/c1-4-6-11(5-2)21-13-8-10(15(19)20)7-12(16)14(13)17-9(3)18/h4,8,11-14H,1,5-7,16H2,2-3H3,(H,17,18)(H,19,20) HQIVDWCSVLHHIC-UHFFFAOYSA-N 4995 (3R,4R,5S)-4-Acetamido-5-amino-3-[[(1S)-1-ethylbut-3-enyl]oxy]-1-cyclohexene-1-carboxylic Acid::(3R,4R,5S)-5-amino-4-acetamido-3-[(3S)-hex-5-en-3-yloxy]cyclohex-1-ene-1-carboxylic acid::Carbocyclic Analogue 45 Neuraminidase Influenza A virus (strain A/Puerto Rico/8/1934 H1N1) 1 Curated from the literature by BindingDB 10.1021/jm980162u 10.7270/Q2MP51GP 9651151 aid1795723 Kim, CU; Lew, W; Williams, MA; Wu, H; Zhang, L; Chen, X; Escarpe, PA; Mendel, DB; Laver, WG; Stevens, RC 7/2/1998 7/5/2005 Gilead Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=4995 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=753&target=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=4995&enzyme=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search 493859 8034634 1 MNPNQKIITIGSICLVVGLISLILQIGNIISIWISHSIQTGSQNHTGICNQNIITYKNSTWVKDTTSVILTGNSSLCPIRGWAIYSKDNSIRIGSKGDVFVIREPFISCSHLECRTFFLTQGALLNDKHSNGTVKDRSPYRALMSCPVGEAPSPYNSRFESVAWSASACHDGMGWLTIGISGPDNGAVAVLKYNGIITETIKSWRKKILRTQESECACVNGSCFTIMTDGPSDGLASYKIFKIEKGKVTKSIELNAPNSHYEECSCYPDTGKVMCVCRDNWHGSNRPWVSFDQNLDYQIGYICSGVFGDNPRPEDGTGSCGPVYVDGANGVKGFSYRYGNGVWIGRTKSHSSRHGFEMIWDPNGWTETDSKFSVRQDVVAMTDWSGYSGSFVQHPELTGLDCMRPCFWVELIRGRPKEKTIWTSASSISFCGVNSDTVDWSWPDGAELPFSIDK 9GQT,9GQQ Neuraminidase NRAM_I34A1 P03468 A4GXH6 Q20N35 Q84043 Q8JUU4 7827 CC[C@H](CC=C)O[C@@H]1C=C(C[C@H](N)[C@H]1NC(C)=O)C(O)=O |r,c:8| InChI=1S/C15H24N2O4/c1-4-6-11(5-2)21-13-8-10(15(19)20)7-12(16)14(13)17-9(3)18/h4,8,11-14H,1,5-7,16H2,2-3H3,(H,17,18)(H,19,20) HQIVDWCSVLHHIC-UHFFFAOYSA-N 4996 (3R,4R,5S)-4-Acetamido-5-amino-3-[[(1R)-1-ethylbut-3-enyl]oxy]-1-cyclohexene-1-carboxylic Acid::(3R,4R,5S)-5-amino-4-acetamido-3-[(3R)-hex-5-en-3-yloxy]cyclohex-1-ene-1-carboxylic acid::Carbocyclic Analogue 46 Neuraminidase Influenza A virus (strain A/Puerto Rico/8/1934 H1N1) 3 Curated from the literature by BindingDB 10.1021/jm980162u 10.7270/Q2MP51GP 9651151 aid1795723 Kim, CU; Lew, W; Williams, MA; Wu, H; Zhang, L; Chen, X; Escarpe, PA; Mendel, DB; Laver, WG; Stevens, RC 7/2/1998 7/5/2005 Gilead Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=4996 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=753&target=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=4996&enzyme=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search 493858 8034635 1 MNPNQKIITIGSICLVVGLISLILQIGNIISIWISHSIQTGSQNHTGICNQNIITYKNSTWVKDTTSVILTGNSSLCPIRGWAIYSKDNSIRIGSKGDVFVIREPFISCSHLECRTFFLTQGALLNDKHSNGTVKDRSPYRALMSCPVGEAPSPYNSRFESVAWSASACHDGMGWLTIGISGPDNGAVAVLKYNGIITETIKSWRKKILRTQESECACVNGSCFTIMTDGPSDGLASYKIFKIEKGKVTKSIELNAPNSHYEECSCYPDTGKVMCVCRDNWHGSNRPWVSFDQNLDYQIGYICSGVFGDNPRPEDGTGSCGPVYVDGANGVKGFSYRYGNGVWIGRTKSHSSRHGFEMIWDPNGWTETDSKFSVRQDVVAMTDWSGYSGSFVQHPELTGLDCMRPCFWVELIRGRPKEKTIWTSASSISFCGVNSDTVDWSWPDGAELPFSIDK 9GQT,9GQQ Neuraminidase NRAM_I34A1 P03468 A4GXH6 Q20N35 Q84043 Q8JUU4 7828 CCCCCCC[C@H](CC)O[C@@H]1C=C(C[C@H](N)[C@H]1NC(C)=O)C(O)=O |r,c:12| InChI=1S/C19H34N2O4/c1-4-6-7-8-9-10-15(5-2)25-17-12-14(19(23)24)11-16(20)18(17)21-13(3)22/h12,15-18H,4-11,20H2,1-3H3,(H,21,22)(H,23,24) XJOGOXCVUUHNTA-UHFFFAOYSA-N 4997 (3R,4R,5S)-5-amino-3-[(3S)-decan-3-yloxy]-4-acetamidocyclohex-1-ene-1-carboxylic acid::(3R,4R,5S)-4-Acetamido-5-amino-3-[(3S)-decyloxy]-1-cyclohexene-1-carboxylic Acid::Carbocyclic Analogue 47 Neuraminidase Influenza A virus (strain A/Puerto Rico/8/1934 H1N1) 1 Curated from the literature by BindingDB 10.1021/jm980162u 10.7270/Q2MP51GP 9651151 aid1795723 Kim, CU; Lew, W; Williams, MA; Wu, H; Zhang, L; Chen, X; Escarpe, PA; Mendel, DB; Laver, WG; Stevens, RC 7/2/1998 7/5/2005 Gilead Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=4997 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=753&target=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=4997&enzyme=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search 493860 8034636 1 MNPNQKIITIGSICLVVGLISLILQIGNIISIWISHSIQTGSQNHTGICNQNIITYKNSTWVKDTTSVILTGNSSLCPIRGWAIYSKDNSIRIGSKGDVFVIREPFISCSHLECRTFFLTQGALLNDKHSNGTVKDRSPYRALMSCPVGEAPSPYNSRFESVAWSASACHDGMGWLTIGISGPDNGAVAVLKYNGIITETIKSWRKKILRTQESECACVNGSCFTIMTDGPSDGLASYKIFKIEKGKVTKSIELNAPNSHYEECSCYPDTGKVMCVCRDNWHGSNRPWVSFDQNLDYQIGYICSGVFGDNPRPEDGTGSCGPVYVDGANGVKGFSYRYGNGVWIGRTKSHSSRHGFEMIWDPNGWTETDSKFSVRQDVVAMTDWSGYSGSFVQHPELTGLDCMRPCFWVELIRGRPKEKTIWTSASSISFCGVNSDTVDWSWPDGAELPFSIDK 9GQT,9GQQ Neuraminidase NRAM_I34A1 P03468 A4GXH6 Q20N35 Q84043 Q8JUU4 7829 CC(=O)N[C@@H]1[C@@H](N)CC(=C[C@H]1OC1CCCCC1)C(O)=O |r,c:8| InChI=1S/C15H24N2O4/c1-9(18)17-14-12(16)7-10(15(19)20)8-13(14)21-11-5-3-2-4-6-11/h8,11-14H,2-7,16H2,1H3,(H,17,18)(H,19,20) GRDCBQGRBJQGMO-UHFFFAOYSA-N 4998 carbocyclic analogue 8::(3R,4R,5S)-5-amino-3-(cyclohexyloxy)-4-acetamidocyclohex-1-ene-1-carboxylic acid::Carbocyclic Analogue 48 Neuraminidase Influenza A virus (strain A/Puerto Rico/8/1934 H1N1) 60 Curated from the literature by BindingDB 10.1021/jm980162u 10.7270/Q2MP51GP 9651151 aid1795723 Kim, CU; Lew, W; Williams, MA; Wu, H; Zhang, L; Chen, X; Escarpe, PA; Mendel, DB; Laver, WG; Stevens, RC 7/2/1998 7/5/2005 Gilead Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=4998 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=753&target=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=4998&enzyme=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search 493861 8034637 1 MNPNQKIITIGSICLVVGLISLILQIGNIISIWISHSIQTGSQNHTGICNQNIITYKNSTWVKDTTSVILTGNSSLCPIRGWAIYSKDNSIRIGSKGDVFVIREPFISCSHLECRTFFLTQGALLNDKHSNGTVKDRSPYRALMSCPVGEAPSPYNSRFESVAWSASACHDGMGWLTIGISGPDNGAVAVLKYNGIITETIKSWRKKILRTQESECACVNGSCFTIMTDGPSDGLASYKIFKIEKGKVTKSIELNAPNSHYEECSCYPDTGKVMCVCRDNWHGSNRPWVSFDQNLDYQIGYICSGVFGDNPRPEDGTGSCGPVYVDGANGVKGFSYRYGNGVWIGRTKSHSSRHGFEMIWDPNGWTETDSKFSVRQDVVAMTDWSGYSGSFVQHPELTGLDCMRPCFWVELIRGRPKEKTIWTSASSISFCGVNSDTVDWSWPDGAELPFSIDK 9GQT,9GQQ Neuraminidase NRAM_I34A1 P03468 A4GXH6 Q20N35 Q84043 Q8JUU4 7830 CC[C@@H](CC1CCCCC1)O[C@@H]1C=C(C[C@H](N)[C@H]1NC(C)=O)C(O)=O |r,c:13| InChI=1S/C19H32N2O4/c1-3-15(9-13-7-5-4-6-8-13)25-17-11-14(19(23)24)10-16(20)18(17)21-12(2)22/h11,13,15-18H,3-10,20H2,1-2H3,(H,21,22)(H,23,24) AQRGYVZHOSSLOY-UHFFFAOYSA-N 4999 (3R,4R,5S)-4-Acetamido-5-amino-3-(1(S)-(cyclohexylmethyl)propoxy)-1-cyclohexene-1-carboxylic Acid::(3R,4R,5S)-5-amino-3-{[(2S)-1-cyclohexylbutan-2-yl]oxy}-4-acetamidocyclohex-1-ene-1-carboxylic acid::Carbocyclic Analogue 49 Neuraminidase Influenza A virus (strain A/Puerto Rico/8/1934 H1N1) 16 Curated from the literature by BindingDB 10.1021/jm980162u 10.7270/Q2MP51GP 9651151 aid1795723 Kim, CU; Lew, W; Williams, MA; Wu, H; Zhang, L; Chen, X; Escarpe, PA; Mendel, DB; Laver, WG; Stevens, RC 7/2/1998 7/5/2005 Gilead Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=4999 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=753&target=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=4999&enzyme=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search 5464654 8034638 1 MNPNQKIITIGSICLVVGLISLILQIGNIISIWISHSIQTGSQNHTGICNQNIITYKNSTWVKDTTSVILTGNSSLCPIRGWAIYSKDNSIRIGSKGDVFVIREPFISCSHLECRTFFLTQGALLNDKHSNGTVKDRSPYRALMSCPVGEAPSPYNSRFESVAWSASACHDGMGWLTIGISGPDNGAVAVLKYNGIITETIKSWRKKILRTQESECACVNGSCFTIMTDGPSDGLASYKIFKIEKGKVTKSIELNAPNSHYEECSCYPDTGKVMCVCRDNWHGSNRPWVSFDQNLDYQIGYICSGVFGDNPRPEDGTGSCGPVYVDGANGVKGFSYRYGNGVWIGRTKSHSSRHGFEMIWDPNGWTETDSKFSVRQDVVAMTDWSGYSGSFVQHPELTGLDCMRPCFWVELIRGRPKEKTIWTSASSISFCGVNSDTVDWSWPDGAELPFSIDK 9GQT,9GQQ Neuraminidase NRAM_I34A1 P03468 A4GXH6 Q20N35 Q84043 Q8JUU4 7831 CC[C@@H](CCC1CCCCC1)O[C@@H]1C=C(C[C@H](N)[C@H]1NC(C)=O)C(O)=O |r,c:14| InChI=1S/C20H34N2O4/c1-3-16(10-9-14-7-5-4-6-8-14)26-18-12-15(20(24)25)11-17(21)19(18)22-13(2)23/h12,14,16-19H,3-11,21H2,1-2H3,(H,22,23)(H,24,25) WEUWRQVKQNNAEK-UHFFFAOYSA-N 5000 (3R,4R,5S)-4-Acetamido-5-amino-3-(1(S)-(2-cyclohexylethyl)propoxy)-1-cyclohexene-1-carboxylic Acid::(3R,4R,5S)-5-amino-3-{[(3S)-1-cyclohexylpentan-3-yl]oxy}-4-acetamidocyclohex-1-ene-1-carboxylic acid::Carbocyclic Analogue 50 Neuraminidase Influenza A virus (strain A/Puerto Rico/8/1934 H1N1) 1 Curated from the literature by BindingDB 10.1021/jm980162u 10.7270/Q2MP51GP 9651151 aid1795723 Kim, CU; Lew, W; Williams, MA; Wu, H; Zhang, L; Chen, X; Escarpe, PA; Mendel, DB; Laver, WG; Stevens, RC 7/2/1998 7/5/2005 Gilead Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=5000 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=753&target=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=5000&enzyme=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search 5464655 8034639 1 MNPNQKIITIGSICLVVGLISLILQIGNIISIWISHSIQTGSQNHTGICNQNIITYKNSTWVKDTTSVILTGNSSLCPIRGWAIYSKDNSIRIGSKGDVFVIREPFISCSHLECRTFFLTQGALLNDKHSNGTVKDRSPYRALMSCPVGEAPSPYNSRFESVAWSASACHDGMGWLTIGISGPDNGAVAVLKYNGIITETIKSWRKKILRTQESECACVNGSCFTIMTDGPSDGLASYKIFKIEKGKVTKSIELNAPNSHYEECSCYPDTGKVMCVCRDNWHGSNRPWVSFDQNLDYQIGYICSGVFGDNPRPEDGTGSCGPVYVDGANGVKGFSYRYGNGVWIGRTKSHSSRHGFEMIWDPNGWTETDSKFSVRQDVVAMTDWSGYSGSFVQHPELTGLDCMRPCFWVELIRGRPKEKTIWTSASSISFCGVNSDTVDWSWPDGAELPFSIDK 9GQT,9GQQ Neuraminidase NRAM_I34A1 P03468 A4GXH6 Q20N35 Q84043 Q8JUU4 7832 CC(=O)N[C@@H]1[C@@H](N)CC(=C[C@H]1Oc1ccccc1)C(O)=O |r,c:8| InChI=1S/C15H18N2O4/c1-9(18)17-14-12(16)7-10(15(19)20)8-13(14)21-11-5-3-2-4-6-11/h2-6,8,12-14H,7,16H2,1H3,(H,17,18)(H,19,20) DKWGERBFVMJXSN-UHFFFAOYSA-N 5001 (3R,4R,5S)-5-amino-4-acetamido-3-phenoxycyclohex-1-ene-1-carboxylic acid::carbocyclic analogue 9::Carbocyclic Analogue 51 Neuraminidase Influenza A virus (strain A/Puerto Rico/8/1934 H1N1) 530 Curated from the literature by BindingDB 10.1021/jm980162u 10.7270/Q2MP51GP 9651151 aid1795723 Kim, CU; Lew, W; Williams, MA; Wu, H; Zhang, L; Chen, X; Escarpe, PA; Mendel, DB; Laver, WG; Stevens, RC 7/2/1998 7/5/2005 Gilead Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=5001 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=753&target=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=5001&enzyme=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search 493864 8034640 1 MNPNQKIITIGSICLVVGLISLILQIGNIISIWISHSIQTGSQNHTGICNQNIITYKNSTWVKDTTSVILTGNSSLCPIRGWAIYSKDNSIRIGSKGDVFVIREPFISCSHLECRTFFLTQGALLNDKHSNGTVKDRSPYRALMSCPVGEAPSPYNSRFESVAWSASACHDGMGWLTIGISGPDNGAVAVLKYNGIITETIKSWRKKILRTQESECACVNGSCFTIMTDGPSDGLASYKIFKIEKGKVTKSIELNAPNSHYEECSCYPDTGKVMCVCRDNWHGSNRPWVSFDQNLDYQIGYICSGVFGDNPRPEDGTGSCGPVYVDGANGVKGFSYRYGNGVWIGRTKSHSSRHGFEMIWDPNGWTETDSKFSVRQDVVAMTDWSGYSGSFVQHPELTGLDCMRPCFWVELIRGRPKEKTIWTSASSISFCGVNSDTVDWSWPDGAELPFSIDK 9GQT,9GQQ Neuraminidase NRAM_I34A1 P03468 A4GXH6 Q20N35 Q84043 Q8JUU4 7833 CC(=O)N[C@@H]1[C@@H](N)CC(=C[C@H]1OCc1ccccc1)C(O)=O |r,c:8| InChI=1S/C16H20N2O4/c1-10(19)18-15-13(17)7-12(16(20)21)8-14(15)22-9-11-5-3-2-4-6-11/h2-6,8,13-15H,7,9,17H2,1H3,(H,18,19)(H,20,21) FBEKRJIKDMARPJ-UHFFFAOYSA-N 5002 (3R,4R,5S)-5-amino-3-(benzyloxy)-4-acetamidocyclohex-1-ene-1-carboxylic acid::Carbocyclic Analogue 52 Neuraminidase Influenza A virus (strain A/Puerto Rico/8/1934 H1N1) 620 Curated from the literature by BindingDB 10.1021/jm980162u 10.7270/Q2MP51GP 9651151 aid1795723 Kim, CU; Lew, W; Williams, MA; Wu, H; Zhang, L; Chen, X; Escarpe, PA; Mendel, DB; Laver, WG; Stevens, RC 7/2/1998 7/5/2005 Gilead Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=5002 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=753&target=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=5002&enzyme=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search 493865 8034641 1 MNPNQKIITIGSICLVVGLISLILQIGNIISIWISHSIQTGSQNHTGICNQNIITYKNSTWVKDTTSVILTGNSSLCPIRGWAIYSKDNSIRIGSKGDVFVIREPFISCSHLECRTFFLTQGALLNDKHSNGTVKDRSPYRALMSCPVGEAPSPYNSRFESVAWSASACHDGMGWLTIGISGPDNGAVAVLKYNGIITETIKSWRKKILRTQESECACVNGSCFTIMTDGPSDGLASYKIFKIEKGKVTKSIELNAPNSHYEECSCYPDTGKVMCVCRDNWHGSNRPWVSFDQNLDYQIGYICSGVFGDNPRPEDGTGSCGPVYVDGANGVKGFSYRYGNGVWIGRTKSHSSRHGFEMIWDPNGWTETDSKFSVRQDVVAMTDWSGYSGSFVQHPELTGLDCMRPCFWVELIRGRPKEKTIWTSASSISFCGVNSDTVDWSWPDGAELPFSIDK 9GQT,9GQQ Neuraminidase NRAM_I34A1 P03468 A4GXH6 Q20N35 Q84043 Q8JUU4 7842 CC[C@@H](CCc1ccccc1)O[C@@H]1C=C(C[C@H](N)[C@H]1NC(C)=O)C(O)=O |r,c:14| InChI=1S/C20H28N2O4/c1-3-16(10-9-14-7-5-4-6-8-14)26-18-12-15(20(24)25)11-17(21)19(18)22-13(2)23/h4-8,12,16-19H,3,9-11,21H2,1-2H3,(H,22,23)(H,24,25) GLTBEVKCDJQDEE-UHFFFAOYSA-N 5003 (3R,4R,5S)-5-amino-4-acetamido-3-{[(3S)-1-phenylpentan-3-yl]oxy}cyclohex-1-ene-1-carboxylic acid::Carbocyclic Analogue 53 Neuraminidase Influenza A virus (strain A/Puerto Rico/8/1934 H1N1) 0.3 Curated from the literature by BindingDB 10.1021/jm980162u 10.7270/Q2MP51GP 9651151 aid1795723 Kim, CU; Lew, W; Williams, MA; Wu, H; Zhang, L; Chen, X; Escarpe, PA; Mendel, DB; Laver, WG; Stevens, RC 7/2/1998 7/5/2005 Gilead Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=5003 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=753&target=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=5003&enzyme=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search 493867 8034642 1 MNPNQKIITIGSICLVVGLISLILQIGNIISIWISHSIQTGSQNHTGICNQNIITYKNSTWVKDTTSVILTGNSSLCPIRGWAIYSKDNSIRIGSKGDVFVIREPFISCSHLECRTFFLTQGALLNDKHSNGTVKDRSPYRALMSCPVGEAPSPYNSRFESVAWSASACHDGMGWLTIGISGPDNGAVAVLKYNGIITETIKSWRKKILRTQESECACVNGSCFTIMTDGPSDGLASYKIFKIEKGKVTKSIELNAPNSHYEECSCYPDTGKVMCVCRDNWHGSNRPWVSFDQNLDYQIGYICSGVFGDNPRPEDGTGSCGPVYVDGANGVKGFSYRYGNGVWIGRTKSHSSRHGFEMIWDPNGWTETDSKFSVRQDVVAMTDWSGYSGSFVQHPELTGLDCMRPCFWVELIRGRPKEKTIWTSASSISFCGVNSDTVDWSWPDGAELPFSIDK 9GQT,9GQQ Neuraminidase NRAM_I34A1 P03468 A4GXH6 Q20N35 Q84043 Q8JUU4 7843 CC[C@H](CCc1ccccc1)O[C@@H]1C=C(C[C@H](N)[C@H]1NC(C)=O)C(O)=O |r,c:14| InChI=1S/C20H28N2O4/c1-3-16(10-9-14-7-5-4-6-8-14)26-18-12-15(20(24)25)11-17(21)19(18)22-13(2)23/h4-8,12,16-19H,3,9-11,21H2,1-2H3,(H,22,23)(H,24,25) GLTBEVKCDJQDEE-UHFFFAOYSA-N 5004 (3R,4R,5S)-5-amino-4-acetamido-3-{[(3R)-1-phenylpentan-3-yl]oxy}cyclohex-1-ene-1-carboxylic acid::Carbocyclic Analogue 54 Neuraminidase Influenza A virus (strain A/Puerto Rico/8/1934 H1N1) 12 Curated from the literature by BindingDB 10.1021/jm980162u 10.7270/Q2MP51GP 9651151 aid1795723 Kim, CU; Lew, W; Williams, MA; Wu, H; Zhang, L; Chen, X; Escarpe, PA; Mendel, DB; Laver, WG; Stevens, RC 7/2/1998 7/5/2005 Gilead Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=5004 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=753&target=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=5004&enzyme=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search 493866 8034643 1 MNPNQKIITIGSICLVVGLISLILQIGNIISIWISHSIQTGSQNHTGICNQNIITYKNSTWVKDTTSVILTGNSSLCPIRGWAIYSKDNSIRIGSKGDVFVIREPFISCSHLECRTFFLTQGALLNDKHSNGTVKDRSPYRALMSCPVGEAPSPYNSRFESVAWSASACHDGMGWLTIGISGPDNGAVAVLKYNGIITETIKSWRKKILRTQESECACVNGSCFTIMTDGPSDGLASYKIFKIEKGKVTKSIELNAPNSHYEECSCYPDTGKVMCVCRDNWHGSNRPWVSFDQNLDYQIGYICSGVFGDNPRPEDGTGSCGPVYVDGANGVKGFSYRYGNGVWIGRTKSHSSRHGFEMIWDPNGWTETDSKFSVRQDVVAMTDWSGYSGSFVQHPELTGLDCMRPCFWVELIRGRPKEKTIWTSASSISFCGVNSDTVDWSWPDGAELPFSIDK 9GQT,9GQQ Neuraminidase NRAM_I34A1 P03468 A4GXH6 Q20N35 Q84043 Q8JUU4 7844 CC(=O)N[C@@H]1[C@@H](N)CC(=C[C@H]1OC(Cc1ccccc1)Cc1ccccc1)C(O)=O |r,c:8| InChI=1S/C24H28N2O4/c1-16(27)26-23-21(25)14-19(24(28)29)15-22(23)30-20(12-17-8-4-2-5-9-17)13-18-10-6-3-7-11-18/h2-11,15,20-23H,12-14,25H2,1H3,(H,26,27)(H,28,29) QSJHZDKKICVMRR-UHFFFAOYSA-N 5005 (3R,4R,5S)-4-Acetamido-5-amino-3-(bis(phenylmethyl)methoxy)-1-cyclohexene-1-carboxylic Acid Hydrochloride::(3R,4R,5S)-5-amino-3-[(1,3-diphenylpropan-2-yl)oxy]-4-acetamidocyclohex-1-ene-1-carboxylic acid::Carbocyclic Analogue 55 Neuraminidase Influenza A virus (strain A/Puerto Rico/8/1934 H1N1) >1000 Curated from the literature by BindingDB 10.1021/jm980162u 10.7270/Q2MP51GP 9651151 aid1795723 Kim, CU; Lew, W; Williams, MA; Wu, H; Zhang, L; Chen, X; Escarpe, PA; Mendel, DB; Laver, WG; Stevens, RC 7/2/1998 7/5/2005 Gilead Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=5005 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=753&target=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=5005&enzyme=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search 493868 8034644 1 MNPNQKIITIGSICLVVGLISLILQIGNIISIWISHSIQTGSQNHTGICNQNIITYKNSTWVKDTTSVILTGNSSLCPIRGWAIYSKDNSIRIGSKGDVFVIREPFISCSHLECRTFFLTQGALLNDKHSNGTVKDRSPYRALMSCPVGEAPSPYNSRFESVAWSASACHDGMGWLTIGISGPDNGAVAVLKYNGIITETIKSWRKKILRTQESECACVNGSCFTIMTDGPSDGLASYKIFKIEKGKVTKSIELNAPNSHYEECSCYPDTGKVMCVCRDNWHGSNRPWVSFDQNLDYQIGYICSGVFGDNPRPEDGTGSCGPVYVDGANGVKGFSYRYGNGVWIGRTKSHSSRHGFEMIWDPNGWTETDSKFSVRQDVVAMTDWSGYSGSFVQHPELTGLDCMRPCFWVELIRGRPKEKTIWTSASSISFCGVNSDTVDWSWPDGAELPFSIDK 9GQT,9GQQ Neuraminidase NRAM_I34A1 P03468 A4GXH6 Q20N35 Q84043 Q8JUU4 7845 CC(=O)N[C@@H]1[C@@H](N)CC(=C[C@H]1OC(CCCc1ccccc1)CCCc1ccccc1)C(O)=O |r,c:8| InChI=1S/C28H36N2O4/c1-20(31)30-27-25(29)18-23(28(32)33)19-26(27)34-24(16-8-14-21-10-4-2-5-11-21)17-9-15-22-12-6-3-7-13-22/h2-7,10-13,19,24-27H,8-9,14-18,29H2,1H3,(H,30,31)(H,32,33) TXVFAGMTJMJDMF-UHFFFAOYSA-N 5006 (3R,4R,5S)-4-Acetamido-5-amino-3-(bis(3-phenylpropyl)methoxy)-1-cyclohexene-1-carboxylic Acid::(3R,4R,5S)-5-amino-3-[(1,7-diphenylheptan-4-yl)oxy]-4-acetamidocyclohex-1-ene-1-carboxylic acid::Carbocyclic Analogue 56 Neuraminidase Influenza A virus (strain A/Puerto Rico/8/1934 H1N1) >1000 Curated from the literature by BindingDB 10.1021/jm980162u 10.7270/Q2MP51GP 9651151 aid1795723 Kim, CU; Lew, W; Williams, MA; Wu, H; Zhang, L; Chen, X; Escarpe, PA; Mendel, DB; Laver, WG; Stevens, RC 7/2/1998 7/5/2005 Gilead Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=5006 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=753&target=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=5006&enzyme=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search 493869 8034645 1 MNPNQKIITIGSICLVVGLISLILQIGNIISIWISHSIQTGSQNHTGICNQNIITYKNSTWVKDTTSVILTGNSSLCPIRGWAIYSKDNSIRIGSKGDVFVIREPFISCSHLECRTFFLTQGALLNDKHSNGTVKDRSPYRALMSCPVGEAPSPYNSRFESVAWSASACHDGMGWLTIGISGPDNGAVAVLKYNGIITETIKSWRKKILRTQESECACVNGSCFTIMTDGPSDGLASYKIFKIEKGKVTKSIELNAPNSHYEECSCYPDTGKVMCVCRDNWHGSNRPWVSFDQNLDYQIGYICSGVFGDNPRPEDGTGSCGPVYVDGANGVKGFSYRYGNGVWIGRTKSHSSRHGFEMIWDPNGWTETDSKFSVRQDVVAMTDWSGYSGSFVQHPELTGLDCMRPCFWVELIRGRPKEKTIWTSASSISFCGVNSDTVDWSWPDGAELPFSIDK 9GQT,9GQQ Neuraminidase NRAM_I34A1 P03468 A4GXH6 Q20N35 Q84043 Q8JUU4 7846 CC(=O)N[C@@H]1[C@@H](N)CC(=C[C@H]1OCCCc1ccc(cc1)-c1ccccc1)C(O)=O |r,c:8| InChI=1S/C24H28N2O4/c1-16(27)26-23-21(25)14-20(24(28)29)15-22(23)30-13-5-6-17-9-11-19(12-10-17)18-7-3-2-4-8-18/h2-4,7-12,15,21-23H,5-6,13-14,25H2,1H3,(H,26,27)(H,28,29) WLWJACADVNSTQF-UHFFFAOYSA-N 5007 (3R,4R,5S)-5-amino-4-acetamido-3-[3-(4-phenylphenyl)propoxy]cyclohex-1-ene-1-carboxylic acid::(3R,4R,5S)-4-Acetamido-5-amino-3-(3-biphenylylpropoxy)-1-cyclohexene-1-carboxylic Acid::Carbocyclic Analogue 57 Neuraminidase Influenza A virus (strain A/Puerto Rico/8/1934 H1N1) 90 Curated from the literature by BindingDB 10.1021/jm980162u 10.7270/Q2MP51GP 9651151 aid1795723 Kim, CU; Lew, W; Williams, MA; Wu, H; Zhang, L; Chen, X; Escarpe, PA; Mendel, DB; Laver, WG; Stevens, RC 7/2/1998 7/5/2005 Gilead Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=5007 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=753&target=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=5007&enzyme=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search 493870 8034646 1 MNPNQKIITIGSICLVVGLISLILQIGNIISIWISHSIQTGSQNHTGICNQNIITYKNSTWVKDTTSVILTGNSSLCPIRGWAIYSKDNSIRIGSKGDVFVIREPFISCSHLECRTFFLTQGALLNDKHSNGTVKDRSPYRALMSCPVGEAPSPYNSRFESVAWSASACHDGMGWLTIGISGPDNGAVAVLKYNGIITETIKSWRKKILRTQESECACVNGSCFTIMTDGPSDGLASYKIFKIEKGKVTKSIELNAPNSHYEECSCYPDTGKVMCVCRDNWHGSNRPWVSFDQNLDYQIGYICSGVFGDNPRPEDGTGSCGPVYVDGANGVKGFSYRYGNGVWIGRTKSHSSRHGFEMIWDPNGWTETDSKFSVRQDVVAMTDWSGYSGSFVQHPELTGLDCMRPCFWVELIRGRPKEKTIWTSASSISFCGVNSDTVDWSWPDGAELPFSIDK 9GQT,9GQQ Neuraminidase NRAM_I34A1 P03468 A4GXH6 Q20N35 Q84043 Q8JUU4 7847 CC(=O)N[C@H]1[C@H](O)C=C(C[C@@H]1N=C(N)N)C(O)=O |r,c:7| InChI=1S/C10H16N4O4/c1-4(15)13-8-6(14-10(11)12)2-5(9(17)18)3-7(8)16/h3,6-8,16H,2H2,1H3,(H,13,15)(H,17,18)(H4,11,12,14) DLBPVPLABVAVJF-UHFFFAOYSA-N 5008 (3R,4R,5S)-5-carbamimidamido-4-acetamido-3-hydroxycyclohex-1-ene-1-carboxylic acid::Carbocyclic Analogue 58 Neuraminidase Influenza A virus (strain A/Puerto Rico/8/1934 H1N1) 100 Curated from the literature by BindingDB 10.1021/jm980162u 10.7270/Q2MP51GP 9651151 aid1795723 Kim, CU; Lew, W; Williams, MA; Wu, H; Zhang, L; Chen, X; Escarpe, PA; Mendel, DB; Laver, WG; Stevens, RC 7/2/1998 7/5/2005 Gilead Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=5008 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=753&target=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=5008&enzyme=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search 493871 8034647 1 MNPNQKIITIGSICLVVGLISLILQIGNIISIWISHSIQTGSQNHTGICNQNIITYKNSTWVKDTTSVILTGNSSLCPIRGWAIYSKDNSIRIGSKGDVFVIREPFISCSHLECRTFFLTQGALLNDKHSNGTVKDRSPYRALMSCPVGEAPSPYNSRFESVAWSASACHDGMGWLTIGISGPDNGAVAVLKYNGIITETIKSWRKKILRTQESECACVNGSCFTIMTDGPSDGLASYKIFKIEKGKVTKSIELNAPNSHYEECSCYPDTGKVMCVCRDNWHGSNRPWVSFDQNLDYQIGYICSGVFGDNPRPEDGTGSCGPVYVDGANGVKGFSYRYGNGVWIGRTKSHSSRHGFEMIWDPNGWTETDSKFSVRQDVVAMTDWSGYSGSFVQHPELTGLDCMRPCFWVELIRGRPKEKTIWTSASSISFCGVNSDTVDWSWPDGAELPFSIDK 9GQT,9GQQ Neuraminidase NRAM_I34A1 P03468 A4GXH6 Q20N35 Q84043 Q8JUU4 7848 CCCO[C@@H]1C=C(C[C@H](N=C(N)N)[C@H]1NC(C)=O)C(O)=O |r,c:5| InChI=1S/C13H22N4O4/c1-3-4-21-10-6-8(12(19)20)5-9(17-13(14)15)11(10)16-7(2)18/h6,9-11H,3-5H2,1-2H3,(H,16,18)(H,19,20)(H4,14,15,17) JPGVNBPJSYNZSP-UHFFFAOYSA-N 5009 carbocyclic analogue 18::(3R,4R,5S)-5-carbamimidamido-4-acetamido-3-propoxycyclohex-1-ene-1-carboxylic acid::(3R,4R,5S)-4-Acetamido-5-guanidinyl-3-propoxy-1-cyclohexene-1-carboxylic Acid::Carbocyclic Analogue 59 Neuraminidase Influenza A virus (strain A/Puerto Rico/8/1934 H1N1) 2 Curated from the literature by BindingDB 10.1021/jm980162u 10.7270/Q2MP51GP 9651151 aid1795723 Kim, CU; Lew, W; Williams, MA; Wu, H; Zhang, L; Chen, X; Escarpe, PA; Mendel, DB; Laver, WG; Stevens, RC 7/2/1998 7/5/2005 Gilead Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=5009 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=753&target=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=5009&enzyme=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search 493872 8034648 1 MNPNQKIITIGSICLVVGLISLILQIGNIISIWISHSIQTGSQNHTGICNQNIITYKNSTWVKDTTSVILTGNSSLCPIRGWAIYSKDNSIRIGSKGDVFVIREPFISCSHLECRTFFLTQGALLNDKHSNGTVKDRSPYRALMSCPVGEAPSPYNSRFESVAWSASACHDGMGWLTIGISGPDNGAVAVLKYNGIITETIKSWRKKILRTQESECACVNGSCFTIMTDGPSDGLASYKIFKIEKGKVTKSIELNAPNSHYEECSCYPDTGKVMCVCRDNWHGSNRPWVSFDQNLDYQIGYICSGVFGDNPRPEDGTGSCGPVYVDGANGVKGFSYRYGNGVWIGRTKSHSSRHGFEMIWDPNGWTETDSKFSVRQDVVAMTDWSGYSGSFVQHPELTGLDCMRPCFWVELIRGRPKEKTIWTSASSISFCGVNSDTVDWSWPDGAELPFSIDK 9GQT,9GQQ Neuraminidase NRAM_I34A1 P03468 A4GXH6 Q20N35 Q84043 Q8JUU4 7849 CCCCO[C@@H]1C=C(C[C@H](N=C(N)N)[C@H]1NC(C)=O)C(O)=O |r,c:6| InChI=1S/C14H24N4O4/c1-3-4-5-22-11-7-9(13(20)21)6-10(18-14(15)16)12(11)17-8(2)19/h7,10-12H,3-6H2,1-2H3,(H,17,19)(H,20,21)(H4,15,16,18) KSPORGXVFPIYIQ-UHFFFAOYSA-N 5010 (3R,4R,5S)-4-Acetamido-5-guanidinyl-3-butoxy-1-cyclohexene-1-carboxylic acid::(3R,4R,5S)-3-butoxy-5-carbamimidamido-4-acetamidocyclohex-1-ene-1-carboxylic acid::Carbocyclic Analogue 60 Neuraminidase Influenza A virus (strain A/Puerto Rico/8/1934 H1N1) 3 Curated from the literature by BindingDB 10.1021/jm980162u 10.7270/Q2MP51GP 9651151 aid1795723 Kim, CU; Lew, W; Williams, MA; Wu, H; Zhang, L; Chen, X; Escarpe, PA; Mendel, DB; Laver, WG; Stevens, RC 7/2/1998 7/5/2005 Gilead Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=5010 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=753&target=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=5010&enzyme=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search 493873 8034649 1 MNPNQKIITIGSICLVVGLISLILQIGNIISIWISHSIQTGSQNHTGICNQNIITYKNSTWVKDTTSVILTGNSSLCPIRGWAIYSKDNSIRIGSKGDVFVIREPFISCSHLECRTFFLTQGALLNDKHSNGTVKDRSPYRALMSCPVGEAPSPYNSRFESVAWSASACHDGMGWLTIGISGPDNGAVAVLKYNGIITETIKSWRKKILRTQESECACVNGSCFTIMTDGPSDGLASYKIFKIEKGKVTKSIELNAPNSHYEECSCYPDTGKVMCVCRDNWHGSNRPWVSFDQNLDYQIGYICSGVFGDNPRPEDGTGSCGPVYVDGANGVKGFSYRYGNGVWIGRTKSHSSRHGFEMIWDPNGWTETDSKFSVRQDVVAMTDWSGYSGSFVQHPELTGLDCMRPCFWVELIRGRPKEKTIWTSASSISFCGVNSDTVDWSWPDGAELPFSIDK 9GQT,9GQQ Neuraminidase NRAM_I34A1 P03468 A4GXH6 Q20N35 Q84043 Q8JUU4 7850 CC[C@@H](C)O[C@@H]1C=C(C[C@H](N=C(N)N)[C@H]1NC(C)=O)C(O)=O |r,c:6| InChI=1S/C14H24N4O4/c1-4-7(2)22-11-6-9(13(20)21)5-10(18-14(15)16)12(11)17-8(3)19/h6-7,10-12H,4-5H2,1-3H3,(H,17,19)(H,20,21)(H4,15,16,18) BKSBSWKRQZCHQR-UHFFFAOYSA-N 5011 (3R,4R,5S)-3-[(2R)-butan-2-yloxy]-5-carbamimidamido-4-acetamidocyclohex-1-ene-1-carboxylic acid::(3R,4R,5S)-4-Acetamido-5-guanidinyl-3-(1(R)-methylpropoxy)-1-cyclohexene-1-carboxylic acid::Carbocyclic Analogue 61 Neuraminidase Influenza A virus (strain A/Puerto Rico/8/1934 H1N1) 0.5 Curated from the literature by BindingDB 10.1021/jm980162u 10.7270/Q2MP51GP 9651151 aid1795723 Kim, CU; Lew, W; Williams, MA; Wu, H; Zhang, L; Chen, X; Escarpe, PA; Mendel, DB; Laver, WG; Stevens, RC 7/2/1998 7/5/2005 Gilead Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=5011 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=753&target=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=5011&enzyme=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search 493875 8034650 1 MNPNQKIITIGSICLVVGLISLILQIGNIISIWISHSIQTGSQNHTGICNQNIITYKNSTWVKDTTSVILTGNSSLCPIRGWAIYSKDNSIRIGSKGDVFVIREPFISCSHLECRTFFLTQGALLNDKHSNGTVKDRSPYRALMSCPVGEAPSPYNSRFESVAWSASACHDGMGWLTIGISGPDNGAVAVLKYNGIITETIKSWRKKILRTQESECACVNGSCFTIMTDGPSDGLASYKIFKIEKGKVTKSIELNAPNSHYEECSCYPDTGKVMCVCRDNWHGSNRPWVSFDQNLDYQIGYICSGVFGDNPRPEDGTGSCGPVYVDGANGVKGFSYRYGNGVWIGRTKSHSSRHGFEMIWDPNGWTETDSKFSVRQDVVAMTDWSGYSGSFVQHPELTGLDCMRPCFWVELIRGRPKEKTIWTSASSISFCGVNSDTVDWSWPDGAELPFSIDK 9GQT,9GQQ Neuraminidase NRAM_I34A1 P03468 A4GXH6 Q20N35 Q84043 Q8JUU4 7851 CC[C@H](C)O[C@@H]1C=C(C[C@H](N=C(N)N)[C@H]1NC(C)=O)C(O)=O |r,c:6| InChI=1S/C14H24N4O4/c1-4-7(2)22-11-6-9(13(20)21)5-10(18-14(15)16)12(11)17-8(3)19/h6-7,10-12H,4-5H2,1-3H3,(H,17,19)(H,20,21)(H4,15,16,18) BKSBSWKRQZCHQR-UHFFFAOYSA-N 5012 (3R,4R,5S)-4-Acetamido-5-guanidinyl-3-(1(S)-methylpropoxy)-1-cyclohexene-1-carboxylic acid::(3R,4R,5S)-3-[(2S)-butan-2-yloxy]-5-carbamimidamido-4-acetamidocyclohex-1-ene-1-carboxylic acid::Carbocyclic Analogue 62 Neuraminidase Influenza A virus (strain A/Puerto Rico/8/1934 H1N1) 0.5 Curated from the literature by BindingDB 10.1021/jm980162u 10.7270/Q2MP51GP 9651151 aid1795723 Kim, CU; Lew, W; Williams, MA; Wu, H; Zhang, L; Chen, X; Escarpe, PA; Mendel, DB; Laver, WG; Stevens, RC 7/2/1998 7/5/2005 Gilead Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=5012 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=753&target=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=5012&enzyme=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search 493874 8034651 1 MNPNQKIITIGSICLVVGLISLILQIGNIISIWISHSIQTGSQNHTGICNQNIITYKNSTWVKDTTSVILTGNSSLCPIRGWAIYSKDNSIRIGSKGDVFVIREPFISCSHLECRTFFLTQGALLNDKHSNGTVKDRSPYRALMSCPVGEAPSPYNSRFESVAWSASACHDGMGWLTIGISGPDNGAVAVLKYNGIITETIKSWRKKILRTQESECACVNGSCFTIMTDGPSDGLASYKIFKIEKGKVTKSIELNAPNSHYEECSCYPDTGKVMCVCRDNWHGSNRPWVSFDQNLDYQIGYICSGVFGDNPRPEDGTGSCGPVYVDGANGVKGFSYRYGNGVWIGRTKSHSSRHGFEMIWDPNGWTETDSKFSVRQDVVAMTDWSGYSGSFVQHPELTGLDCMRPCFWVELIRGRPKEKTIWTSASSISFCGVNSDTVDWSWPDGAELPFSIDK 9GQT,9GQQ Neuraminidase NRAM_I34A1 P03468 A4GXH6 Q20N35 Q84043 Q8JUU4 7852 CCC(CC)O[C@@H]1C=C(C[C@H](N=C(N)N)[C@H]1NC(C)=O)C(O)=O |r,c:7| InChI=1S/C15H26N4O4/c1-4-10(5-2)23-12-7-9(14(21)22)6-11(19-15(16)17)13(12)18-8(3)20/h7,10-13H,4-6H2,1-3H3,(H,18,20)(H,21,22)(H4,16,17,19) TXXPTEJSSVMAFL-UHFFFAOYSA-N 5013 (3R,4R,5S)-4-Acetamido-5-guanidinyl-3-(1-ethylpropoxy)-1-cyclohexene-1-carboxylic acid::(3R,4R,5S)-5-carbamimidamido-4-acetamido-3-(pentan-3-yloxy)cyclohex-1-ene-1-carboxylic acid::Carbocyclic Analogue 63 Neuraminidase Influenza A virus (strain A/Puerto Rico/8/1934 H1N1) 0.5 Curated from the literature by BindingDB 10.1021/jm980162u 10.7270/Q2MP51GP 9651151 aid1795723 Kim, CU; Lew, W; Williams, MA; Wu, H; Zhang, L; Chen, X; Escarpe, PA; Mendel, DB; Laver, WG; Stevens, RC 7/2/1998 7/5/2005 Gilead Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=5013 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=753&target=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=5013&enzyme=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search 490476 8034652 1 MNPNQKIITIGSICLVVGLISLILQIGNIISIWISHSIQTGSQNHTGICNQNIITYKNSTWVKDTTSVILTGNSSLCPIRGWAIYSKDNSIRIGSKGDVFVIREPFISCSHLECRTFFLTQGALLNDKHSNGTVKDRSPYRALMSCPVGEAPSPYNSRFESVAWSASACHDGMGWLTIGISGPDNGAVAVLKYNGIITETIKSWRKKILRTQESECACVNGSCFTIMTDGPSDGLASYKIFKIEKGKVTKSIELNAPNSHYEECSCYPDTGKVMCVCRDNWHGSNRPWVSFDQNLDYQIGYICSGVFGDNPRPEDGTGSCGPVYVDGANGVKGFSYRYGNGVWIGRTKSHSSRHGFEMIWDPNGWTETDSKFSVRQDVVAMTDWSGYSGSFVQHPELTGLDCMRPCFWVELIRGRPKEKTIWTSASSISFCGVNSDTVDWSWPDGAELPFSIDK 9GQT,9GQQ Neuraminidase NRAM_I34A1 P03468 A4GXH6 Q20N35 Q84043 Q8JUU4 7853 CCC(CC)O[C@H]1[C@H](NC(C)=O)[C@@H](N)CC(C(O)=O)=C1C |r,c:18| InChI=1S/C15H26N2O4/c1-5-10(6-2)21-14-8(3)11(15(19)20)7-12(16)13(14)17-9(4)18/h10,12-14H,5-7,16H2,1-4H3,(H,17,18)(H,19,20) FYSOMEMGLOCHIM-UHFFFAOYSA-N 5014 C2-Substituted Carbocyclic Analogue 4::(3R,4R,5S)-5-amino-4-acetamido-2-methyl-3-(pentan-3-yloxy)cyclohex-1-ene-1-carboxylic acid::Carbocyclic Analogue 64 Neuraminidase Influenza A virus (strain A/Puerto Rico/8/1934 H1N1) 2300 Curated from the literature by BindingDB 10.1021/jm980162u 10.7270/Q2MP51GP 9651151 aid1795723 Kim, CU; Lew, W; Williams, MA; Wu, H; Zhang, L; Chen, X; Escarpe, PA; Mendel, DB; Laver, WG; Stevens, RC 7/2/1998 7/5/2005 Gilead Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=5014 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=753&target=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=5014&enzyme=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search 493876 8034653 1 MNPNQKIITIGSICLVVGLISLILQIGNIISIWISHSIQTGSQNHTGICNQNIITYKNSTWVKDTTSVILTGNSSLCPIRGWAIYSKDNSIRIGSKGDVFVIREPFISCSHLECRTFFLTQGALLNDKHSNGTVKDRSPYRALMSCPVGEAPSPYNSRFESVAWSASACHDGMGWLTIGISGPDNGAVAVLKYNGIITETIKSWRKKILRTQESECACVNGSCFTIMTDGPSDGLASYKIFKIEKGKVTKSIELNAPNSHYEECSCYPDTGKVMCVCRDNWHGSNRPWVSFDQNLDYQIGYICSGVFGDNPRPEDGTGSCGPVYVDGANGVKGFSYRYGNGVWIGRTKSHSSRHGFEMIWDPNGWTETDSKFSVRQDVVAMTDWSGYSGSFVQHPELTGLDCMRPCFWVELIRGRPKEKTIWTSASSISFCGVNSDTVDWSWPDGAELPFSIDK 9GQT,9GQQ Neuraminidase NRAM_I34A1 P03468 A4GXH6 Q20N35 Q84043 Q8JUU4 7854 CCC(CC)O[C@H]1[C@H](NC(C)=O)[C@@H](N)CC(C(O)=O)=C1F |r,c:18| InChI=1S/C14H23FN2O4/c1-4-8(5-2)21-13-11(15)9(14(19)20)6-10(16)12(13)17-7(3)18/h8,10,12-13H,4-6,16H2,1-3H3,(H,17,18)(H,19,20) DTBDFNJXZHXCFW-UHFFFAOYSA-N 5015 (3S,4R,5S)-5-amino-4-acetamido-2-fluoro-3-(pentan-3-yloxy)cyclohex-1-ene-1-carboxylic acid::Carbocyclic Analogue 30 Neuraminidase Influenza A virus (strain A/Puerto Rico/8/1934 H1N1) 3 Curated from the literature by BindingDB 10.1021/jm980162u 10.7270/Q2MP51GP 9651151 aid1795723 Kim, CU; Lew, W; Williams, MA; Wu, H; Zhang, L; Chen, X; Escarpe, PA; Mendel, DB; Laver, WG; Stevens, RC 7/2/1998 7/5/2005 Gilead Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=5015 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=753&target=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=5015&enzyme=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search 493877 8034654 1 MNPNQKIITIGSICLVVGLISLILQIGNIISIWISHSIQTGSQNHTGICNQNIITYKNSTWVKDTTSVILTGNSSLCPIRGWAIYSKDNSIRIGSKGDVFVIREPFISCSHLECRTFFLTQGALLNDKHSNGTVKDRSPYRALMSCPVGEAPSPYNSRFESVAWSASACHDGMGWLTIGISGPDNGAVAVLKYNGIITETIKSWRKKILRTQESECACVNGSCFTIMTDGPSDGLASYKIFKIEKGKVTKSIELNAPNSHYEECSCYPDTGKVMCVCRDNWHGSNRPWVSFDQNLDYQIGYICSGVFGDNPRPEDGTGSCGPVYVDGANGVKGFSYRYGNGVWIGRTKSHSSRHGFEMIWDPNGWTETDSKFSVRQDVVAMTDWSGYSGSFVQHPELTGLDCMRPCFWVELIRGRPKEKTIWTSASSISFCGVNSDTVDWSWPDGAELPFSIDK 9GQT,9GQQ Neuraminidase NRAM_I34A1 P03468 A4GXH6 Q20N35 Q84043 Q8JUU4 7858 CCC(CC)O[C@@H]1C=C([C@@H](C)[C@H](N)[C@H]1NC(C)=O)C(O)=O |r,c:7| InChI=1S/C15H26N2O4/c1-5-10(6-2)21-12-7-11(15(19)20)8(3)13(16)14(12)17-9(4)18/h7-8,10,12-14H,5-6,16H2,1-4H3,(H,17,18)(H,19,20) MYLKRBMLLOGEBS-UHFFFAOYSA-N 5016 4-beta-Acetamido-5-alpha-amino-3-alpha-(1-ethylpropoxy)-6-beta-methyl-1-cyclohexene-1-carboxylic acid::(3R,4R,5S,6R)-5-amino-4-acetamido-6-methyl-3-(pentan-3-yloxy)cyclohex-1-ene-1-carboxylic acid::Carbocyclic Analogue 22 Neuraminidase Influenza A virus (strain A/Puerto Rico/8/1934 H1N1) 1500 Curated from the literature by BindingDB 10.1021/jm980162u 10.7270/Q2MP51GP 9651151 aid1795723 Kim, CU; Lew, W; Williams, MA; Wu, H; Zhang, L; Chen, X; Escarpe, PA; Mendel, DB; Laver, WG; Stevens, RC 7/2/1998 7/5/2005 Gilead Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=5016 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=753&target=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=5016&enzyme=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search 493878 8034655 1 MNPNQKIITIGSICLVVGLISLILQIGNIISIWISHSIQTGSQNHTGICNQNIITYKNSTWVKDTTSVILTGNSSLCPIRGWAIYSKDNSIRIGSKGDVFVIREPFISCSHLECRTFFLTQGALLNDKHSNGTVKDRSPYRALMSCPVGEAPSPYNSRFESVAWSASACHDGMGWLTIGISGPDNGAVAVLKYNGIITETIKSWRKKILRTQESECACVNGSCFTIMTDGPSDGLASYKIFKIEKGKVTKSIELNAPNSHYEECSCYPDTGKVMCVCRDNWHGSNRPWVSFDQNLDYQIGYICSGVFGDNPRPEDGTGSCGPVYVDGANGVKGFSYRYGNGVWIGRTKSHSSRHGFEMIWDPNGWTETDSKFSVRQDVVAMTDWSGYSGSFVQHPELTGLDCMRPCFWVELIRGRPKEKTIWTSASSISFCGVNSDTVDWSWPDGAELPFSIDK 9GQT,9GQQ Neuraminidase NRAM_I34A1 P03468 A4GXH6 Q20N35 Q84043 Q8JUU4 8353 CCC(CC)O[C@@H]1C=C(C[C@H](N)[C@H]1NC(C)=O)C(O)=O |r,c:7| InChI=1S/C14H24N2O4/c1-4-10(5-2)20-12-7-9(14(18)19)6-11(15)13(12)16-8(3)17/h7,10-13H,4-6,15H2,1-3H3,(H,16,17)(H,18,19) NENPYTRHICXVCS-UHFFFAOYSA-N 4994 CHEMBL674::(3R,4R,5S)-5-amino-4-acetamido-3-(pentan-3-yloxy)cyclohex-1-ene-1-carboxylic acid::GS4071::Oseltamivir carboxylate Neuraminidase Influenza A virus (strain A/Puerto Rico/8/1934 H1N1) 1 6.5000 37.00 C Curated from the literature by BindingDB 10.1016/S0960-894X(97)00333-8 10.7270/Q2FX77MK aid1795757 Williams, MA; Lew, W; Mendel, DB; Tai, CY; Escarpe, PA; Laver, WG; Stevens, RC; Kim, CU 7/22/1997 7/27/2005 Gilead Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=4994 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=753&target=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=4994&enzyme=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search 449381 8034633 CHEMBL674 1 MNPNQKIITIGSICLVVGLISLILQIGNIISIWISHSIQTGSQNHTGICNQNIITYKNSTWVKDTTSVILTGNSSLCPIRGWAIYSKDNSIRIGSKGDVFVIREPFISCSHLECRTFFLTQGALLNDKHSNGTVKDRSPYRALMSCPVGEAPSPYNSRFESVAWSASACHDGMGWLTIGISGPDNGAVAVLKYNGIITETIKSWRKKILRTQESECACVNGSCFTIMTDGPSDGLASYKIFKIEKGKVTKSIELNAPNSHYEECSCYPDTGKVMCVCRDNWHGSNRPWVSFDQNLDYQIGYICSGVFGDNPRPEDGTGSCGPVYVDGANGVKGFSYRYGNGVWIGRTKSHSSRHGFEMIWDPNGWTETDSKFSVRQDVVAMTDWSGYSGSFVQHPELTGLDCMRPCFWVELIRGRPKEKTIWTSASSISFCGVNSDTVDWSWPDGAELPFSIDK 9GQT,9GQQ Neuraminidase NRAM_I34A1 P03468 A4GXH6 Q20N35 Q84043 Q8JUU4 8354 CCCO[C@@H]1C=C(C[C@H](N)[C@H]1NC(C)=O)C(O)=O |r,c:5| InChI=1S/C12H20N2O4/c1-3-4-18-10-6-8(12(16)17)5-9(13)11(10)14-7(2)15/h6,9-11H,3-5,13H2,1-2H3,(H,14,15)(H,16,17) UNJFVQQPDOQFDW-UHFFFAOYSA-N 4983 Carbocyclic Analogue 3::(3R,4R,5S)-5-amino-4-acetamido-3-propoxycyclohex-1-ene-1-carboxylic acid::Carbocyclic Analogue 34 Neuraminidase Influenza A virus (strain A/Puerto Rico/8/1934 H1N1) 130 6.5000 37.00 C Curated from the literature by BindingDB 10.1016/S0960-894X(97)00333-8 10.7270/Q2FX77MK aid1795757 Williams, MA; Lew, W; Mendel, DB; Tai, CY; Escarpe, PA; Laver, WG; Stevens, RC; Kim, CU 7/22/1997 7/27/2005 Gilead Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=4983 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=753&target=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=4983&enzyme=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search 480258 8034622 1 MNPNQKIITIGSICLVVGLISLILQIGNIISIWISHSIQTGSQNHTGICNQNIITYKNSTWVKDTTSVILTGNSSLCPIRGWAIYSKDNSIRIGSKGDVFVIREPFISCSHLECRTFFLTQGALLNDKHSNGTVKDRSPYRALMSCPVGEAPSPYNSRFESVAWSASACHDGMGWLTIGISGPDNGAVAVLKYNGIITETIKSWRKKILRTQESECACVNGSCFTIMTDGPSDGLASYKIFKIEKGKVTKSIELNAPNSHYEECSCYPDTGKVMCVCRDNWHGSNRPWVSFDQNLDYQIGYICSGVFGDNPRPEDGTGSCGPVYVDGANGVKGFSYRYGNGVWIGRTKSHSSRHGFEMIWDPNGWTETDSKFSVRQDVVAMTDWSGYSGSFVQHPELTGLDCMRPCFWVELIRGRPKEKTIWTSASSISFCGVNSDTVDWSWPDGAELPFSIDK 9GQT,9GQQ Neuraminidase NRAM_I34A1 P03468 A4GXH6 Q20N35 Q84043 Q8JUU4 8355 COCO[C@@H]1C=C(C[C@H](N)[C@H]1NC(C)=O)C(O)=O |r,c:5| InChI=1S/C11H18N2O5/c1-6(14)13-10-8(12)3-7(11(15)16)4-9(10)18-5-17-2/h4,8-10H,3,5,12H2,1-2H3,(H,13,14)(H,15,16) QQJHJEFLKIICMG-UHFFFAOYSA-N 5213 (3R,4R,5S)-5-amino-4-acetamido-3-(methoxymethoxy)cyclohex-1-ene-1-carboxylic acid::carbocyclic analogue 4 Neuraminidase Influenza A virus (strain A/Puerto Rico/8/1934 H1N1) 2000 6.5000 37.00 C Curated from the literature by BindingDB 10.1016/S0960-894X(97)00333-8 10.7270/Q2FX77MK aid1795757 Williams, MA; Lew, W; Mendel, DB; Tai, CY; Escarpe, PA; Laver, WG; Stevens, RC; Kim, CU 7/22/1997 7/27/2005 Gilead Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=5213 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=753&target=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=5213&enzyme=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search 505918 8034845 1 MNPNQKIITIGSICLVVGLISLILQIGNIISIWISHSIQTGSQNHTGICNQNIITYKNSTWVKDTTSVILTGNSSLCPIRGWAIYSKDNSIRIGSKGDVFVIREPFISCSHLECRTFFLTQGALLNDKHSNGTVKDRSPYRALMSCPVGEAPSPYNSRFESVAWSASACHDGMGWLTIGISGPDNGAVAVLKYNGIITETIKSWRKKILRTQESECACVNGSCFTIMTDGPSDGLASYKIFKIEKGKVTKSIELNAPNSHYEECSCYPDTGKVMCVCRDNWHGSNRPWVSFDQNLDYQIGYICSGVFGDNPRPEDGTGSCGPVYVDGANGVKGFSYRYGNGVWIGRTKSHSSRHGFEMIWDPNGWTETDSKFSVRQDVVAMTDWSGYSGSFVQHPELTGLDCMRPCFWVELIRGRPKEKTIWTSASSISFCGVNSDTVDWSWPDGAELPFSIDK 9GQT,9GQQ Neuraminidase NRAM_I34A1 P03468 A4GXH6 Q20N35 Q84043 Q8JUU4 8356 CC(=O)N[C@@H]1[C@@H](N)CC(=C[C@H]1OCCC(F)(F)F)C(O)=O |r,c:8| InChI=1S/C12H17F3N2O4/c1-6(18)17-10-8(16)4-7(11(19)20)5-9(10)21-3-2-12(13,14)15/h5,8-10H,2-4,16H2,1H3,(H,17,18)(H,19,20) VOPLDVVYCKXZGJ-UHFFFAOYSA-N 5214 (3R,4R,5S)-5-amino-4-acetamido-3-(3,3,3-trifluoropropoxy)cyclohex-1-ene-1-carboxylic acid::carbocyclic analogue 5 Neuraminidase Influenza A virus (strain A/Puerto Rico/8/1934 H1N1) 225 6.5000 37.00 C Curated from the literature by BindingDB 10.1016/S0960-894X(97)00333-8 10.7270/Q2FX77MK aid1795757 Williams, MA; Lew, W; Mendel, DB; Tai, CY; Escarpe, PA; Laver, WG; Stevens, RC; Kim, CU 7/22/1997 7/27/2005 Gilead Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=5214 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=753&target=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=5214&enzyme=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search 505919 8034846 1 MNPNQKIITIGSICLVVGLISLILQIGNIISIWISHSIQTGSQNHTGICNQNIITYKNSTWVKDTTSVILTGNSSLCPIRGWAIYSKDNSIRIGSKGDVFVIREPFISCSHLECRTFFLTQGALLNDKHSNGTVKDRSPYRALMSCPVGEAPSPYNSRFESVAWSASACHDGMGWLTIGISGPDNGAVAVLKYNGIITETIKSWRKKILRTQESECACVNGSCFTIMTDGPSDGLASYKIFKIEKGKVTKSIELNAPNSHYEECSCYPDTGKVMCVCRDNWHGSNRPWVSFDQNLDYQIGYICSGVFGDNPRPEDGTGSCGPVYVDGANGVKGFSYRYGNGVWIGRTKSHSSRHGFEMIWDPNGWTETDSKFSVRQDVVAMTDWSGYSGSFVQHPELTGLDCMRPCFWVELIRGRPKEKTIWTSASSISFCGVNSDTVDWSWPDGAELPFSIDK 9GQT,9GQQ Neuraminidase NRAM_I34A1 P03468 A4GXH6 Q20N35 Q84043 Q8JUU4 8357 CC(=O)N[C@@H]1[C@@H](N)CC(=C[C@H]1OCC=C)C(O)=O |r,c:8| InChI=1S/C12H18N2O4/c1-3-4-18-10-6-8(12(16)17)5-9(13)11(10)14-7(2)15/h3,6,9-11H,1,4-5,13H2,2H3,(H,14,15)(H,16,17) CPEQXRRROPTVGA-UHFFFAOYSA-N 5215 (3R,4R,5S)-5-amino-4-acetamido-3-(prop-2-en-1-yloxy)cyclohex-1-ene-1-carboxylic acid::carbocyclic analogue 6 Neuraminidase Influenza A virus (strain A/Puerto Rico/8/1934 H1N1) 2200 6.5000 37.00 C Curated from the literature by BindingDB 10.1016/S0960-894X(97)00333-8 10.7270/Q2FX77MK aid1795757 Williams, MA; Lew, W; Mendel, DB; Tai, CY; Escarpe, PA; Laver, WG; Stevens, RC; Kim, CU 7/22/1997 7/27/2005 Gilead Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=5215 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=753&target=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=5215&enzyme=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search 505920 8034847 1 MNPNQKIITIGSICLVVGLISLILQIGNIISIWISHSIQTGSQNHTGICNQNIITYKNSTWVKDTTSVILTGNSSLCPIRGWAIYSKDNSIRIGSKGDVFVIREPFISCSHLECRTFFLTQGALLNDKHSNGTVKDRSPYRALMSCPVGEAPSPYNSRFESVAWSASACHDGMGWLTIGISGPDNGAVAVLKYNGIITETIKSWRKKILRTQESECACVNGSCFTIMTDGPSDGLASYKIFKIEKGKVTKSIELNAPNSHYEECSCYPDTGKVMCVCRDNWHGSNRPWVSFDQNLDYQIGYICSGVFGDNPRPEDGTGSCGPVYVDGANGVKGFSYRYGNGVWIGRTKSHSSRHGFEMIWDPNGWTETDSKFSVRQDVVAMTDWSGYSGSFVQHPELTGLDCMRPCFWVELIRGRPKEKTIWTSASSISFCGVNSDTVDWSWPDGAELPFSIDK 9GQT,9GQQ Neuraminidase NRAM_I34A1 P03468 A4GXH6 Q20N35 Q84043 Q8JUU4 8358 CC(=O)N[C@@H]1[C@@H](N)CC(=C[C@H]1OC1CCCC1)C(O)=O |r,c:8| InChI=1S/C14H22N2O4/c1-8(17)16-13-11(15)6-9(14(18)19)7-12(13)20-10-4-2-3-5-10/h7,10-13H,2-6,15H2,1H3,(H,16,17)(H,18,19) UZOVWFQVJCMDDP-UHFFFAOYSA-N 5216 (3R,4R,5S)-5-amino-3-(cyclopentyloxy)-4-acetamidocyclohex-1-ene-1-carboxylic acid::carbocyclic analogue 7 Neuraminidase Influenza A virus (strain A/Puerto Rico/8/1934 H1N1) 22 6.5000 37.00 C Curated from the literature by BindingDB 10.1016/S0960-894X(97)00333-8 10.7270/Q2FX77MK aid1795757 Williams, MA; Lew, W; Mendel, DB; Tai, CY; Escarpe, PA; Laver, WG; Stevens, RC; Kim, CU 7/22/1997 7/27/2005 Gilead Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=5216 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=753&target=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=5216&enzyme=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search 505921 8034848 1 MNPNQKIITIGSICLVVGLISLILQIGNIISIWISHSIQTGSQNHTGICNQNIITYKNSTWVKDTTSVILTGNSSLCPIRGWAIYSKDNSIRIGSKGDVFVIREPFISCSHLECRTFFLTQGALLNDKHSNGTVKDRSPYRALMSCPVGEAPSPYNSRFESVAWSASACHDGMGWLTIGISGPDNGAVAVLKYNGIITETIKSWRKKILRTQESECACVNGSCFTIMTDGPSDGLASYKIFKIEKGKVTKSIELNAPNSHYEECSCYPDTGKVMCVCRDNWHGSNRPWVSFDQNLDYQIGYICSGVFGDNPRPEDGTGSCGPVYVDGANGVKGFSYRYGNGVWIGRTKSHSSRHGFEMIWDPNGWTETDSKFSVRQDVVAMTDWSGYSGSFVQHPELTGLDCMRPCFWVELIRGRPKEKTIWTSASSISFCGVNSDTVDWSWPDGAELPFSIDK 9GQT,9GQQ Neuraminidase NRAM_I34A1 P03468 A4GXH6 Q20N35 Q84043 Q8JUU4 8359 CC(=O)N[C@@H]1[C@@H](N)CC(=C[C@H]1OC1CCCCC1)C(O)=O |r,c:8| InChI=1S/C15H24N2O4/c1-9(18)17-14-12(16)7-10(15(19)20)8-13(14)21-11-5-3-2-4-6-11/h8,11-14H,2-7,16H2,1H3,(H,17,18)(H,19,20) GRDCBQGRBJQGMO-UHFFFAOYSA-N 4998 carbocyclic analogue 8::(3R,4R,5S)-5-amino-3-(cyclohexyloxy)-4-acetamidocyclohex-1-ene-1-carboxylic acid::Carbocyclic Analogue 48 Neuraminidase Influenza A virus (strain A/Puerto Rico/8/1934 H1N1) 60 6.5000 37.00 C Curated from the literature by BindingDB 10.1016/S0960-894X(97)00333-8 10.7270/Q2FX77MK aid1795757 Williams, MA; Lew, W; Mendel, DB; Tai, CY; Escarpe, PA; Laver, WG; Stevens, RC; Kim, CU 7/22/1997 7/27/2005 Gilead Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=4998 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=753&target=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=4998&enzyme=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search 493861 8034637 1 MNPNQKIITIGSICLVVGLISLILQIGNIISIWISHSIQTGSQNHTGICNQNIITYKNSTWVKDTTSVILTGNSSLCPIRGWAIYSKDNSIRIGSKGDVFVIREPFISCSHLECRTFFLTQGALLNDKHSNGTVKDRSPYRALMSCPVGEAPSPYNSRFESVAWSASACHDGMGWLTIGISGPDNGAVAVLKYNGIITETIKSWRKKILRTQESECACVNGSCFTIMTDGPSDGLASYKIFKIEKGKVTKSIELNAPNSHYEECSCYPDTGKVMCVCRDNWHGSNRPWVSFDQNLDYQIGYICSGVFGDNPRPEDGTGSCGPVYVDGANGVKGFSYRYGNGVWIGRTKSHSSRHGFEMIWDPNGWTETDSKFSVRQDVVAMTDWSGYSGSFVQHPELTGLDCMRPCFWVELIRGRPKEKTIWTSASSISFCGVNSDTVDWSWPDGAELPFSIDK 9GQT,9GQQ Neuraminidase NRAM_I34A1 P03468 A4GXH6 Q20N35 Q84043 Q8JUU4 8360 CC(=O)N[C@@H]1[C@@H](N)CC(=C[C@H]1Oc1ccccc1)C(O)=O |r,c:8| InChI=1S/C15H18N2O4/c1-9(18)17-14-12(16)7-10(15(19)20)8-13(14)21-11-5-3-2-4-6-11/h2-6,8,12-14H,7,16H2,1H3,(H,17,18)(H,19,20) DKWGERBFVMJXSN-UHFFFAOYSA-N 5001 (3R,4R,5S)-5-amino-4-acetamido-3-phenoxycyclohex-1-ene-1-carboxylic acid::carbocyclic analogue 9::Carbocyclic Analogue 51 Neuraminidase Influenza A virus (strain A/Puerto Rico/8/1934 H1N1) 530 6.5000 37.00 C Curated from the literature by BindingDB 10.1016/S0960-894X(97)00333-8 10.7270/Q2FX77MK aid1795757 Williams, MA; Lew, W; Mendel, DB; Tai, CY; Escarpe, PA; Laver, WG; Stevens, RC; Kim, CU 7/22/1997 7/27/2005 Gilead Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=5001 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=753&target=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=5001&enzyme=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search 493864 8034640 1 MNPNQKIITIGSICLVVGLISLILQIGNIISIWISHSIQTGSQNHTGICNQNIITYKNSTWVKDTTSVILTGNSSLCPIRGWAIYSKDNSIRIGSKGDVFVIREPFISCSHLECRTFFLTQGALLNDKHSNGTVKDRSPYRALMSCPVGEAPSPYNSRFESVAWSASACHDGMGWLTIGISGPDNGAVAVLKYNGIITETIKSWRKKILRTQESECACVNGSCFTIMTDGPSDGLASYKIFKIEKGKVTKSIELNAPNSHYEECSCYPDTGKVMCVCRDNWHGSNRPWVSFDQNLDYQIGYICSGVFGDNPRPEDGTGSCGPVYVDGANGVKGFSYRYGNGVWIGRTKSHSSRHGFEMIWDPNGWTETDSKFSVRQDVVAMTDWSGYSGSFVQHPELTGLDCMRPCFWVELIRGRPKEKTIWTSASSISFCGVNSDTVDWSWPDGAELPFSIDK 9GQT,9GQQ Neuraminidase NRAM_I34A1 P03468 A4GXH6 Q20N35 Q84043 Q8JUU4 8361 CCCO[C@@H]1C=C(C[C@H](N)[C@H]1NC(=O)C(F)(F)F)C(O)=O |r,c:5| InChI=1S/C12H17F3N2O4/c1-2-3-21-8-5-6(10(18)19)4-7(16)9(8)17-11(20)12(13,14)15/h5,7-9H,2-4,16H2,1H3,(H,17,20)(H,18,19) LSTDSHDWUMFIPV-UHFFFAOYSA-N 5219 (3R,4R,5S)-5-amino-3-propoxy-4-(2,2,2-trifluoroacetamido)cyclohex-1-ene-1-carboxylic acid::carbocyclic analogue 12 Neuraminidase Influenza A virus (strain A/Puerto Rico/8/1934 H1N1) 100 6.5000 37.00 C Curated from the literature by BindingDB 10.1016/S0960-894X(97)00333-8 10.7270/Q2FX77MK aid1795757 Williams, MA; Lew, W; Mendel, DB; Tai, CY; Escarpe, PA; Laver, WG; Stevens, RC; Kim, CU 7/22/1997 7/27/2005 Gilead Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=5219 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=753&target=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=5219&enzyme=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search 505922 8034849 1 MNPNQKIITIGSICLVVGLISLILQIGNIISIWISHSIQTGSQNHTGICNQNIITYKNSTWVKDTTSVILTGNSSLCPIRGWAIYSKDNSIRIGSKGDVFVIREPFISCSHLECRTFFLTQGALLNDKHSNGTVKDRSPYRALMSCPVGEAPSPYNSRFESVAWSASACHDGMGWLTIGISGPDNGAVAVLKYNGIITETIKSWRKKILRTQESECACVNGSCFTIMTDGPSDGLASYKIFKIEKGKVTKSIELNAPNSHYEECSCYPDTGKVMCVCRDNWHGSNRPWVSFDQNLDYQIGYICSGVFGDNPRPEDGTGSCGPVYVDGANGVKGFSYRYGNGVWIGRTKSHSSRHGFEMIWDPNGWTETDSKFSVRQDVVAMTDWSGYSGSFVQHPELTGLDCMRPCFWVELIRGRPKEKTIWTSASSISFCGVNSDTVDWSWPDGAELPFSIDK 9GQT,9GQQ Neuraminidase NRAM_I34A1 P03468 A4GXH6 Q20N35 Q84043 Q8JUU4 8362 CCCO[C@@H]1C=C(C[C@H](N)[C@H]1NC(=O)CC)C(O)=O |r,c:5| InChI=1S/C13H22N2O4/c1-3-5-19-10-7-8(13(17)18)6-9(14)12(10)15-11(16)4-2/h7,9-10,12H,3-6,14H2,1-2H3,(H,15,16)(H,17,18) JSSVBLPCZUAOLK-UHFFFAOYSA-N 5220 (3R,4R,5S)-5-amino-4-propanamido-3-propoxycyclohex-1-ene-1-carboxylic acid::carbocyclic analogue 13 Neuraminidase Influenza A virus (strain A/Puerto Rico/8/1934 H1N1) 1500 6.5000 37.00 C Curated from the literature by BindingDB 10.1016/S0960-894X(97)00333-8 10.7270/Q2FX77MK aid1795757 Williams, MA; Lew, W; Mendel, DB; Tai, CY; Escarpe, PA; Laver, WG; Stevens, RC; Kim, CU 7/22/1997 7/27/2005 Gilead Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=5220 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=753&target=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=5220&enzyme=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search 505923 8034850 1 MNPNQKIITIGSICLVVGLISLILQIGNIISIWISHSIQTGSQNHTGICNQNIITYKNSTWVKDTTSVILTGNSSLCPIRGWAIYSKDNSIRIGSKGDVFVIREPFISCSHLECRTFFLTQGALLNDKHSNGTVKDRSPYRALMSCPVGEAPSPYNSRFESVAWSASACHDGMGWLTIGISGPDNGAVAVLKYNGIITETIKSWRKKILRTQESECACVNGSCFTIMTDGPSDGLASYKIFKIEKGKVTKSIELNAPNSHYEECSCYPDTGKVMCVCRDNWHGSNRPWVSFDQNLDYQIGYICSGVFGDNPRPEDGTGSCGPVYVDGANGVKGFSYRYGNGVWIGRTKSHSSRHGFEMIWDPNGWTETDSKFSVRQDVVAMTDWSGYSGSFVQHPELTGLDCMRPCFWVELIRGRPKEKTIWTSASSISFCGVNSDTVDWSWPDGAELPFSIDK 9GQT,9GQQ Neuraminidase NRAM_I34A1 P03468 A4GXH6 Q20N35 Q84043 Q8JUU4 8363 CCCO[C@@H]1C=C(C[C@H](N)[C@H]1NS(C)(=O)=O)C(O)=O |r,c:5| InChI=1S/C11H20N2O5S/c1-3-4-18-9-6-7(11(14)15)5-8(12)10(9)13-19(2,16)17/h6,8-10,13H,3-5,12H2,1-2H3,(H,14,15) OEZYEYXMBIPGKG-UHFFFAOYSA-N 5221 (3R,4R,5S)-5-amino-4-methanesulfonamido-3-propoxycyclohex-1-ene-1-carboxylic acid::carbocyclic analogue 14 Neuraminidase Influenza A virus (strain A/Puerto Rico/8/1934 H1N1) 25000 6.5000 37.00 C Curated from the literature by BindingDB 10.1016/S0960-894X(97)00333-8 10.7270/Q2FX77MK aid1795757 Williams, MA; Lew, W; Mendel, DB; Tai, CY; Escarpe, PA; Laver, WG; Stevens, RC; Kim, CU 7/22/1997 7/27/2005 Gilead Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=5221 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=753&target=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=5221&enzyme=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search 505924 8034851 1 MNPNQKIITIGSICLVVGLISLILQIGNIISIWISHSIQTGSQNHTGICNQNIITYKNSTWVKDTTSVILTGNSSLCPIRGWAIYSKDNSIRIGSKGDVFVIREPFISCSHLECRTFFLTQGALLNDKHSNGTVKDRSPYRALMSCPVGEAPSPYNSRFESVAWSASACHDGMGWLTIGISGPDNGAVAVLKYNGIITETIKSWRKKILRTQESECACVNGSCFTIMTDGPSDGLASYKIFKIEKGKVTKSIELNAPNSHYEECSCYPDTGKVMCVCRDNWHGSNRPWVSFDQNLDYQIGYICSGVFGDNPRPEDGTGSCGPVYVDGANGVKGFSYRYGNGVWIGRTKSHSSRHGFEMIWDPNGWTETDSKFSVRQDVVAMTDWSGYSGSFVQHPELTGLDCMRPCFWVELIRGRPKEKTIWTSASSISFCGVNSDTVDWSWPDGAELPFSIDK 9GQT,9GQQ Neuraminidase NRAM_I34A1 P03468 A4GXH6 Q20N35 Q84043 Q8JUU4 8364 CCCO[C@@H]1C=C(C[C@H](N=CN)[C@H]1NC(C)=O)C(O)=O |r,w:10.10,c:5| InChI=1S/C13H21N3O4/c1-3-4-20-11-6-9(13(18)19)5-10(15-7-14)12(11)16-8(2)17/h6-7,10-12H,3-5H2,1-2H3,(H2,14,15)(H,16,17)(H,18,19) UHUIIWFIVBGZEX-UHFFFAOYSA-N 5222 (3R,4R,5S)-4-acetamido-5-methanimidamido-3-propoxycyclohex-1-ene-1-carboxylic acid::carbocyclic analogue 16 Neuraminidase Influenza A virus (strain A/Puerto Rico/8/1934 H1N1) 140 6.5000 37.00 C Curated from the literature by BindingDB 10.1016/S0960-894X(97)00333-8 10.7270/Q2FX77MK aid1795757 Williams, MA; Lew, W; Mendel, DB; Tai, CY; Escarpe, PA; Laver, WG; Stevens, RC; Kim, CU 7/22/1997 7/27/2005 Gilead Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=5222 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=753&target=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=5222&enzyme=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search 505925 8034852 1 MNPNQKIITIGSICLVVGLISLILQIGNIISIWISHSIQTGSQNHTGICNQNIITYKNSTWVKDTTSVILTGNSSLCPIRGWAIYSKDNSIRIGSKGDVFVIREPFISCSHLECRTFFLTQGALLNDKHSNGTVKDRSPYRALMSCPVGEAPSPYNSRFESVAWSASACHDGMGWLTIGISGPDNGAVAVLKYNGIITETIKSWRKKILRTQESECACVNGSCFTIMTDGPSDGLASYKIFKIEKGKVTKSIELNAPNSHYEECSCYPDTGKVMCVCRDNWHGSNRPWVSFDQNLDYQIGYICSGVFGDNPRPEDGTGSCGPVYVDGANGVKGFSYRYGNGVWIGRTKSHSSRHGFEMIWDPNGWTETDSKFSVRQDVVAMTDWSGYSGSFVQHPELTGLDCMRPCFWVELIRGRPKEKTIWTSASSISFCGVNSDTVDWSWPDGAELPFSIDK 9GQT,9GQQ Neuraminidase NRAM_I34A1 P03468 A4GXH6 Q20N35 Q84043 Q8JUU4 8365 CCCO[C@@H]1C=C(C[C@H](N=C(N)N)[C@H]1NC(C)=O)C(O)=O |r,c:5| InChI=1S/C13H22N4O4/c1-3-4-21-10-6-8(12(19)20)5-9(17-13(14)15)11(10)16-7(2)18/h6,9-11H,3-5H2,1-2H3,(H,16,18)(H,19,20)(H4,14,15,17) JPGVNBPJSYNZSP-UHFFFAOYSA-N 5009 carbocyclic analogue 18::(3R,4R,5S)-5-carbamimidamido-4-acetamido-3-propoxycyclohex-1-ene-1-carboxylic acid::(3R,4R,5S)-4-Acetamido-5-guanidinyl-3-propoxy-1-cyclohexene-1-carboxylic Acid::Carbocyclic Analogue 59 Neuraminidase Influenza A virus (strain A/Puerto Rico/8/1934 H1N1) 1.8 6.5000 37.00 C Curated from the literature by BindingDB 10.1016/S0960-894X(97)00333-8 10.7270/Q2FX77MK aid1795757 Williams, MA; Lew, W; Mendel, DB; Tai, CY; Escarpe, PA; Laver, WG; Stevens, RC; Kim, CU 7/22/1997 7/27/2005 Gilead Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=5009 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=753&target=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=5009&enzyme=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search 493872 8034648 1 MNPNQKIITIGSICLVVGLISLILQIGNIISIWISHSIQTGSQNHTGICNQNIITYKNSTWVKDTTSVILTGNSSLCPIRGWAIYSKDNSIRIGSKGDVFVIREPFISCSHLECRTFFLTQGALLNDKHSNGTVKDRSPYRALMSCPVGEAPSPYNSRFESVAWSASACHDGMGWLTIGISGPDNGAVAVLKYNGIITETIKSWRKKILRTQESECACVNGSCFTIMTDGPSDGLASYKIFKIEKGKVTKSIELNAPNSHYEECSCYPDTGKVMCVCRDNWHGSNRPWVSFDQNLDYQIGYICSGVFGDNPRPEDGTGSCGPVYVDGANGVKGFSYRYGNGVWIGRTKSHSSRHGFEMIWDPNGWTETDSKFSVRQDVVAMTDWSGYSGSFVQHPELTGLDCMRPCFWVELIRGRPKEKTIWTSASSISFCGVNSDTVDWSWPDGAELPFSIDK 9GQT,9GQQ Neuraminidase NRAM_I34A1 P03468 A4GXH6 Q20N35 Q84043 Q8JUU4 8366 CCCO[C@@H]1C=C(C[C@H](N=C(N)NC)[C@H]1NC(C)=O)C(O)=O |r,w:10.10,c:5| InChI=1S/C14H24N4O4/c1-4-5-22-11-7-9(13(20)21)6-10(18-14(15)16-3)12(11)17-8(2)19/h7,10-12H,4-6H2,1-3H3,(H,17,19)(H,20,21)(H3,15,16,18) ROGKFDGNMDXYMW-UHFFFAOYSA-N 5224 (3R,4R,5S)-4-acetamido-5-(2-methylcarbamimidamido)-3-propoxycyclohex-1-ene-1-carboxylic acid::carbocyclic analogue 19 Neuraminidase Influenza A virus (strain A/Puerto Rico/8/1934 H1N1) 4.6 6.5000 37.00 C Curated from the literature by BindingDB 10.1016/S0960-894X(97)00333-8 10.7270/Q2FX77MK aid1795757 Williams, MA; Lew, W; Mendel, DB; Tai, CY; Escarpe, PA; Laver, WG; Stevens, RC; Kim, CU 7/22/1997 7/27/2005 Gilead Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=5224 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=753&target=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=5224&enzyme=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search 505926 8034853 1 MNPNQKIITIGSICLVVGLISLILQIGNIISIWISHSIQTGSQNHTGICNQNIITYKNSTWVKDTTSVILTGNSSLCPIRGWAIYSKDNSIRIGSKGDVFVIREPFISCSHLECRTFFLTQGALLNDKHSNGTVKDRSPYRALMSCPVGEAPSPYNSRFESVAWSASACHDGMGWLTIGISGPDNGAVAVLKYNGIITETIKSWRKKILRTQESECACVNGSCFTIMTDGPSDGLASYKIFKIEKGKVTKSIELNAPNSHYEECSCYPDTGKVMCVCRDNWHGSNRPWVSFDQNLDYQIGYICSGVFGDNPRPEDGTGSCGPVYVDGANGVKGFSYRYGNGVWIGRTKSHSSRHGFEMIWDPNGWTETDSKFSVRQDVVAMTDWSGYSGSFVQHPELTGLDCMRPCFWVELIRGRPKEKTIWTSASSISFCGVNSDTVDWSWPDGAELPFSIDK 9GQT,9GQQ Neuraminidase NRAM_I34A1 P03468 A4GXH6 Q20N35 Q84043 Q8JUU4 8367 CCCN(C)[C@@H]1C=C(C[C@H](N)[C@H]1NC(C)=O)C(O)=O |r,c:6| InChI=1S/C13H23N3O3/c1-4-5-16(3)11-7-9(13(18)19)6-10(14)12(11)15-8(2)17/h7,10-12H,4-6,14H2,1-3H3,(H,15,17)(H,18,19) NXAIKJLHJJDCAN-UHFFFAOYSA-N 5225 (3R,4R,5S)-5-amino-4-acetamido-3-[methyl(propyl)amino]cyclohex-1-ene-1-carboxylic acid::C3-Aza Carbocyclic Analogue 3a Neuraminidase Influenza A virus (strain A/Puerto Rico/8/1934 H1N1) 65 6.5000 37.00 C Curated from the literature by BindingDB 10.1016/s0960-894x(98)00587-3 10.7270/Q2B56GXM 9873727 aid1795758 Lew, W; Wu, H; Mendel, DB; Escarpe, PA; Chen, X; Laver, WG; Graves, BJ; Kim, CU 12/1/1998 7/27/2005 Gilead Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=5225 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=753&target=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=5225&enzyme=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search 5329304 8034854 1 MNPNQKIITIGSICLVVGLISLILQIGNIISIWISHSIQTGSQNHTGICNQNIITYKNSTWVKDTTSVILTGNSSLCPIRGWAIYSKDNSIRIGSKGDVFVIREPFISCSHLECRTFFLTQGALLNDKHSNGTVKDRSPYRALMSCPVGEAPSPYNSRFESVAWSASACHDGMGWLTIGISGPDNGAVAVLKYNGIITETIKSWRKKILRTQESECACVNGSCFTIMTDGPSDGLASYKIFKIEKGKVTKSIELNAPNSHYEECSCYPDTGKVMCVCRDNWHGSNRPWVSFDQNLDYQIGYICSGVFGDNPRPEDGTGSCGPVYVDGANGVKGFSYRYGNGVWIGRTKSHSSRHGFEMIWDPNGWTETDSKFSVRQDVVAMTDWSGYSGSFVQHPELTGLDCMRPCFWVELIRGRPKEKTIWTSASSISFCGVNSDTVDWSWPDGAELPFSIDK 9GQT,9GQQ Neuraminidase NRAM_I34A1 P03468 A4GXH6 Q20N35 Q84043 Q8JUU4 8368 CCCCN(C)[C@@H]1C=C(C[C@H](N)[C@H]1NC(C)=O)C(O)=O |r,c:7| InChI=1S/C14H25N3O3/c1-4-5-6-17(3)12-8-10(14(19)20)7-11(15)13(12)16-9(2)18/h8,11-13H,4-7,15H2,1-3H3,(H,16,18)(H,19,20) YSTLRIPWHBZYEM-UHFFFAOYSA-N 5226 (3R,4R,5S)-5-amino-3-[butyl(methyl)amino]-4-acetamidocyclohex-1-ene-1-carboxylic acid::C3-Aza Carbocyclic Analogue 3b Neuraminidase Influenza A virus (strain A/Puerto Rico/8/1934 H1N1) 180 6.5000 37.00 C Curated from the literature by BindingDB 10.1016/s0960-894x(98)00587-3 10.7270/Q2B56GXM 9873727 aid1795758 Lew, W; Wu, H; Mendel, DB; Escarpe, PA; Chen, X; Laver, WG; Graves, BJ; Kim, CU 12/1/1998 7/27/2005 Gilead Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=5226 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=753&target=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=5226&enzyme=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search 5329305 8034855 1 MNPNQKIITIGSICLVVGLISLILQIGNIISIWISHSIQTGSQNHTGICNQNIITYKNSTWVKDTTSVILTGNSSLCPIRGWAIYSKDNSIRIGSKGDVFVIREPFISCSHLECRTFFLTQGALLNDKHSNGTVKDRSPYRALMSCPVGEAPSPYNSRFESVAWSASACHDGMGWLTIGISGPDNGAVAVLKYNGIITETIKSWRKKILRTQESECACVNGSCFTIMTDGPSDGLASYKIFKIEKGKVTKSIELNAPNSHYEECSCYPDTGKVMCVCRDNWHGSNRPWVSFDQNLDYQIGYICSGVFGDNPRPEDGTGSCGPVYVDGANGVKGFSYRYGNGVWIGRTKSHSSRHGFEMIWDPNGWTETDSKFSVRQDVVAMTDWSGYSGSFVQHPELTGLDCMRPCFWVELIRGRPKEKTIWTSASSISFCGVNSDTVDWSWPDGAELPFSIDK 9GQT,9GQQ Neuraminidase NRAM_I34A1 P03468 A4GXH6 Q20N35 Q84043 Q8JUU4 8369 CCC(CC)N(C)[C@@H]1C=C(C[C@H](N)[C@H]1NC(C)=O)C(O)=O |r,c:8| InChI=1S/C15H27N3O3/c1-5-11(6-2)18(4)13-8-10(15(20)21)7-12(16)14(13)17-9(3)19/h8,11-14H,5-7,16H2,1-4H3,(H,17,19)(H,20,21) SXSWDQYDUTZALK-UHFFFAOYSA-N 5227 (3R,4R,5S)-5-amino-4-acetamido-3-[methyl(pentan-3-yl)amino]cyclohex-1-ene-1-carboxylic acid::C3-Aza Carbocyclic Analogue 3c Neuraminidase Influenza A virus (strain A/Puerto Rico/8/1934 H1N1) 6 6.5000 37.00 C Curated from the literature by BindingDB 10.1016/s0960-894x(98)00587-3 10.7270/Q2B56GXM 9873727 aid1795758 Lew, W; Wu, H; Mendel, DB; Escarpe, PA; Chen, X; Laver, WG; Graves, BJ; Kim, CU 12/1/1998 7/27/2005 Gilead Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=5227 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=753&target=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=5227&enzyme=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search 5329306 8034856 1 MNPNQKIITIGSICLVVGLISLILQIGNIISIWISHSIQTGSQNHTGICNQNIITYKNSTWVKDTTSVILTGNSSLCPIRGWAIYSKDNSIRIGSKGDVFVIREPFISCSHLECRTFFLTQGALLNDKHSNGTVKDRSPYRALMSCPVGEAPSPYNSRFESVAWSASACHDGMGWLTIGISGPDNGAVAVLKYNGIITETIKSWRKKILRTQESECACVNGSCFTIMTDGPSDGLASYKIFKIEKGKVTKSIELNAPNSHYEECSCYPDTGKVMCVCRDNWHGSNRPWVSFDQNLDYQIGYICSGVFGDNPRPEDGTGSCGPVYVDGANGVKGFSYRYGNGVWIGRTKSHSSRHGFEMIWDPNGWTETDSKFSVRQDVVAMTDWSGYSGSFVQHPELTGLDCMRPCFWVELIRGRPKEKTIWTSASSISFCGVNSDTVDWSWPDGAELPFSIDK 9GQT,9GQQ Neuraminidase NRAM_I34A1 P03468 A4GXH6 Q20N35 Q84043 Q8JUU4 8370 CN(CCc1ccccc1)[C@@H]1C=C(C[C@H](N)[C@H]1NC(C)=O)C(O)=O |r,c:12| InChI=1S/C18H25N3O3/c1-12(22)20-17-15(19)10-14(18(23)24)11-16(17)21(2)9-8-13-6-4-3-5-7-13/h3-7,11,15-17H,8-10,19H2,1-2H3,(H,20,22)(H,23,24) JGHGNWBFWJQGDZ-UHFFFAOYSA-N 5228 (3R,4R,5S)-5-amino-4-acetamido-3-[methyl(2-phenylethyl)amino]cyclohex-1-ene-1-carboxylic acid::C3-Aza Carbocyclic Analogue 3d Neuraminidase Influenza A virus (strain A/Puerto Rico/8/1934 H1N1) 100 6.5000 37.00 C Curated from the literature by BindingDB 10.1016/s0960-894x(98)00587-3 10.7270/Q2B56GXM 9873727 aid1795758 Lew, W; Wu, H; Mendel, DB; Escarpe, PA; Chen, X; Laver, WG; Graves, BJ; Kim, CU 12/1/1998 7/27/2005 Gilead Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=5228 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=753&target=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=5228&enzyme=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search 5329307 8034857 1 MNPNQKIITIGSICLVVGLISLILQIGNIISIWISHSIQTGSQNHTGICNQNIITYKNSTWVKDTTSVILTGNSSLCPIRGWAIYSKDNSIRIGSKGDVFVIREPFISCSHLECRTFFLTQGALLNDKHSNGTVKDRSPYRALMSCPVGEAPSPYNSRFESVAWSASACHDGMGWLTIGISGPDNGAVAVLKYNGIITETIKSWRKKILRTQESECACVNGSCFTIMTDGPSDGLASYKIFKIEKGKVTKSIELNAPNSHYEECSCYPDTGKVMCVCRDNWHGSNRPWVSFDQNLDYQIGYICSGVFGDNPRPEDGTGSCGPVYVDGANGVKGFSYRYGNGVWIGRTKSHSSRHGFEMIWDPNGWTETDSKFSVRQDVVAMTDWSGYSGSFVQHPELTGLDCMRPCFWVELIRGRPKEKTIWTSASSISFCGVNSDTVDWSWPDGAELPFSIDK 9GQT,9GQQ Neuraminidase NRAM_I34A1 P03468 A4GXH6 Q20N35 Q84043 Q8JUU4 8371 CN(C1CCCCC1)[C@@H]1C=C(C[C@H](N)[C@H]1NC(C)=O)C(O)=O |r,c:10| InChI=1S/C16H27N3O3/c1-10(20)18-15-13(17)8-11(16(21)22)9-14(15)19(2)12-6-4-3-5-7-12/h9,12-15H,3-8,17H2,1-2H3,(H,18,20)(H,21,22) CJRHXCLZYDLFTK-UHFFFAOYSA-N 5229 (3R,4R,5S)-5-amino-3-[cyclohexyl(methyl)amino]-4-acetamidocyclohex-1-ene-1-carboxylic acid::C3-Aza Carbocyclic Analogue 3e Neuraminidase Influenza A virus (strain A/Puerto Rico/8/1934 H1N1) 200 6.5000 37.00 C Curated from the literature by BindingDB 10.1016/s0960-894x(98)00587-3 10.7270/Q2B56GXM 9873727 aid1795758 Lew, W; Wu, H; Mendel, DB; Escarpe, PA; Chen, X; Laver, WG; Graves, BJ; Kim, CU 12/1/1998 7/27/2005 Gilead Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=5229 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=753&target=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=5229&enzyme=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search 5329308 8034858 1 MNPNQKIITIGSICLVVGLISLILQIGNIISIWISHSIQTGSQNHTGICNQNIITYKNSTWVKDTTSVILTGNSSLCPIRGWAIYSKDNSIRIGSKGDVFVIREPFISCSHLECRTFFLTQGALLNDKHSNGTVKDRSPYRALMSCPVGEAPSPYNSRFESVAWSASACHDGMGWLTIGISGPDNGAVAVLKYNGIITETIKSWRKKILRTQESECACVNGSCFTIMTDGPSDGLASYKIFKIEKGKVTKSIELNAPNSHYEECSCYPDTGKVMCVCRDNWHGSNRPWVSFDQNLDYQIGYICSGVFGDNPRPEDGTGSCGPVYVDGANGVKGFSYRYGNGVWIGRTKSHSSRHGFEMIWDPNGWTETDSKFSVRQDVVAMTDWSGYSGSFVQHPELTGLDCMRPCFWVELIRGRPKEKTIWTSASSISFCGVNSDTVDWSWPDGAELPFSIDK 9GQT,9GQQ Neuraminidase NRAM_I34A1 P03468 A4GXH6 Q20N35 Q84043 Q8JUU4 8372 CCCN(CC)[C@@H]1C=C(C[C@H](N)[C@H]1NC(C)=O)C(O)=O |r,c:7| InChI=1S/C14H25N3O3/c1-4-6-17(5-2)12-8-10(14(19)20)7-11(15)13(12)16-9(3)18/h8,11-13H,4-7,15H2,1-3H3,(H,16,18)(H,19,20) HXGVFIWGGUQRIO-UHFFFAOYSA-N 5230 (3R,4R,5S)-5-amino-4-acetamido-3-[ethyl(propyl)amino]cyclohex-1-ene-1-carboxylic acid::C3-Aza Carbocyclic Analogue 3f Neuraminidase Influenza A virus (strain A/Puerto Rico/8/1934 H1N1) 90 6.5000 37.00 C Curated from the literature by BindingDB 10.1016/s0960-894x(98)00587-3 10.7270/Q2B56GXM 9873727 aid1795758 Lew, W; Wu, H; Mendel, DB; Escarpe, PA; Chen, X; Laver, WG; Graves, BJ; Kim, CU 12/1/1998 7/27/2005 Gilead Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=5230 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=753&target=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=5230&enzyme=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search 5329309 8034859 1 MNPNQKIITIGSICLVVGLISLILQIGNIISIWISHSIQTGSQNHTGICNQNIITYKNSTWVKDTTSVILTGNSSLCPIRGWAIYSKDNSIRIGSKGDVFVIREPFISCSHLECRTFFLTQGALLNDKHSNGTVKDRSPYRALMSCPVGEAPSPYNSRFESVAWSASACHDGMGWLTIGISGPDNGAVAVLKYNGIITETIKSWRKKILRTQESECACVNGSCFTIMTDGPSDGLASYKIFKIEKGKVTKSIELNAPNSHYEECSCYPDTGKVMCVCRDNWHGSNRPWVSFDQNLDYQIGYICSGVFGDNPRPEDGTGSCGPVYVDGANGVKGFSYRYGNGVWIGRTKSHSSRHGFEMIWDPNGWTETDSKFSVRQDVVAMTDWSGYSGSFVQHPELTGLDCMRPCFWVELIRGRPKEKTIWTSASSISFCGVNSDTVDWSWPDGAELPFSIDK 9GQT,9GQQ Neuraminidase NRAM_I34A1 P03468 A4GXH6 Q20N35 Q84043 Q8JUU4 8373 CCCCN(CC)[C@@H]1C=C(C[C@H](N)[C@H]1NC(C)=O)C(O)=O |r,c:8| InChI=1S/C15H27N3O3/c1-4-6-7-18(5-2)13-9-11(15(20)21)8-12(16)14(13)17-10(3)19/h9,12-14H,4-8,16H2,1-3H3,(H,17,19)(H,20,21) XAOXVEKLSJSSHZ-UHFFFAOYSA-N 5231 (3R,4R,5S)-5-amino-3-[butyl(ethyl)amino]-4-acetamidocyclohex-1-ene-1-carboxylic acid::C3-Aza Carbocyclic Analogue 3g Neuraminidase Influenza A virus (strain A/Puerto Rico/8/1934 H1N1) 85 6.5000 37.00 C Curated from the literature by BindingDB 10.1016/s0960-894x(98)00587-3 10.7270/Q2B56GXM 9873727 aid1795758 Lew, W; Wu, H; Mendel, DB; Escarpe, PA; Chen, X; Laver, WG; Graves, BJ; Kim, CU 12/1/1998 7/27/2005 Gilead Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=5231 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=753&target=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=5231&enzyme=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search 5329310 8034860 1 MNPNQKIITIGSICLVVGLISLILQIGNIISIWISHSIQTGSQNHTGICNQNIITYKNSTWVKDTTSVILTGNSSLCPIRGWAIYSKDNSIRIGSKGDVFVIREPFISCSHLECRTFFLTQGALLNDKHSNGTVKDRSPYRALMSCPVGEAPSPYNSRFESVAWSASACHDGMGWLTIGISGPDNGAVAVLKYNGIITETIKSWRKKILRTQESECACVNGSCFTIMTDGPSDGLASYKIFKIEKGKVTKSIELNAPNSHYEECSCYPDTGKVMCVCRDNWHGSNRPWVSFDQNLDYQIGYICSGVFGDNPRPEDGTGSCGPVYVDGANGVKGFSYRYGNGVWIGRTKSHSSRHGFEMIWDPNGWTETDSKFSVRQDVVAMTDWSGYSGSFVQHPELTGLDCMRPCFWVELIRGRPKEKTIWTSASSISFCGVNSDTVDWSWPDGAELPFSIDK 9GQT,9GQQ Neuraminidase NRAM_I34A1 P03468 A4GXH6 Q20N35 Q84043 Q8JUU4 8374 CCCN(CCC)[C@@H]1C=C(C[C@H](N)[C@H]1NC(C)=O)C(O)=O |r,c:8| InChI=1S/C15H27N3O3/c1-4-6-18(7-5-2)13-9-11(15(20)21)8-12(16)14(13)17-10(3)19/h9,12-14H,4-8,16H2,1-3H3,(H,17,19)(H,20,21) MUAKAPZVYKVOTQ-UHFFFAOYSA-N 5232 (3R,4R,5S)-5-amino-3-(dipropylamino)-4-acetamidocyclohex-1-ene-1-carboxylic acid::C3-Aza Carbocyclic Analogue 3h Neuraminidase Influenza A virus (strain A/Puerto Rico/8/1934 H1N1) 12 6.5000 37.00 C Curated from the literature by BindingDB 10.1016/s0960-894x(98)00587-3 10.7270/Q2B56GXM 9873727 aid1795758 Lew, W; Wu, H; Mendel, DB; Escarpe, PA; Chen, X; Laver, WG; Graves, BJ; Kim, CU 12/1/1998 7/27/2005 Gilead Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=5232 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=753&target=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=5232&enzyme=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search 5329311 8034861 1 MNPNQKIITIGSICLVVGLISLILQIGNIISIWISHSIQTGSQNHTGICNQNIITYKNSTWVKDTTSVILTGNSSLCPIRGWAIYSKDNSIRIGSKGDVFVIREPFISCSHLECRTFFLTQGALLNDKHSNGTVKDRSPYRALMSCPVGEAPSPYNSRFESVAWSASACHDGMGWLTIGISGPDNGAVAVLKYNGIITETIKSWRKKILRTQESECACVNGSCFTIMTDGPSDGLASYKIFKIEKGKVTKSIELNAPNSHYEECSCYPDTGKVMCVCRDNWHGSNRPWVSFDQNLDYQIGYICSGVFGDNPRPEDGTGSCGPVYVDGANGVKGFSYRYGNGVWIGRTKSHSSRHGFEMIWDPNGWTETDSKFSVRQDVVAMTDWSGYSGSFVQHPELTGLDCMRPCFWVELIRGRPKEKTIWTSASSISFCGVNSDTVDWSWPDGAELPFSIDK 9GQT,9GQQ Neuraminidase NRAM_I34A1 P03468 A4GXH6 Q20N35 Q84043 Q8JUU4 8375 CCCN[C@@H]1C=C(C[C@H](N)[C@H]1NC(C)=O)C(O)=O |r,c:5| InChI=1S/C12H21N3O3/c1-3-4-14-10-6-8(12(17)18)5-9(13)11(10)15-7(2)16/h6,9-11,14H,3-5,13H2,1-2H3,(H,15,16)(H,17,18) FNCJWVGYTHJBEJ-UHFFFAOYSA-N 5233 (3R,4R,5S)-5-amino-4-acetamido-3-(propylamino)cyclohex-1-ene-1-carboxylic acid::C3-Aza Carbocyclic Analogue 3i Neuraminidase Influenza A virus (strain A/Puerto Rico/8/1934 H1N1) 200 6.5000 37.00 C Curated from the literature by BindingDB 10.1016/s0960-894x(98)00587-3 10.7270/Q2B56GXM 9873727 aid1795758 Lew, W; Wu, H; Mendel, DB; Escarpe, PA; Chen, X; Laver, WG; Graves, BJ; Kim, CU 12/1/1998 7/27/2005 Gilead Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=5233 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=753&target=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=5233&enzyme=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search 5329312 8034862 1 MNPNQKIITIGSICLVVGLISLILQIGNIISIWISHSIQTGSQNHTGICNQNIITYKNSTWVKDTTSVILTGNSSLCPIRGWAIYSKDNSIRIGSKGDVFVIREPFISCSHLECRTFFLTQGALLNDKHSNGTVKDRSPYRALMSCPVGEAPSPYNSRFESVAWSASACHDGMGWLTIGISGPDNGAVAVLKYNGIITETIKSWRKKILRTQESECACVNGSCFTIMTDGPSDGLASYKIFKIEKGKVTKSIELNAPNSHYEECSCYPDTGKVMCVCRDNWHGSNRPWVSFDQNLDYQIGYICSGVFGDNPRPEDGTGSCGPVYVDGANGVKGFSYRYGNGVWIGRTKSHSSRHGFEMIWDPNGWTETDSKFSVRQDVVAMTDWSGYSGSFVQHPELTGLDCMRPCFWVELIRGRPKEKTIWTSASSISFCGVNSDTVDWSWPDGAELPFSIDK 9GQT,9GQQ Neuraminidase NRAM_I34A1 P03468 A4GXH6 Q20N35 Q84043 Q8JUU4 8376 CCC(CC)N[C@@H]1C=C(C[C@H](N)[C@H]1NC(C)=O)C(O)=O |r,c:7| InChI=1S/C14H25N3O3/c1-4-10(5-2)17-12-7-9(14(19)20)6-11(15)13(12)16-8(3)18/h7,10-13,17H,4-6,15H2,1-3H3,(H,16,18)(H,19,20) DLUDMOWAEDKCDD-UHFFFAOYSA-N 5234 (3R,4R,5S)-5-amino-4-acetamido-3-(pentan-3-ylamino)cyclohex-1-ene-1-carboxylic acid::CHEMBL320978::C3-Aza Carbocyclic Analogue 3j Neuraminidase Influenza A virus (strain A/Puerto Rico/8/1934 H1N1) 11 6.5000 37.00 C Curated from the literature by BindingDB 10.1016/s0960-894x(98)00587-3 10.7270/Q2B56GXM 9873727 aid1795758 Lew, W; Wu, H; Mendel, DB; Escarpe, PA; Chen, X; Laver, WG; Graves, BJ; Kim, CU 12/1/1998 7/27/2005 Gilead Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=5234 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=753&target=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=5234&enzyme=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search 5329313 8034863 CHEMBL320978 1 MNPNQKIITIGSICLVVGLISLILQIGNIISIWISHSIQTGSQNHTGICNQNIITYKNSTWVKDTTSVILTGNSSLCPIRGWAIYSKDNSIRIGSKGDVFVIREPFISCSHLECRTFFLTQGALLNDKHSNGTVKDRSPYRALMSCPVGEAPSPYNSRFESVAWSASACHDGMGWLTIGISGPDNGAVAVLKYNGIITETIKSWRKKILRTQESECACVNGSCFTIMTDGPSDGLASYKIFKIEKGKVTKSIELNAPNSHYEECSCYPDTGKVMCVCRDNWHGSNRPWVSFDQNLDYQIGYICSGVFGDNPRPEDGTGSCGPVYVDGANGVKGFSYRYGNGVWIGRTKSHSSRHGFEMIWDPNGWTETDSKFSVRQDVVAMTDWSGYSGSFVQHPELTGLDCMRPCFWVELIRGRPKEKTIWTSASSISFCGVNSDTVDWSWPDGAELPFSIDK 9GQT,9GQQ Neuraminidase NRAM_I34A1 P03468 A4GXH6 Q20N35 Q84043 Q8JUU4 8377 CCC(=O)N[C@@H]1C=C(C[C@H](N)[C@H]1NC(C)=O)C(O)=O |r,c:6| InChI=1S/C12H19N3O4/c1-3-10(17)15-9-5-7(12(18)19)4-8(13)11(9)14-6(2)16/h5,8-9,11H,3-4,13H2,1-2H3,(H,14,16)(H,15,17)(H,18,19) VIPZFBVMNXXPOS-UHFFFAOYSA-N 5235 (3R,4R,5S)-5-amino-4-acetamido-3-propanamidocyclohex-1-ene-1-carboxylic acid::C3-Aza Carbocyclic Analogue 3k Neuraminidase Influenza A virus (strain A/Puerto Rico/8/1934 H1N1) 2700 6.5000 37.00 C Curated from the literature by BindingDB 10.1016/s0960-894x(98)00587-3 10.7270/Q2B56GXM 9873727 aid1795758 Lew, W; Wu, H; Mendel, DB; Escarpe, PA; Chen, X; Laver, WG; Graves, BJ; Kim, CU 12/1/1998 7/27/2005 Gilead Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=5235 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=753&target=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=5235&enzyme=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search 5329314 8034864 1 MNPNQKIITIGSICLVVGLISLILQIGNIISIWISHSIQTGSQNHTGICNQNIITYKNSTWVKDTTSVILTGNSSLCPIRGWAIYSKDNSIRIGSKGDVFVIREPFISCSHLECRTFFLTQGALLNDKHSNGTVKDRSPYRALMSCPVGEAPSPYNSRFESVAWSASACHDGMGWLTIGISGPDNGAVAVLKYNGIITETIKSWRKKILRTQESECACVNGSCFTIMTDGPSDGLASYKIFKIEKGKVTKSIELNAPNSHYEECSCYPDTGKVMCVCRDNWHGSNRPWVSFDQNLDYQIGYICSGVFGDNPRPEDGTGSCGPVYVDGANGVKGFSYRYGNGVWIGRTKSHSSRHGFEMIWDPNGWTETDSKFSVRQDVVAMTDWSGYSGSFVQHPELTGLDCMRPCFWVELIRGRPKEKTIWTSASSISFCGVNSDTVDWSWPDGAELPFSIDK 9GQT,9GQQ Neuraminidase NRAM_I34A1 P03468 A4GXH6 Q20N35 Q84043 Q8JUU4 8378 CC(C)C(=O)N[C@@H]1C=C(C[C@H](N)[C@H]1NC(C)=O)C(O)=O |r,c:7| InChI=1S/C13H21N3O4/c1-6(2)12(18)16-10-5-8(13(19)20)4-9(14)11(10)15-7(3)17/h5-6,9-11H,4,14H2,1-3H3,(H,15,17)(H,16,18)(H,19,20) ZDYZHXUKXANZNA-UHFFFAOYSA-N 5236 (3R,4R,5S)-5-amino-4-acetamido-3-(2-methylpropanamido)cyclohex-1-ene-1-carboxylic acid::C3-Aza Carbocyclic Analogue 3l Neuraminidase Influenza A virus (strain A/Puerto Rico/8/1934 H1N1) 6400 6.5000 37.00 C Curated from the literature by BindingDB 10.1016/s0960-894x(98)00587-3 10.7270/Q2B56GXM 9873727 aid1795758 Lew, W; Wu, H; Mendel, DB; Escarpe, PA; Chen, X; Laver, WG; Graves, BJ; Kim, CU 12/1/1998 7/27/2005 Gilead Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=5236 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=753&target=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=5236&enzyme=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search 5329315 8034865 1 MNPNQKIITIGSICLVVGLISLILQIGNIISIWISHSIQTGSQNHTGICNQNIITYKNSTWVKDTTSVILTGNSSLCPIRGWAIYSKDNSIRIGSKGDVFVIREPFISCSHLECRTFFLTQGALLNDKHSNGTVKDRSPYRALMSCPVGEAPSPYNSRFESVAWSASACHDGMGWLTIGISGPDNGAVAVLKYNGIITETIKSWRKKILRTQESECACVNGSCFTIMTDGPSDGLASYKIFKIEKGKVTKSIELNAPNSHYEECSCYPDTGKVMCVCRDNWHGSNRPWVSFDQNLDYQIGYICSGVFGDNPRPEDGTGSCGPVYVDGANGVKGFSYRYGNGVWIGRTKSHSSRHGFEMIWDPNGWTETDSKFSVRQDVVAMTDWSGYSGSFVQHPELTGLDCMRPCFWVELIRGRPKEKTIWTSASSISFCGVNSDTVDWSWPDGAELPFSIDK 9GQT,9GQQ Neuraminidase NRAM_I34A1 P03468 A4GXH6 Q20N35 Q84043 Q8JUU4 8379 CCC(CC)C(=O)N[C@@H]1C=C(C[C@H](N)[C@H]1NC(C)=O)C(O)=O |r,c:9| InChI=1S/C15H25N3O4/c1-4-9(5-2)14(20)18-12-7-10(15(21)22)6-11(16)13(12)17-8(3)19/h7,9,11-13H,4-6,16H2,1-3H3,(H,17,19)(H,18,20)(H,21,22) RUXBAAFLWYBMAI-UHFFFAOYSA-N 5237 (3R,4R,5S)-5-amino-4-acetamido-3-(2-ethylbutanamido)cyclohex-1-ene-1-carboxylic acid::C3-Aza Carbocyclic Analogue 3m Neuraminidase Influenza A virus (strain A/Puerto Rico/8/1934 H1N1) 4000 6.5000 37.00 C Curated from the literature by BindingDB 10.1016/s0960-894x(98)00587-3 10.7270/Q2B56GXM 9873727 aid1795758 Lew, W; Wu, H; Mendel, DB; Escarpe, PA; Chen, X; Laver, WG; Graves, BJ; Kim, CU 12/1/1998 7/27/2005 Gilead Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=5237 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=753&target=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=5237&enzyme=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search 5329316 8034866 1 MNPNQKIITIGSICLVVGLISLILQIGNIISIWISHSIQTGSQNHTGICNQNIITYKNSTWVKDTTSVILTGNSSLCPIRGWAIYSKDNSIRIGSKGDVFVIREPFISCSHLECRTFFLTQGALLNDKHSNGTVKDRSPYRALMSCPVGEAPSPYNSRFESVAWSASACHDGMGWLTIGISGPDNGAVAVLKYNGIITETIKSWRKKILRTQESECACVNGSCFTIMTDGPSDGLASYKIFKIEKGKVTKSIELNAPNSHYEECSCYPDTGKVMCVCRDNWHGSNRPWVSFDQNLDYQIGYICSGVFGDNPRPEDGTGSCGPVYVDGANGVKGFSYRYGNGVWIGRTKSHSSRHGFEMIWDPNGWTETDSKFSVRQDVVAMTDWSGYSGSFVQHPELTGLDCMRPCFWVELIRGRPKEKTIWTSASSISFCGVNSDTVDWSWPDGAELPFSIDK 9GQT,9GQQ Neuraminidase NRAM_I34A1 P03468 A4GXH6 Q20N35 Q84043 Q8JUU4 8380 CCC(CC)O[C@@H]1C=C(C[C@H](N)[C@H]1NC(C)=O)C(O)=O |r,c:7| InChI=1S/C14H24N2O4/c1-4-10(5-2)20-12-7-9(14(18)19)6-11(15)13(12)16-8(3)17/h7,10-13H,4-6,15H2,1-3H3,(H,16,17)(H,18,19) NENPYTRHICXVCS-UHFFFAOYSA-N 4994 CHEMBL674::(3R,4R,5S)-5-amino-4-acetamido-3-(pentan-3-yloxy)cyclohex-1-ene-1-carboxylic acid::GS4071::Oseltamivir carboxylate Neuraminidase Influenza A virus (strain A/Puerto Rico/8/1934 H1N1) 1 6.5000 37.00 C Curated from the literature by BindingDB 10.1016/s0960-894x(98)00587-3 10.7270/Q2B56GXM 9873727 aid1795758 Lew, W; Wu, H; Mendel, DB; Escarpe, PA; Chen, X; Laver, WG; Graves, BJ; Kim, CU 12/1/1998 7/27/2005 Gilead Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=4994 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=753&target=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=4994&enzyme=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search 449381 8034633 CHEMBL674 1 MNPNQKIITIGSICLVVGLISLILQIGNIISIWISHSIQTGSQNHTGICNQNIITYKNSTWVKDTTSVILTGNSSLCPIRGWAIYSKDNSIRIGSKGDVFVIREPFISCSHLECRTFFLTQGALLNDKHSNGTVKDRSPYRALMSCPVGEAPSPYNSRFESVAWSASACHDGMGWLTIGISGPDNGAVAVLKYNGIITETIKSWRKKILRTQESECACVNGSCFTIMTDGPSDGLASYKIFKIEKGKVTKSIELNAPNSHYEECSCYPDTGKVMCVCRDNWHGSNRPWVSFDQNLDYQIGYICSGVFGDNPRPEDGTGSCGPVYVDGANGVKGFSYRYGNGVWIGRTKSHSSRHGFEMIWDPNGWTETDSKFSVRQDVVAMTDWSGYSGSFVQHPELTGLDCMRPCFWVELIRGRPKEKTIWTSASSISFCGVNSDTVDWSWPDGAELPFSIDK 9GQT,9GQQ Neuraminidase NRAM_I34A1 P03468 A4GXH6 Q20N35 Q84043 Q8JUU4 8393 CCCS[C@@H]1C=C(C[C@H](N)[C@H]1NC(C)=O)C(O)=O |r,c:5| InChI=1S/C12H20N2O3S/c1-3-4-18-10-6-8(12(16)17)5-9(13)11(10)14-7(2)15/h6,9-11H,3-5,13H2,1-2H3,(H,14,15)(H,16,17) SYMUFQWWJBHWKE-UHFFFAOYSA-N 5238 (3R,4R,5S)-5-amino-4-acetamido-3-(propylsulfanyl)cyclohex-1-ene-1-carboxylic acid::C3-Thia Carbocyclic Analogue 4 Neuraminidase Influenza A virus (strain A/Puerto Rico/8/1934 H1N1) 212 Curated from the literature by BindingDB 10.1016/s0960-894x(98)00587-3 10.7270/Q2B56GXM 9873727 aid1795758 Lew, W; Wu, H; Mendel, DB; Escarpe, PA; Chen, X; Laver, WG; Graves, BJ; Kim, CU 12/1/1998 7/27/2005 Gilead Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=5238 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=753&target=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=5238&enzyme=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search 505927 8034867 1 MNPNQKIITIGSICLVVGLISLILQIGNIISIWISHSIQTGSQNHTGICNQNIITYKNSTWVKDTTSVILTGNSSLCPIRGWAIYSKDNSIRIGSKGDVFVIREPFISCSHLECRTFFLTQGALLNDKHSNGTVKDRSPYRALMSCPVGEAPSPYNSRFESVAWSASACHDGMGWLTIGISGPDNGAVAVLKYNGIITETIKSWRKKILRTQESECACVNGSCFTIMTDGPSDGLASYKIFKIEKGKVTKSIELNAPNSHYEECSCYPDTGKVMCVCRDNWHGSNRPWVSFDQNLDYQIGYICSGVFGDNPRPEDGTGSCGPVYVDGANGVKGFSYRYGNGVWIGRTKSHSSRHGFEMIWDPNGWTETDSKFSVRQDVVAMTDWSGYSGSFVQHPELTGLDCMRPCFWVELIRGRPKEKTIWTSASSISFCGVNSDTVDWSWPDGAELPFSIDK 9GQT,9GQQ Neuraminidase NRAM_I34A1 P03468 A4GXH6 Q20N35 Q84043 Q8JUU4 8394 CCCC[C@@H]1C=C(C[C@H](N)[C@H]1NC(C)=O)C(O)=O |r,c:5| InChI=1S/C13H22N2O3/c1-3-4-5-9-6-10(13(17)18)7-11(14)12(9)15-8(2)16/h6,9,11-12H,3-5,7,14H2,1-2H3,(H,15,16)(H,17,18) PBGQJNIKRSVZMP-UHFFFAOYSA-N 5242 (3R,4S,5S)-5-amino-3-butyl-4-acetamidocyclohex-1-ene-1-carboxylic acid::Carbocyclic Analogue 5 Neuraminidase Influenza A virus (strain A/Puerto Rico/8/1934 H1N1) 220 Curated from the literature by BindingDB 10.1016/s0960-894x(98)00587-3 10.7270/Q2B56GXM 9873727 aid1795758 Lew, W; Wu, H; Mendel, DB; Escarpe, PA; Chen, X; Laver, WG; Graves, BJ; Kim, CU 12/1/1998 7/27/2005 Gilead Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=5242 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=753&target=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=5242&enzyme=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search 505928 8034870 1 MNPNQKIITIGSICLVVGLISLILQIGNIISIWISHSIQTGSQNHTGICNQNIITYKNSTWVKDTTSVILTGNSSLCPIRGWAIYSKDNSIRIGSKGDVFVIREPFISCSHLECRTFFLTQGALLNDKHSNGTVKDRSPYRALMSCPVGEAPSPYNSRFESVAWSASACHDGMGWLTIGISGPDNGAVAVLKYNGIITETIKSWRKKILRTQESECACVNGSCFTIMTDGPSDGLASYKIFKIEKGKVTKSIELNAPNSHYEECSCYPDTGKVMCVCRDNWHGSNRPWVSFDQNLDYQIGYICSGVFGDNPRPEDGTGSCGPVYVDGANGVKGFSYRYGNGVWIGRTKSHSSRHGFEMIWDPNGWTETDSKFSVRQDVVAMTDWSGYSGSFVQHPELTGLDCMRPCFWVELIRGRPKEKTIWTSASSISFCGVNSDTVDWSWPDGAELPFSIDK 9GQT,9GQQ Neuraminidase NRAM_I34A1 P03468 A4GXH6 Q20N35 Q84043 Q8JUU4 8395 CCCO[C@@H]1C=C(C[C@H](N)[C@H]1NC(C)=O)C(O)=O |r,c:5| InChI=1S/C12H20N2O4/c1-3-4-18-10-6-8(12(16)17)5-9(13)11(10)14-7(2)15/h6,9-11H,3-5,13H2,1-2H3,(H,14,15)(H,16,17) UNJFVQQPDOQFDW-UHFFFAOYSA-N 4983 Carbocyclic Analogue 3::(3R,4R,5S)-5-amino-4-acetamido-3-propoxycyclohex-1-ene-1-carboxylic acid::Carbocyclic Analogue 34 Neuraminidase Influenza A virus (strain A/Puerto Rico/8/1934 H1N1) 130 Curated from the literature by BindingDB 10.1016/s0960-894x(98)00587-3 10.7270/Q2B56GXM 9873727 aid1795758 Lew, W; Wu, H; Mendel, DB; Escarpe, PA; Chen, X; Laver, WG; Graves, BJ; Kim, CU 12/1/1998 7/27/2005 Gilead Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=4983 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=753&target=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=4983&enzyme=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search 480258 8034622 1 MNPNQKIITIGSICLVVGLISLILQIGNIISIWISHSIQTGSQNHTGICNQNIITYKNSTWVKDTTSVILTGNSSLCPIRGWAIYSKDNSIRIGSKGDVFVIREPFISCSHLECRTFFLTQGALLNDKHSNGTVKDRSPYRALMSCPVGEAPSPYNSRFESVAWSASACHDGMGWLTIGISGPDNGAVAVLKYNGIITETIKSWRKKILRTQESECACVNGSCFTIMTDGPSDGLASYKIFKIEKGKVTKSIELNAPNSHYEECSCYPDTGKVMCVCRDNWHGSNRPWVSFDQNLDYQIGYICSGVFGDNPRPEDGTGSCGPVYVDGANGVKGFSYRYGNGVWIGRTKSHSSRHGFEMIWDPNGWTETDSKFSVRQDVVAMTDWSGYSGSFVQHPELTGLDCMRPCFWVELIRGRPKEKTIWTSASSISFCGVNSDTVDWSWPDGAELPFSIDK 9GQT,9GQQ Neuraminidase NRAM_I34A1 P03468 A4GXH6 Q20N35 Q84043 Q8JUU4 8396 CCC(CC)O[C@H]1[C@H](NC(C)=O)[C@@H](N)CC(C(O)=O)=C1Cl |r,c:18| InChI=1S/C14H23ClN2O4/c1-4-8(5-2)21-13-11(15)9(14(19)20)6-10(16)12(13)17-7(3)18/h8,10,12-13H,4-6,16H2,1-3H3,(H,17,18)(H,19,20) YORQPJJSBLLNJV-UHFFFAOYSA-N 5239 (3S,4R,5S)-5-amino-2-chloro-4-acetamido-3-(pentan-3-yloxy)cyclohex-1-ene-1-carboxylic acid::C2-Substituted Carbocyclic Analogue 2 Neuraminidase Influenza A virus (strain A/Puerto Rico/8/1934 H1N1) 3100 Curated from the literature by BindingDB 10.1016/s0960-894x(98)00587-3 10.7270/Q2B56GXM 9873727 aid1795758 Lew, W; Wu, H; Mendel, DB; Escarpe, PA; Chen, X; Laver, WG; Graves, BJ; Kim, CU 12/1/1998 7/27/2005 Gilead Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=5239 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=753&target=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=5239&enzyme=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search 505929 8034868 1 MNPNQKIITIGSICLVVGLISLILQIGNIISIWISHSIQTGSQNHTGICNQNIITYKNSTWVKDTTSVILTGNSSLCPIRGWAIYSKDNSIRIGSKGDVFVIREPFISCSHLECRTFFLTQGALLNDKHSNGTVKDRSPYRALMSCPVGEAPSPYNSRFESVAWSASACHDGMGWLTIGISGPDNGAVAVLKYNGIITETIKSWRKKILRTQESECACVNGSCFTIMTDGPSDGLASYKIFKIEKGKVTKSIELNAPNSHYEECSCYPDTGKVMCVCRDNWHGSNRPWVSFDQNLDYQIGYICSGVFGDNPRPEDGTGSCGPVYVDGANGVKGFSYRYGNGVWIGRTKSHSSRHGFEMIWDPNGWTETDSKFSVRQDVVAMTDWSGYSGSFVQHPELTGLDCMRPCFWVELIRGRPKEKTIWTSASSISFCGVNSDTVDWSWPDGAELPFSIDK 9GQT,9GQQ Neuraminidase NRAM_I34A1 P03468 A4GXH6 Q20N35 Q84043 Q8JUU4 8397 CCC(CC)O[C@H]1[C@H](NC(C)=O)[C@@H](N)CC(C(O)=O)=C1SC |r,c:18| InChI=1S/C15H26N2O4S/c1-5-9(6-2)21-13-12(17-8(3)18)11(16)7-10(15(19)20)14(13)22-4/h9,11-13H,5-7,16H2,1-4H3,(H,17,18)(H,19,20) MILZGVDOBKGGQY-UHFFFAOYSA-N 5240 (3S,4R,5S)-5-amino-4-acetamido-2-(methylsulfanyl)-3-(pentan-3-yloxy)cyclohex-1-ene-1-carboxylic acid::C2-Substituted Carbocyclic Analogue 3 Neuraminidase Influenza A virus (strain A/Puerto Rico/8/1934 H1N1) 3400 Curated from the literature by BindingDB 10.1016/s0960-894x(98)00587-3 10.7270/Q2B56GXM 9873727 aid1795758 Lew, W; Wu, H; Mendel, DB; Escarpe, PA; Chen, X; Laver, WG; Graves, BJ; Kim, CU 12/1/1998 7/27/2005 Gilead Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=5240 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=753&target=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=5240&enzyme=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search 505930 8034869 1 MNPNQKIITIGSICLVVGLISLILQIGNIISIWISHSIQTGSQNHTGICNQNIITYKNSTWVKDTTSVILTGNSSLCPIRGWAIYSKDNSIRIGSKGDVFVIREPFISCSHLECRTFFLTQGALLNDKHSNGTVKDRSPYRALMSCPVGEAPSPYNSRFESVAWSASACHDGMGWLTIGISGPDNGAVAVLKYNGIITETIKSWRKKILRTQESECACVNGSCFTIMTDGPSDGLASYKIFKIEKGKVTKSIELNAPNSHYEECSCYPDTGKVMCVCRDNWHGSNRPWVSFDQNLDYQIGYICSGVFGDNPRPEDGTGSCGPVYVDGANGVKGFSYRYGNGVWIGRTKSHSSRHGFEMIWDPNGWTETDSKFSVRQDVVAMTDWSGYSGSFVQHPELTGLDCMRPCFWVELIRGRPKEKTIWTSASSISFCGVNSDTVDWSWPDGAELPFSIDK 9GQT,9GQQ Neuraminidase NRAM_I34A1 P03468 A4GXH6 Q20N35 Q84043 Q8JUU4 8398 CCC(CC)O[C@H]1[C@H](NC(C)=O)[C@@H](N)CC(C(O)=O)=C1C |r,c:18| InChI=1S/C15H26N2O4/c1-5-10(6-2)21-14-8(3)11(15(19)20)7-12(16)13(14)17-9(4)18/h10,12-14H,5-7,16H2,1-4H3,(H,17,18)(H,19,20) FYSOMEMGLOCHIM-UHFFFAOYSA-N 5014 C2-Substituted Carbocyclic Analogue 4::(3R,4R,5S)-5-amino-4-acetamido-2-methyl-3-(pentan-3-yloxy)cyclohex-1-ene-1-carboxylic acid::Carbocyclic Analogue 64 Neuraminidase Influenza A virus (strain A/Puerto Rico/8/1934 H1N1) 2300 Curated from the literature by BindingDB 10.1016/s0960-894x(98)00587-3 10.7270/Q2B56GXM 9873727 aid1795758 Lew, W; Wu, H; Mendel, DB; Escarpe, PA; Chen, X; Laver, WG; Graves, BJ; Kim, CU 12/1/1998 7/27/2005 Gilead Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=5014 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=753&target=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=5014&enzyme=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search 493876 8034653 1 MNPNQKIITIGSICLVVGLISLILQIGNIISIWISHSIQTGSQNHTGICNQNIITYKNSTWVKDTTSVILTGNSSLCPIRGWAIYSKDNSIRIGSKGDVFVIREPFISCSHLECRTFFLTQGALLNDKHSNGTVKDRSPYRALMSCPVGEAPSPYNSRFESVAWSASACHDGMGWLTIGISGPDNGAVAVLKYNGIITETIKSWRKKILRTQESECACVNGSCFTIMTDGPSDGLASYKIFKIEKGKVTKSIELNAPNSHYEECSCYPDTGKVMCVCRDNWHGSNRPWVSFDQNLDYQIGYICSGVFGDNPRPEDGTGSCGPVYVDGANGVKGFSYRYGNGVWIGRTKSHSSRHGFEMIWDPNGWTETDSKFSVRQDVVAMTDWSGYSGSFVQHPELTGLDCMRPCFWVELIRGRPKEKTIWTSASSISFCGVNSDTVDWSWPDGAELPFSIDK 9GQT,9GQQ Neuraminidase NRAM_I34A1 P03468 A4GXH6 Q20N35 Q84043 Q8JUU4 8399 CCC(CC)C(=O)N1N=C(C[C@H](N)[C@H]1NC(C)=O)C(O)=O |r,c:8| InChI=1S/C13H22N4O4/c1-4-8(5-2)12(19)17-11(15-7(3)18)9(14)6-10(16-17)13(20)21/h8-9,11H,4-6,14H2,1-3H3,(H,15,18)(H,20,21) TWIKMSBUPNVIPQ-UHFFFAOYSA-N 5243 (5S,6S)-5-amino-6-acetamido-1-(2-ethylbutanoyl)-1,4,5,6-tetrahydropyridazine-3-carboxylic acid::Tetrahydropyridazine deriv. 15 Neuraminidase Influenza A virus (strain A/Puerto Rico/8/1934 H1N1) 6000 Curated from the literature by BindingDB 10.1016/s0960-894x(99)00280-2 10.7270/Q2ZS2TNF 10406636 aid1794848 Zhang, L; Williams, MA; Mendel, DB; Escarpe, PA; Chen, X; Wang, KY; Graves, BJ; Lawton, G; Kim, CU 7/5/1999 12/13/2017 Gilead Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=5243 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=753&target=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=5243&enzyme=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search 506122 8034871 1 MNPNQKIITIGSICLVVGLISLILQIGNIISIWISHSIQTGSQNHTGICNQNIITYKNSTWVKDTTSVILTGNSSLCPIRGWAIYSKDNSIRIGSKGDVFVIREPFISCSHLECRTFFLTQGALLNDKHSNGTVKDRSPYRALMSCPVGEAPSPYNSRFESVAWSASACHDGMGWLTIGISGPDNGAVAVLKYNGIITETIKSWRKKILRTQESECACVNGSCFTIMTDGPSDGLASYKIFKIEKGKVTKSIELNAPNSHYEECSCYPDTGKVMCVCRDNWHGSNRPWVSFDQNLDYQIGYICSGVFGDNPRPEDGTGSCGPVYVDGANGVKGFSYRYGNGVWIGRTKSHSSRHGFEMIWDPNGWTETDSKFSVRQDVVAMTDWSGYSGSFVQHPELTGLDCMRPCFWVELIRGRPKEKTIWTSASSISFCGVNSDTVDWSWPDGAELPFSIDK 9GQT,9GQQ Neuraminidase NRAM_I34A1 P03468 A4GXH6 Q20N35 Q84043 Q8JUU4 8400 [#6]-[#6]-[#6](-[#6]-[#6])-[#6](=O)-[#7]-1-[#7]=[#6](-[#6]-[#6@H](\[#7]=[#6](/[#7])-[#7])-[#6@H]-1-[#7]-[#6](-[#6])=O)-[#6](-[#8])=O |r,c:8| InChI=1S/C14H2N6O4/c1-4-8(5-2)12(22)20-11(17-7(3)21)9(18-14(15)16)6-10(19-20)13(23)24/h9,11H URVVOVKHMMEBQB-UHFFFAOYSA-N 5244 (5S,6S)-5-carbamimidamido-6-acetamido-1-(2-ethylbutanoyl)-1,4,5,6-tetrahydropyridazine-3-carboxylic acid::Tetrahydropyridazine deriv. 16 Neuraminidase Influenza A virus (strain A/Puerto Rico/8/1934 H1N1) 140 Curated from the literature by BindingDB 10.1016/s0960-894x(99)00280-2 10.7270/Q2ZS2TNF 10406636 aid1794848 Zhang, L; Williams, MA; Mendel, DB; Escarpe, PA; Chen, X; Wang, KY; Graves, BJ; Lawton, G; Kim, CU 7/5/1999 12/13/2017 Gilead Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=5244 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=753&target=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=5244&enzyme=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search 506123 8034872 1 MNPNQKIITIGSICLVVGLISLILQIGNIISIWISHSIQTGSQNHTGICNQNIITYKNSTWVKDTTSVILTGNSSLCPIRGWAIYSKDNSIRIGSKGDVFVIREPFISCSHLECRTFFLTQGALLNDKHSNGTVKDRSPYRALMSCPVGEAPSPYNSRFESVAWSASACHDGMGWLTIGISGPDNGAVAVLKYNGIITETIKSWRKKILRTQESECACVNGSCFTIMTDGPSDGLASYKIFKIEKGKVTKSIELNAPNSHYEECSCYPDTGKVMCVCRDNWHGSNRPWVSFDQNLDYQIGYICSGVFGDNPRPEDGTGSCGPVYVDGANGVKGFSYRYGNGVWIGRTKSHSSRHGFEMIWDPNGWTETDSKFSVRQDVVAMTDWSGYSGSFVQHPELTGLDCMRPCFWVELIRGRPKEKTIWTSASSISFCGVNSDTVDWSWPDGAELPFSIDK 9GQT,9GQQ Neuraminidase NRAM_I34A1 P03468 A4GXH6 Q20N35 Q84043 Q8JUU4 8401 CCC(CC)C(=O)N1N=C(C[C@@H](N)[C@H]1NC(C)=O)C(O)=O |r,c:8| InChI=1S/C13H22N4O4/c1-4-8(5-2)12(19)17-11(15-7(3)18)9(14)6-10(16-17)13(20)21/h8-9,11H,4-6,14H2,1-3H3,(H,15,18)(H,20,21) TWIKMSBUPNVIPQ-UHFFFAOYSA-N 5245 (5R,6S)-5-amino-6-acetamido-1-(2-ethylbutanoyl)-1,4,5,6-tetrahydropyridazine-3-carboxylic acid::Tetrahydropyridazine deriv. 19 Neuraminidase Influenza A virus (strain A/Puerto Rico/8/1934 H1N1) 160000 Curated from the literature by BindingDB 10.1016/s0960-894x(99)00280-2 10.7270/Q2ZS2TNF 10406636 aid1794848 Zhang, L; Williams, MA; Mendel, DB; Escarpe, PA; Chen, X; Wang, KY; Graves, BJ; Lawton, G; Kim, CU 7/5/1999 12/13/2017 Gilead Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=5245 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=753&target=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=5245&enzyme=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search 506124 8034873 1 MNPNQKIITIGSICLVVGLISLILQIGNIISIWISHSIQTGSQNHTGICNQNIITYKNSTWVKDTTSVILTGNSSLCPIRGWAIYSKDNSIRIGSKGDVFVIREPFISCSHLECRTFFLTQGALLNDKHSNGTVKDRSPYRALMSCPVGEAPSPYNSRFESVAWSASACHDGMGWLTIGISGPDNGAVAVLKYNGIITETIKSWRKKILRTQESECACVNGSCFTIMTDGPSDGLASYKIFKIEKGKVTKSIELNAPNSHYEECSCYPDTGKVMCVCRDNWHGSNRPWVSFDQNLDYQIGYICSGVFGDNPRPEDGTGSCGPVYVDGANGVKGFSYRYGNGVWIGRTKSHSSRHGFEMIWDPNGWTETDSKFSVRQDVVAMTDWSGYSGSFVQHPELTGLDCMRPCFWVELIRGRPKEKTIWTSASSISFCGVNSDTVDWSWPDGAELPFSIDK 9GQT,9GQQ Neuraminidase NRAM_I34A1 P03468 A4GXH6 Q20N35 Q84043 Q8JUU4 8405 CCC(CC)O[C@@H]1C=C(C[C@H](N)[C@H]1NC(C)=O)C(O)=O |r,c:7| InChI=1S/C14H24N2O4/c1-4-10(5-2)20-12-7-9(14(18)19)6-11(15)13(12)16-8(3)17/h7,10-13H,4-6,15H2,1-3H3,(H,16,17)(H,18,19) NENPYTRHICXVCS-UHFFFAOYSA-N 4994 CHEMBL674::(3R,4R,5S)-5-amino-4-acetamido-3-(pentan-3-yloxy)cyclohex-1-ene-1-carboxylic acid::GS4071::Oseltamivir carboxylate Neuraminidase Influenza A virus (strain A/Puerto Rico/8/1934 H1N1) 1 6.5000 37.00 C Curated from the literature by BindingDB 10.1016/s0960-894x(99)00479-5 10.7270/Q26H4FMM 10522696 aid1795760 Lew, W; Escarpe, PA; Mendel, DB; Sweeny, DJ; Kim, CU 10/4/1999 7/28/2005 Gilead Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=4994 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=753&target=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=4994&enzyme=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search 449381 8034633 CHEMBL674 1 MNPNQKIITIGSICLVVGLISLILQIGNIISIWISHSIQTGSQNHTGICNQNIITYKNSTWVKDTTSVILTGNSSLCPIRGWAIYSKDNSIRIGSKGDVFVIREPFISCSHLECRTFFLTQGALLNDKHSNGTVKDRSPYRALMSCPVGEAPSPYNSRFESVAWSASACHDGMGWLTIGISGPDNGAVAVLKYNGIITETIKSWRKKILRTQESECACVNGSCFTIMTDGPSDGLASYKIFKIEKGKVTKSIELNAPNSHYEECSCYPDTGKVMCVCRDNWHGSNRPWVSFDQNLDYQIGYICSGVFGDNPRPEDGTGSCGPVYVDGANGVKGFSYRYGNGVWIGRTKSHSSRHGFEMIWDPNGWTETDSKFSVRQDVVAMTDWSGYSGSFVQHPELTGLDCMRPCFWVELIRGRPKEKTIWTSASSISFCGVNSDTVDWSWPDGAELPFSIDK 9GQT,9GQQ Neuraminidase NRAM_I34A1 P03468 A4GXH6 Q20N35 Q84043 Q8JUU4 8406 [H][C@@](CC)(CC(O)=O)O[C@@H]1C=C(C[C@H](N)[C@H]1NC(C)=O)C(O)=O |r,c:10| InChI=1S/C14H22N2O6/c1-3-9(6-12(18)19)22-11-5-8(14(20)21)4-10(15)13(11)16-7(2)17/h5,9-11,13H,3-4,6,15H2,1-2H3,(H,16,17)(H,18,19)(H,20,21) KYFVIKVFRPMLPH-UHFFFAOYSA-N 5246 (3R,4R,5S)-5-amino-3-{[(2R)-1-carboxybutan-2-yl]oxy}-4-acetamidocyclohex-1-ene-1-carboxylic acid::carbocyclic analog 17 Neuraminidase Influenza A virus (strain A/Puerto Rico/8/1934 H1N1) 450 6.5000 37.00 C Curated from the literature by BindingDB 10.1016/s0960-894x(99)00479-5 10.7270/Q26H4FMM 10522696 aid1795760 Lew, W; Escarpe, PA; Mendel, DB; Sweeny, DJ; Kim, CU 10/4/1999 7/28/2005 Gilead Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=5246 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=753&target=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=5246&enzyme=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search 5329318 8034874 1 MNPNQKIITIGSICLVVGLISLILQIGNIISIWISHSIQTGSQNHTGICNQNIITYKNSTWVKDTTSVILTGNSSLCPIRGWAIYSKDNSIRIGSKGDVFVIREPFISCSHLECRTFFLTQGALLNDKHSNGTVKDRSPYRALMSCPVGEAPSPYNSRFESVAWSASACHDGMGWLTIGISGPDNGAVAVLKYNGIITETIKSWRKKILRTQESECACVNGSCFTIMTDGPSDGLASYKIFKIEKGKVTKSIELNAPNSHYEECSCYPDTGKVMCVCRDNWHGSNRPWVSFDQNLDYQIGYICSGVFGDNPRPEDGTGSCGPVYVDGANGVKGFSYRYGNGVWIGRTKSHSSRHGFEMIWDPNGWTETDSKFSVRQDVVAMTDWSGYSGSFVQHPELTGLDCMRPCFWVELIRGRPKEKTIWTSASSISFCGVNSDTVDWSWPDGAELPFSIDK 9GQT,9GQQ Neuraminidase NRAM_I34A1 P03468 A4GXH6 Q20N35 Q84043 Q8JUU4 8407 [H][C@](CC)(CC(O)=O)O[C@@H]1C=C(C[C@H](N)[C@H]1NC(C)=O)C(O)=O |r,c:10| InChI=1S/C14H22N2O6/c1-3-9(6-12(18)19)22-11-5-8(14(20)21)4-10(15)13(11)16-7(2)17/h5,9-11,13H,3-4,6,15H2,1-2H3,(H,16,17)(H,18,19)(H,20,21) KYFVIKVFRPMLPH-UHFFFAOYSA-N 5247 (3R,4R,5S)-5-amino-3-{[(2S)-1-carboxybutan-2-yl]oxy}-4-acetamidocyclohex-1-ene-1-carboxylic acid::carbocyclic analog 18 Neuraminidase Influenza A virus (strain A/Puerto Rico/8/1934 H1N1) 1150 6.5000 37.00 C Curated from the literature by BindingDB 10.1016/s0960-894x(99)00479-5 10.7270/Q26H4FMM 10522696 aid1795760 Lew, W; Escarpe, PA; Mendel, DB; Sweeny, DJ; Kim, CU 10/4/1999 7/28/2005 Gilead Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=5247 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=753&target=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=5247&enzyme=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search 5329317 8034875 1 MNPNQKIITIGSICLVVGLISLILQIGNIISIWISHSIQTGSQNHTGICNQNIITYKNSTWVKDTTSVILTGNSSLCPIRGWAIYSKDNSIRIGSKGDVFVIREPFISCSHLECRTFFLTQGALLNDKHSNGTVKDRSPYRALMSCPVGEAPSPYNSRFESVAWSASACHDGMGWLTIGISGPDNGAVAVLKYNGIITETIKSWRKKILRTQESECACVNGSCFTIMTDGPSDGLASYKIFKIEKGKVTKSIELNAPNSHYEECSCYPDTGKVMCVCRDNWHGSNRPWVSFDQNLDYQIGYICSGVFGDNPRPEDGTGSCGPVYVDGANGVKGFSYRYGNGVWIGRTKSHSSRHGFEMIWDPNGWTETDSKFSVRQDVVAMTDWSGYSGSFVQHPELTGLDCMRPCFWVELIRGRPKEKTIWTSASSISFCGVNSDTVDWSWPDGAELPFSIDK 9GQT,9GQQ Neuraminidase NRAM_I34A1 P03468 A4GXH6 Q20N35 Q84043 Q8JUU4 8408 [H][C@@](CC)(CCO)O[C@@H]1C=C(C[C@H](N)[C@H]1NC(C)=O)C(O)=O |r,c:9| InChI=1S/C14H24N2O5/c1-3-10(4-5-17)21-12-7-9(14(19)20)6-11(15)13(12)16-8(2)18/h7,10-13,17H,3-6,15H2,1-2H3,(H,16,18)(H,19,20) UOGXNGRTMXTGCK-UHFFFAOYSA-N 5248 (3R,4R,5S)-5-amino-4-acetamido-3-{[(3R)-1-hydroxypentan-3-yl]oxy}cyclohex-1-ene-1-carboxylic acid::carbocyclic analog 19 Neuraminidase Influenza A virus (strain A/Puerto Rico/8/1934 H1N1) 30 6.5000 37.00 C Curated from the literature by BindingDB 10.1016/s0960-894x(99)00479-5 10.7270/Q26H4FMM 10522696 aid1795760 Lew, W; Escarpe, PA; Mendel, DB; Sweeny, DJ; Kim, CU 10/4/1999 7/28/2005 Gilead Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=5248 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=753&target=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=5248&enzyme=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search 5329319 8034876 1 MNPNQKIITIGSICLVVGLISLILQIGNIISIWISHSIQTGSQNHTGICNQNIITYKNSTWVKDTTSVILTGNSSLCPIRGWAIYSKDNSIRIGSKGDVFVIREPFISCSHLECRTFFLTQGALLNDKHSNGTVKDRSPYRALMSCPVGEAPSPYNSRFESVAWSASACHDGMGWLTIGISGPDNGAVAVLKYNGIITETIKSWRKKILRTQESECACVNGSCFTIMTDGPSDGLASYKIFKIEKGKVTKSIELNAPNSHYEECSCYPDTGKVMCVCRDNWHGSNRPWVSFDQNLDYQIGYICSGVFGDNPRPEDGTGSCGPVYVDGANGVKGFSYRYGNGVWIGRTKSHSSRHGFEMIWDPNGWTETDSKFSVRQDVVAMTDWSGYSGSFVQHPELTGLDCMRPCFWVELIRGRPKEKTIWTSASSISFCGVNSDTVDWSWPDGAELPFSIDK 9GQT,9GQQ Neuraminidase NRAM_I34A1 P03468 A4GXH6 Q20N35 Q84043 Q8JUU4 8409 [H][C@](CC)(CCO)O[C@@H]1C=C(C[C@H](N)[C@H]1NC(C)=O)C(O)=O |r,c:9| InChI=1S/C14H24N2O5/c1-3-10(4-5-17)21-12-7-9(14(19)20)6-11(15)13(12)16-8(2)18/h7,10-13,17H,3-6,15H2,1-2H3,(H,16,18)(H,19,20) UOGXNGRTMXTGCK-UHFFFAOYSA-N 5249 (3R,4R,5S)-5-amino-4-acetamido-3-{[(3S)-1-hydroxypentan-3-yl]oxy}cyclohex-1-ene-1-carboxylic acid::carbocyclic analog 20 Neuraminidase Influenza A virus (strain A/Puerto Rico/8/1934 H1N1) 40 6.5000 37.00 C Curated from the literature by BindingDB 10.1016/s0960-894x(99)00479-5 10.7270/Q26H4FMM 10522696 aid1795760 Lew, W; Escarpe, PA; Mendel, DB; Sweeny, DJ; Kim, CU 10/4/1999 7/28/2005 Gilead Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=5249 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=753&target=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=5249&enzyme=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search 5329320 8034877 1 MNPNQKIITIGSICLVVGLISLILQIGNIISIWISHSIQTGSQNHTGICNQNIITYKNSTWVKDTTSVILTGNSSLCPIRGWAIYSKDNSIRIGSKGDVFVIREPFISCSHLECRTFFLTQGALLNDKHSNGTVKDRSPYRALMSCPVGEAPSPYNSRFESVAWSASACHDGMGWLTIGISGPDNGAVAVLKYNGIITETIKSWRKKILRTQESECACVNGSCFTIMTDGPSDGLASYKIFKIEKGKVTKSIELNAPNSHYEECSCYPDTGKVMCVCRDNWHGSNRPWVSFDQNLDYQIGYICSGVFGDNPRPEDGTGSCGPVYVDGANGVKGFSYRYGNGVWIGRTKSHSSRHGFEMIWDPNGWTETDSKFSVRQDVVAMTDWSGYSGSFVQHPELTGLDCMRPCFWVELIRGRPKEKTIWTSASSISFCGVNSDTVDWSWPDGAELPFSIDK 9GQT,9GQQ Neuraminidase NRAM_I34A1 P03468 A4GXH6 Q20N35 Q84043 Q8JUU4 8413 CC(=O)N[C@@H]1[C@@H](N)CC(=C[C@H]1N1CCC1)C(O)=O |r,c:8| InChI=1S/C12H19N3O3/c1-7(16)14-11-9(13)5-8(12(17)18)6-10(11)15-3-2-4-15/h6,9-11H,2-5,13H2,1H3,(H,14,16)(H,17,18) NBJSIQRSLYGYHV-UHFFFAOYSA-N 5250 (3R,4R,5S)-5-amino-3-(azetidin-1-yl)-4-acetamidocyclohex-1-ene-1-carboxylic acid::C3-Cyclic Amine Carbocyclic Analogue 4a Neuraminidase Influenza A virus (strain A/Puerto Rico/8/1934 H1N1) 1000 6.5000 37.00 C Curated from the literature by BindingDB 10.1016/s0960-894x(00)00214-6 10.7270/Q22R3PWW 10866394 aid1795761 Lew, W; Wu, H; Chen, X; Graves, BJ; Escarpe, PA; MacArthur, HL; Mendel, DB; Kim, CU 6/5/2000 7/28/2005 Gilead Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=5250 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=753&target=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=5250&enzyme=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search 506108 8034878 1 MNPNQKIITIGSICLVVGLISLILQIGNIISIWISHSIQTGSQNHTGICNQNIITYKNSTWVKDTTSVILTGNSSLCPIRGWAIYSKDNSIRIGSKGDVFVIREPFISCSHLECRTFFLTQGALLNDKHSNGTVKDRSPYRALMSCPVGEAPSPYNSRFESVAWSASACHDGMGWLTIGISGPDNGAVAVLKYNGIITETIKSWRKKILRTQESECACVNGSCFTIMTDGPSDGLASYKIFKIEKGKVTKSIELNAPNSHYEECSCYPDTGKVMCVCRDNWHGSNRPWVSFDQNLDYQIGYICSGVFGDNPRPEDGTGSCGPVYVDGANGVKGFSYRYGNGVWIGRTKSHSSRHGFEMIWDPNGWTETDSKFSVRQDVVAMTDWSGYSGSFVQHPELTGLDCMRPCFWVELIRGRPKEKTIWTSASSISFCGVNSDTVDWSWPDGAELPFSIDK 9GQT,9GQQ Neuraminidase NRAM_I34A1 P03468 A4GXH6 Q20N35 Q84043 Q8JUU4 8414 CC(=O)N[C@@H]1[C@@H](N)CC(=C[C@H]1N1CCCC1)C(O)=O |r,c:8| InChI=1S/C13H21N3O3/c1-8(17)15-12-10(14)6-9(13(18)19)7-11(12)16-4-2-3-5-16/h7,10-12H,2-6,14H2,1H3,(H,15,17)(H,18,19) JXUYSAJBWAYKTE-UHFFFAOYSA-N 5251 (3R,4R,5S)-5-amino-4-acetamido-3-(pyrrolidin-1-yl)cyclohex-1-ene-1-carboxylic acid::C3-Cyclic Amine Carbocyclic Analogue 4b Neuraminidase Influenza A virus (strain A/Puerto Rico/8/1934 H1N1) 310 6.5000 37.00 C Curated from the literature by BindingDB 10.1016/s0960-894x(00)00214-6 10.7270/Q22R3PWW 10866394 aid1795761 Lew, W; Wu, H; Chen, X; Graves, BJ; Escarpe, PA; MacArthur, HL; Mendel, DB; Kim, CU 6/5/2000 7/28/2005 Gilead Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=5251 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=753&target=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=5251&enzyme=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search 506109 8034879 1 MNPNQKIITIGSICLVVGLISLILQIGNIISIWISHSIQTGSQNHTGICNQNIITYKNSTWVKDTTSVILTGNSSLCPIRGWAIYSKDNSIRIGSKGDVFVIREPFISCSHLECRTFFLTQGALLNDKHSNGTVKDRSPYRALMSCPVGEAPSPYNSRFESVAWSASACHDGMGWLTIGISGPDNGAVAVLKYNGIITETIKSWRKKILRTQESECACVNGSCFTIMTDGPSDGLASYKIFKIEKGKVTKSIELNAPNSHYEECSCYPDTGKVMCVCRDNWHGSNRPWVSFDQNLDYQIGYICSGVFGDNPRPEDGTGSCGPVYVDGANGVKGFSYRYGNGVWIGRTKSHSSRHGFEMIWDPNGWTETDSKFSVRQDVVAMTDWSGYSGSFVQHPELTGLDCMRPCFWVELIRGRPKEKTIWTSASSISFCGVNSDTVDWSWPDGAELPFSIDK 9GQT,9GQQ Neuraminidase NRAM_I34A1 P03468 A4GXH6 Q20N35 Q84043 Q8JUU4 8415 CC(=O)N[C@@H]1[C@@H](N)CC(=C[C@H]1N1CCCCC1)C(O)=O |r,c:8| InChI=1S/C14H23N3O3/c1-9(18)16-13-11(15)7-10(14(19)20)8-12(13)17-5-3-2-4-6-17/h8,11-13H,2-7,15H2,1H3,(H,16,18)(H,19,20) FVJJBGPSFGVUKN-UHFFFAOYSA-N 5252 (3R,4R,5S)-5-amino-4-acetamido-3-(piperidin-1-yl)cyclohex-1-ene-1-carboxylic acid::C3-Cyclic Amine Carbocyclic Analogue 4c Neuraminidase Influenza A virus (strain A/Puerto Rico/8/1934 H1N1) 25 6.5000 37.00 C Curated from the literature by BindingDB 10.1016/s0960-894x(00)00214-6 10.7270/Q22R3PWW 10866394 aid1795761 Lew, W; Wu, H; Chen, X; Graves, BJ; Escarpe, PA; MacArthur, HL; Mendel, DB; Kim, CU 6/5/2000 7/28/2005 Gilead Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=5252 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=753&target=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=5252&enzyme=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search 506110 8034880 1 MNPNQKIITIGSICLVVGLISLILQIGNIISIWISHSIQTGSQNHTGICNQNIITYKNSTWVKDTTSVILTGNSSLCPIRGWAIYSKDNSIRIGSKGDVFVIREPFISCSHLECRTFFLTQGALLNDKHSNGTVKDRSPYRALMSCPVGEAPSPYNSRFESVAWSASACHDGMGWLTIGISGPDNGAVAVLKYNGIITETIKSWRKKILRTQESECACVNGSCFTIMTDGPSDGLASYKIFKIEKGKVTKSIELNAPNSHYEECSCYPDTGKVMCVCRDNWHGSNRPWVSFDQNLDYQIGYICSGVFGDNPRPEDGTGSCGPVYVDGANGVKGFSYRYGNGVWIGRTKSHSSRHGFEMIWDPNGWTETDSKFSVRQDVVAMTDWSGYSGSFVQHPELTGLDCMRPCFWVELIRGRPKEKTIWTSASSISFCGVNSDTVDWSWPDGAELPFSIDK 9GQT,9GQQ Neuraminidase NRAM_I34A1 P03468 A4GXH6 Q20N35 Q84043 Q8JUU4 8416 CC(=O)N[C@@H]1[C@@H](N)CC(=C[C@H]1N1CCCCCC1)C(O)=O |r,c:8| InChI=1S/C15H25N3O3/c1-10(19)17-14-12(16)8-11(15(20)21)9-13(14)18-6-4-2-3-5-7-18/h9,12-14H,2-8,16H2,1H3,(H,17,19)(H,20,21) ATFBWSUHEBLLLQ-UHFFFAOYSA-N 5253 (3R,4R,5S)-5-amino-3-(azepan-1-yl)-4-acetamidocyclohex-1-ene-1-carboxylic acid::C3-Cyclic Amine Carbocyclic Analogue 4d Neuraminidase Influenza A virus (strain A/Puerto Rico/8/1934 H1N1) 35 6.5000 37.00 C Curated from the literature by BindingDB 10.1016/s0960-894x(00)00214-6 10.7270/Q22R3PWW 10866394 aid1795761 Lew, W; Wu, H; Chen, X; Graves, BJ; Escarpe, PA; MacArthur, HL; Mendel, DB; Kim, CU 6/5/2000 7/28/2005 Gilead Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=5253 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=753&target=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=5253&enzyme=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search 506111 8034881 1 MNPNQKIITIGSICLVVGLISLILQIGNIISIWISHSIQTGSQNHTGICNQNIITYKNSTWVKDTTSVILTGNSSLCPIRGWAIYSKDNSIRIGSKGDVFVIREPFISCSHLECRTFFLTQGALLNDKHSNGTVKDRSPYRALMSCPVGEAPSPYNSRFESVAWSASACHDGMGWLTIGISGPDNGAVAVLKYNGIITETIKSWRKKILRTQESECACVNGSCFTIMTDGPSDGLASYKIFKIEKGKVTKSIELNAPNSHYEECSCYPDTGKVMCVCRDNWHGSNRPWVSFDQNLDYQIGYICSGVFGDNPRPEDGTGSCGPVYVDGANGVKGFSYRYGNGVWIGRTKSHSSRHGFEMIWDPNGWTETDSKFSVRQDVVAMTDWSGYSGSFVQHPELTGLDCMRPCFWVELIRGRPKEKTIWTSASSISFCGVNSDTVDWSWPDGAELPFSIDK 9GQT,9GQQ Neuraminidase NRAM_I34A1 P03468 A4GXH6 Q20N35 Q84043 Q8JUU4 8417 CC(=O)N[C@@H]1[C@@H](N)CC(=C[C@H]1N1CCCCCCC1)C(O)=O |r,c:8| InChI=1S/C16H27N3O3/c1-11(20)18-15-13(17)9-12(16(21)22)10-14(15)19-7-5-3-2-4-6-8-19/h10,13-15H,2-9,17H2,1H3,(H,18,20)(H,21,22) HEXKMBDBYKKIII-UHFFFAOYSA-N 5254 (3R,4R,5S)-5-amino-3-(azocan-1-yl)-4-acetamidocyclohex-1-ene-1-carboxylic acid::C3-Cyclic Amine Carbocyclic Analogue 4e Neuraminidase Influenza A virus (strain A/Puerto Rico/8/1934 H1N1) 26 6.5000 37.00 C Curated from the literature by BindingDB 10.1016/s0960-894x(00)00214-6 10.7270/Q22R3PWW 10866394 aid1795761 Lew, W; Wu, H; Chen, X; Graves, BJ; Escarpe, PA; MacArthur, HL; Mendel, DB; Kim, CU 6/5/2000 7/28/2005 Gilead Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=5254 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=753&target=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=5254&enzyme=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search 506112 8034882 1 MNPNQKIITIGSICLVVGLISLILQIGNIISIWISHSIQTGSQNHTGICNQNIITYKNSTWVKDTTSVILTGNSSLCPIRGWAIYSKDNSIRIGSKGDVFVIREPFISCSHLECRTFFLTQGALLNDKHSNGTVKDRSPYRALMSCPVGEAPSPYNSRFESVAWSASACHDGMGWLTIGISGPDNGAVAVLKYNGIITETIKSWRKKILRTQESECACVNGSCFTIMTDGPSDGLASYKIFKIEKGKVTKSIELNAPNSHYEECSCYPDTGKVMCVCRDNWHGSNRPWVSFDQNLDYQIGYICSGVFGDNPRPEDGTGSCGPVYVDGANGVKGFSYRYGNGVWIGRTKSHSSRHGFEMIWDPNGWTETDSKFSVRQDVVAMTDWSGYSGSFVQHPELTGLDCMRPCFWVELIRGRPKEKTIWTSASSISFCGVNSDTVDWSWPDGAELPFSIDK 9GQT,9GQQ Neuraminidase NRAM_I34A1 P03468 A4GXH6 Q20N35 Q84043 Q8JUU4 8418 CC(=O)N[C@@H]1[C@@H](N)CC(=C[C@H]1N1CCCCCCCC1)C(O)=O |r,c:8| InChI=1S/C17H29N3O3/c1-12(21)19-16-14(18)10-13(17(22)23)11-15(16)20-8-6-4-2-3-5-7-9-20/h11,14-16H,2-10,18H2,1H3,(H,19,21)(H,22,23) MWQLSGCFGLUGJI-UHFFFAOYSA-N 5255 (3R,4R,5S)-5-amino-3-(azonan-1-yl)-4-acetamidocyclohex-1-ene-1-carboxylic acid::C3-Cyclic Amine Carbocyclic Analogue 4f Neuraminidase Influenza A virus (strain A/Puerto Rico/8/1934 H1N1) 75 6.5000 37.00 C Curated from the literature by BindingDB 10.1016/s0960-894x(00)00214-6 10.7270/Q22R3PWW 10866394 aid1795761 Lew, W; Wu, H; Chen, X; Graves, BJ; Escarpe, PA; MacArthur, HL; Mendel, DB; Kim, CU 6/5/2000 7/28/2005 Gilead Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=5255 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=753&target=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=5255&enzyme=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search 506113 8034883 1 MNPNQKIITIGSICLVVGLISLILQIGNIISIWISHSIQTGSQNHTGICNQNIITYKNSTWVKDTTSVILTGNSSLCPIRGWAIYSKDNSIRIGSKGDVFVIREPFISCSHLECRTFFLTQGALLNDKHSNGTVKDRSPYRALMSCPVGEAPSPYNSRFESVAWSASACHDGMGWLTIGISGPDNGAVAVLKYNGIITETIKSWRKKILRTQESECACVNGSCFTIMTDGPSDGLASYKIFKIEKGKVTKSIELNAPNSHYEECSCYPDTGKVMCVCRDNWHGSNRPWVSFDQNLDYQIGYICSGVFGDNPRPEDGTGSCGPVYVDGANGVKGFSYRYGNGVWIGRTKSHSSRHGFEMIWDPNGWTETDSKFSVRQDVVAMTDWSGYSGSFVQHPELTGLDCMRPCFWVELIRGRPKEKTIWTSASSISFCGVNSDTVDWSWPDGAELPFSIDK 9GQT,9GQQ Neuraminidase NRAM_I34A1 P03468 A4GXH6 Q20N35 Q84043 Q8JUU4 8419 CCC1(CC)CN(C1)[C@@H]1C=C(C[C@H](N)[C@H]1NC(C)=O)C(O)=O |r,c:10| InChI=1S/C16H27N3O3/c1-4-16(5-2)8-19(9-16)13-7-11(15(21)22)6-12(17)14(13)18-10(3)20/h7,12-14H,4-6,8-9,17H2,1-3H3,(H,18,20)(H,21,22) PEDKXOUMPSDOSW-UHFFFAOYSA-N 5256 (3R,4R,5S)-5-amino-3-(3,3-diethylazetidin-1-yl)-4-acetamidocyclohex-1-ene-1-carboxylic acid::C3-Cyclic Amine Carbocyclic Analogue 4g Neuraminidase Influenza A virus (strain A/Puerto Rico/8/1934 H1N1) 265 6.5000 37.00 C Curated from the literature by BindingDB 10.1016/s0960-894x(00)00214-6 10.7270/Q22R3PWW 10866394 aid1795761 Lew, W; Wu, H; Chen, X; Graves, BJ; Escarpe, PA; MacArthur, HL; Mendel, DB; Kim, CU 6/5/2000 7/28/2005 Gilead Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=5256 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=753&target=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=5256&enzyme=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search 506114 8034884 1 MNPNQKIITIGSICLVVGLISLILQIGNIISIWISHSIQTGSQNHTGICNQNIITYKNSTWVKDTTSVILTGNSSLCPIRGWAIYSKDNSIRIGSKGDVFVIREPFISCSHLECRTFFLTQGALLNDKHSNGTVKDRSPYRALMSCPVGEAPSPYNSRFESVAWSASACHDGMGWLTIGISGPDNGAVAVLKYNGIITETIKSWRKKILRTQESECACVNGSCFTIMTDGPSDGLASYKIFKIEKGKVTKSIELNAPNSHYEECSCYPDTGKVMCVCRDNWHGSNRPWVSFDQNLDYQIGYICSGVFGDNPRPEDGTGSCGPVYVDGANGVKGFSYRYGNGVWIGRTKSHSSRHGFEMIWDPNGWTETDSKFSVRQDVVAMTDWSGYSGSFVQHPELTGLDCMRPCFWVELIRGRPKEKTIWTSASSISFCGVNSDTVDWSWPDGAELPFSIDK 9GQT,9GQQ Neuraminidase NRAM_I34A1 P03468 A4GXH6 Q20N35 Q84043 Q8JUU4 8420 CC(=O)N[C@@H]1[C@@H](N)CC(=C[C@H]1N1CCOCC1)C(O)=O |r,c:8| InChI=1S/C13H21N3O4/c1-8(17)15-12-10(14)6-9(13(18)19)7-11(12)16-2-4-20-5-3-16/h7,10-12H,2-6,14H2,1H3,(H,15,17)(H,18,19) WYWNZCZUCHSVES-UHFFFAOYSA-N 5257 (3R,4R,5S)-5-amino-4-acetamido-3-(morpholin-4-yl)cyclohex-1-ene-1-carboxylic acid::C3-Cyclic Amine Carbocyclic Analogue 4h Neuraminidase Influenza A virus (strain A/Puerto Rico/8/1934 H1N1) 260 6.5000 37.00 C Curated from the literature by BindingDB 10.1016/s0960-894x(00)00214-6 10.7270/Q22R3PWW 10866394 aid1795761 Lew, W; Wu, H; Chen, X; Graves, BJ; Escarpe, PA; MacArthur, HL; Mendel, DB; Kim, CU 6/5/2000 7/28/2005 Gilead Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=5257 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=753&target=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=5257&enzyme=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search 506115 8034885 1 MNPNQKIITIGSICLVVGLISLILQIGNIISIWISHSIQTGSQNHTGICNQNIITYKNSTWVKDTTSVILTGNSSLCPIRGWAIYSKDNSIRIGSKGDVFVIREPFISCSHLECRTFFLTQGALLNDKHSNGTVKDRSPYRALMSCPVGEAPSPYNSRFESVAWSASACHDGMGWLTIGISGPDNGAVAVLKYNGIITETIKSWRKKILRTQESECACVNGSCFTIMTDGPSDGLASYKIFKIEKGKVTKSIELNAPNSHYEECSCYPDTGKVMCVCRDNWHGSNRPWVSFDQNLDYQIGYICSGVFGDNPRPEDGTGSCGPVYVDGANGVKGFSYRYGNGVWIGRTKSHSSRHGFEMIWDPNGWTETDSKFSVRQDVVAMTDWSGYSGSFVQHPELTGLDCMRPCFWVELIRGRPKEKTIWTSASSISFCGVNSDTVDWSWPDGAELPFSIDK 9GQT,9GQQ Neuraminidase NRAM_I34A1 P03468 A4GXH6 Q20N35 Q84043 Q8JUU4 8421 CN1CCN(CC1)[C@@H]1C=C(C[C@H](N)[C@H]1NC(C)=O)C(O)=O |r,c:9| InChI=1S/C14H24N4O3/c1-9(19)16-13-11(15)7-10(14(20)21)8-12(13)18-5-3-17(2)4-6-18/h8,11-13H,3-7,15H2,1-2H3,(H,16,19)(H,20,21) VJTLCZNJZZQWRD-UHFFFAOYSA-N 5258 (3R,4R,5S)-5-amino-4-acetamido-3-(4-methylpiperazin-1-yl)cyclohex-1-ene-1-carboxylic acid::C3-Cyclic Amine Carbocyclic Analogue 4i Neuraminidase Influenza A virus (strain A/Puerto Rico/8/1934 H1N1) 1900 6.5000 37.00 C Curated from the literature by BindingDB 10.1016/s0960-894x(00)00214-6 10.7270/Q22R3PWW 10866394 aid1795761 Lew, W; Wu, H; Chen, X; Graves, BJ; Escarpe, PA; MacArthur, HL; Mendel, DB; Kim, CU 6/5/2000 7/28/2005 Gilead Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=5258 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=753&target=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=5258&enzyme=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search 506116 8034886 1 MNPNQKIITIGSICLVVGLISLILQIGNIISIWISHSIQTGSQNHTGICNQNIITYKNSTWVKDTTSVILTGNSSLCPIRGWAIYSKDNSIRIGSKGDVFVIREPFISCSHLECRTFFLTQGALLNDKHSNGTVKDRSPYRALMSCPVGEAPSPYNSRFESVAWSASACHDGMGWLTIGISGPDNGAVAVLKYNGIITETIKSWRKKILRTQESECACVNGSCFTIMTDGPSDGLASYKIFKIEKGKVTKSIELNAPNSHYEECSCYPDTGKVMCVCRDNWHGSNRPWVSFDQNLDYQIGYICSGVFGDNPRPEDGTGSCGPVYVDGANGVKGFSYRYGNGVWIGRTKSHSSRHGFEMIWDPNGWTETDSKFSVRQDVVAMTDWSGYSGSFVQHPELTGLDCMRPCFWVELIRGRPKEKTIWTSASSISFCGVNSDTVDWSWPDGAELPFSIDK 9GQT,9GQQ Neuraminidase NRAM_I34A1 P03468 A4GXH6 Q20N35 Q84043 Q8JUU4 8422 CC1CCN(CC1)[C@@H]1C=C(C[C@H](N)[C@H]1NC(C)=O)C(O)=O |r,c:9| InChI=1S/C15H25N3O3/c1-9-3-5-18(6-4-9)13-8-11(15(20)21)7-12(16)14(13)17-10(2)19/h8-9,12-14H,3-7,16H2,1-2H3,(H,17,19)(H,20,21) SBDOFJJFSSZHBK-UHFFFAOYSA-N 5259 (3R,4R,5S)-5-amino-4-acetamido-3-(4-methylpiperidin-1-yl)cyclohex-1-ene-1-carboxylic acid::C3-Cyclic Amine Carbocyclic Analogue 4j Neuraminidase Influenza A virus (strain A/Puerto Rico/8/1934 H1N1) 51 6.5000 37.00 C Curated from the literature by BindingDB 10.1016/s0960-894x(00)00214-6 10.7270/Q22R3PWW 10866394 aid1795761 Lew, W; Wu, H; Chen, X; Graves, BJ; Escarpe, PA; MacArthur, HL; Mendel, DB; Kim, CU 6/5/2000 7/28/2005 Gilead Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=5259 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=753&target=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=5259&enzyme=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search 506117 8034887 1 MNPNQKIITIGSICLVVGLISLILQIGNIISIWISHSIQTGSQNHTGICNQNIITYKNSTWVKDTTSVILTGNSSLCPIRGWAIYSKDNSIRIGSKGDVFVIREPFISCSHLECRTFFLTQGALLNDKHSNGTVKDRSPYRALMSCPVGEAPSPYNSRFESVAWSASACHDGMGWLTIGISGPDNGAVAVLKYNGIITETIKSWRKKILRTQESECACVNGSCFTIMTDGPSDGLASYKIFKIEKGKVTKSIELNAPNSHYEECSCYPDTGKVMCVCRDNWHGSNRPWVSFDQNLDYQIGYICSGVFGDNPRPEDGTGSCGPVYVDGANGVKGFSYRYGNGVWIGRTKSHSSRHGFEMIWDPNGWTETDSKFSVRQDVVAMTDWSGYSGSFVQHPELTGLDCMRPCFWVELIRGRPKEKTIWTSASSISFCGVNSDTVDWSWPDGAELPFSIDK 9GQT,9GQQ Neuraminidase NRAM_I34A1 P03468 A4GXH6 Q20N35 Q84043 Q8JUU4 8423 CCC1CCN(CC1)[C@@H]1C=C(C[C@H](N)[C@H]1NC(C)=O)C(O)=O |r,c:10| InChI=1S/C16H27N3O3/c1-3-11-4-6-19(7-5-11)14-9-12(16(21)22)8-13(17)15(14)18-10(2)20/h9,11,13-15H,3-8,17H2,1-2H3,(H,18,20)(H,21,22) ZMKUNMGXTLXQDD-UHFFFAOYSA-N 5260 (3R,4R,5S)-5-amino-4-acetamido-3-(4-ethylpiperidin-1-yl)cyclohex-1-ene-1-carboxylic acid::C3-Cyclic Amine Carbocyclic Analogue 4k Neuraminidase Influenza A virus (strain A/Puerto Rico/8/1934 H1N1) 52 6.5000 37.00 C Curated from the literature by BindingDB 10.1016/s0960-894x(00)00214-6 10.7270/Q22R3PWW 10866394 aid1795761 Lew, W; Wu, H; Chen, X; Graves, BJ; Escarpe, PA; MacArthur, HL; Mendel, DB; Kim, CU 6/5/2000 7/28/2005 Gilead Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=5260 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=753&target=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=5260&enzyme=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search 506118 8034888 1 MNPNQKIITIGSICLVVGLISLILQIGNIISIWISHSIQTGSQNHTGICNQNIITYKNSTWVKDTTSVILTGNSSLCPIRGWAIYSKDNSIRIGSKGDVFVIREPFISCSHLECRTFFLTQGALLNDKHSNGTVKDRSPYRALMSCPVGEAPSPYNSRFESVAWSASACHDGMGWLTIGISGPDNGAVAVLKYNGIITETIKSWRKKILRTQESECACVNGSCFTIMTDGPSDGLASYKIFKIEKGKVTKSIELNAPNSHYEECSCYPDTGKVMCVCRDNWHGSNRPWVSFDQNLDYQIGYICSGVFGDNPRPEDGTGSCGPVYVDGANGVKGFSYRYGNGVWIGRTKSHSSRHGFEMIWDPNGWTETDSKFSVRQDVVAMTDWSGYSGSFVQHPELTGLDCMRPCFWVELIRGRPKEKTIWTSASSISFCGVNSDTVDWSWPDGAELPFSIDK 9GQT,9GQQ Neuraminidase NRAM_I34A1 P03468 A4GXH6 Q20N35 Q84043 Q8JUU4 8424 CCCC1CCN(CC1)[C@@H]1C=C(C[C@H](N)[C@H]1NC(C)=O)C(O)=O |r,c:11| InChI=1S/C17H29N3O3/c1-3-4-12-5-7-20(8-6-12)15-10-13(17(22)23)9-14(18)16(15)19-11(2)21/h10,12,14-16H,3-9,18H2,1-2H3,(H,19,21)(H,22,23) RYUYQPZJUOKCMD-UHFFFAOYSA-N 5261 (3R,4R,5S)-5-amino-4-acetamido-3-(4-propylpiperidin-1-yl)cyclohex-1-ene-1-carboxylic acid::C3-Cyclic Amine Carbocyclic Analogue 4l Neuraminidase Influenza A virus (strain A/Puerto Rico/8/1934 H1N1) 40 6.5000 37.00 C Curated from the literature by BindingDB 10.1016/s0960-894x(00)00214-6 10.7270/Q22R3PWW 10866394 aid1795761 Lew, W; Wu, H; Chen, X; Graves, BJ; Escarpe, PA; MacArthur, HL; Mendel, DB; Kim, CU 6/5/2000 7/28/2005 Gilead Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=5261 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=753&target=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=5261&enzyme=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search 506119 8034889 1 MNPNQKIITIGSICLVVGLISLILQIGNIISIWISHSIQTGSQNHTGICNQNIITYKNSTWVKDTTSVILTGNSSLCPIRGWAIYSKDNSIRIGSKGDVFVIREPFISCSHLECRTFFLTQGALLNDKHSNGTVKDRSPYRALMSCPVGEAPSPYNSRFESVAWSASACHDGMGWLTIGISGPDNGAVAVLKYNGIITETIKSWRKKILRTQESECACVNGSCFTIMTDGPSDGLASYKIFKIEKGKVTKSIELNAPNSHYEECSCYPDTGKVMCVCRDNWHGSNRPWVSFDQNLDYQIGYICSGVFGDNPRPEDGTGSCGPVYVDGANGVKGFSYRYGNGVWIGRTKSHSSRHGFEMIWDPNGWTETDSKFSVRQDVVAMTDWSGYSGSFVQHPELTGLDCMRPCFWVELIRGRPKEKTIWTSASSISFCGVNSDTVDWSWPDGAELPFSIDK 9GQT,9GQQ Neuraminidase NRAM_I34A1 P03468 A4GXH6 Q20N35 Q84043 Q8JUU4 8425 CC(=O)N[C@@H]1[C@@H](N)CC(=C[C@H]1N1C2CCC1CCC2)C(O)=O |r,c:8| InChI=1S/C16H25N3O3/c1-9(20)18-15-13(17)7-10(16(21)22)8-14(15)19-11-3-2-4-12(19)6-5-11/h8,11-15H,2-7,17H2,1H3,(H,18,20)(H,21,22) CBIVFZXLBGGJIX-UHFFFAOYSA-N 5262 (3R,4R,5S)-5-amino-3-{8-azabicyclo[3.2.1]octan-8-yl}-4-acetamidocyclohex-1-ene-1-carboxylic acid::C3-Cyclic Amine Carbocyclic Analogue 4m Neuraminidase Influenza A virus (strain A/Puerto Rico/8/1934 H1N1) 32 6.5000 37.00 C Curated from the literature by BindingDB 10.1016/s0960-894x(00)00214-6 10.7270/Q22R3PWW 10866394 aid1795761 Lew, W; Wu, H; Chen, X; Graves, BJ; Escarpe, PA; MacArthur, HL; Mendel, DB; Kim, CU 6/5/2000 7/28/2005 Gilead Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=5262 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=753&target=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=5262&enzyme=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search 506120 8034890 1 MNPNQKIITIGSICLVVGLISLILQIGNIISIWISHSIQTGSQNHTGICNQNIITYKNSTWVKDTTSVILTGNSSLCPIRGWAIYSKDNSIRIGSKGDVFVIREPFISCSHLECRTFFLTQGALLNDKHSNGTVKDRSPYRALMSCPVGEAPSPYNSRFESVAWSASACHDGMGWLTIGISGPDNGAVAVLKYNGIITETIKSWRKKILRTQESECACVNGSCFTIMTDGPSDGLASYKIFKIEKGKVTKSIELNAPNSHYEECSCYPDTGKVMCVCRDNWHGSNRPWVSFDQNLDYQIGYICSGVFGDNPRPEDGTGSCGPVYVDGANGVKGFSYRYGNGVWIGRTKSHSSRHGFEMIWDPNGWTETDSKFSVRQDVVAMTDWSGYSGSFVQHPELTGLDCMRPCFWVELIRGRPKEKTIWTSASSISFCGVNSDTVDWSWPDGAELPFSIDK 9GQT,9GQQ Neuraminidase NRAM_I34A1 P03468 A4GXH6 Q20N35 Q84043 Q8JUU4 8426 CC(=O)N[C@@H]1[C@@H](N)CC(=C[C@H]1N1CCCCC[C@@H]1CO)C(O)=O |r,c:8| InChI=1S/C16H27N3O4/c1-10(21)18-15-13(17)7-11(16(22)23)8-14(15)19-6-4-2-3-5-12(19)9-20/h8,12-15,20H,2-7,9,17H2,1H3,(H,18,21)(H,22,23) IIIHFJUFPWPHFQ-UHFFFAOYSA-N 5263 (3R,4R,5S)-5-amino-4-acetamido-3-[(2R)-2-(hydroxymethyl)azepan-1-yl]cyclohex-1-ene-1-carboxylic acid::C3-Cyclic Amine Carbocyclic Analogue 4n Neuraminidase Influenza A virus (strain A/Puerto Rico/8/1934 H1N1) 8 6.5000 37.00 C Curated from the literature by BindingDB 10.1016/s0960-894x(00)00214-6 10.7270/Q22R3PWW 10866394 aid1795761 Lew, W; Wu, H; Chen, X; Graves, BJ; Escarpe, PA; MacArthur, HL; Mendel, DB; Kim, CU 6/5/2000 7/28/2005 Gilead Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=5263 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=753&target=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=5263&enzyme=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search 506121 8034891 1 MNPNQKIITIGSICLVVGLISLILQIGNIISIWISHSIQTGSQNHTGICNQNIITYKNSTWVKDTTSVILTGNSSLCPIRGWAIYSKDNSIRIGSKGDVFVIREPFISCSHLECRTFFLTQGALLNDKHSNGTVKDRSPYRALMSCPVGEAPSPYNSRFESVAWSASACHDGMGWLTIGISGPDNGAVAVLKYNGIITETIKSWRKKILRTQESECACVNGSCFTIMTDGPSDGLASYKIFKIEKGKVTKSIELNAPNSHYEECSCYPDTGKVMCVCRDNWHGSNRPWVSFDQNLDYQIGYICSGVFGDNPRPEDGTGSCGPVYVDGANGVKGFSYRYGNGVWIGRTKSHSSRHGFEMIWDPNGWTETDSKFSVRQDVVAMTDWSGYSGSFVQHPELTGLDCMRPCFWVELIRGRPKEKTIWTSASSISFCGVNSDTVDWSWPDGAELPFSIDK 9GQT,9GQQ Neuraminidase NRAM_I34A1 P03468 A4GXH6 Q20N35 Q84043 Q8JUU4 8427 CCC(CC)O[C@@H]1C=C(C[C@H](N)[C@H]1NC(C)=O)C(O)=O |r,c:7| InChI=1S/C14H24N2O4/c1-4-10(5-2)20-12-7-9(14(18)19)6-11(15)13(12)16-8(3)17/h7,10-13H,4-6,15H2,1-3H3,(H,16,17)(H,18,19) NENPYTRHICXVCS-UHFFFAOYSA-N 4994 CHEMBL674::(3R,4R,5S)-5-amino-4-acetamido-3-(pentan-3-yloxy)cyclohex-1-ene-1-carboxylic acid::GS4071::Oseltamivir carboxylate Neuraminidase Influenza A virus (strain A/Puerto Rico/8/1934 H1N1) 1 6.5000 37.00 C Curated from the literature by BindingDB 10.1016/s0960-894x(00)00214-6 10.7270/Q22R3PWW 10866394 aid1795761 Lew, W; Wu, H; Chen, X; Graves, BJ; Escarpe, PA; MacArthur, HL; Mendel, DB; Kim, CU 6/5/2000 7/28/2005 Gilead Sciences http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=4994 http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=753&target=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search http://www.bindingdb.org/rwd/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=4994&enzyme=Neuraminidase&column=ki&startPg=0&Increment=50&submit=Search 449381 8034633 CHEMBL674 1 MNPNQKIITIGSICLVVGLISLILQIGNIISIWISHSIQTGSQNHTGICNQNIITYKNSTWVKDTTSVILTGNSSLCPIRGWAIYSKDNSIRIGSKGDVFVIREPFISCSHLECRTFFLTQGALLNDKHSNGTVKDRSPYRALMSCPVGEAPSPYNSRFESVAWSASACHDGMGWLTIGISGPDNGAVAVLKYNGIITETIKSWRKKILRTQESECACVNGSCFTIMTDGPSDGLASYKIFKIEKGKVTKSIELNAPNSHYEECSCYPDTGKVMCVCRDNWHGSNRPWVSFDQNLDYQIGYICSGVFGDNPRPEDGTGSCGPVYVDGANGVKGFSYRYGNGVWIGRTKSHSSRHGFEMIWDPNGWTETDSKFSVRQDVVAMTDWSGYSGSFVQHPELTGLDCMRPCFWVELIRGRPKEKTIWTSASSISFCGVNSDTVDWSWPDGAELPFSIDK 9GQT,9GQQ Neuraminidase NRAM_I34A1 P03468 A4GXH6 Q20N35 Q84043 Q8JUU4