BDBM50658187 CHEMBL6144978

SMILES COc1cc(-c2ccc(CNC(=O)c3cn(C)c4ccccc34)nc2)cc(OC)c1OC

InChI Key InChIKey=HHIWATXLLOEBAI-UHFFFAOYSA-N

Data  1 Kd

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50658187   

TargetATP-dependent translocase ABCB1(Human)
Fudan University

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50658187BDBM50658187(CHEMBL6144978)
Affinity DataKd:  798nMAssay Description:Binding affinity to CM5 sensor chip-immobilized human P-gp assessed as dissociation constant by SPR analysisMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In Depth
Date in BDB:
6/5/2026
Entry Details
PubMed