BDBM50659279 CHEMBL6161927

SMILES c1cc(c(cc1C(F)(F)F)[N+](=O)[O-])NCCN

InChI Key InChIKey=ZKBIYCKAMFKCNV-UHFFFAOYSA-N

Data  2 Kd

PDB links: 1 PDB ID matches this monomer.

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

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50659279   

TargetSon of sevenless homolog 1(Human)
Vanderbilt University School of Medicine

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50659279BDBM50659279(CHEMBL6161927)
Affinity DataKd:  1.59E+5nMAssay Description:Binding affinity to SOS1 (unknown origin) assessed as dissociation constant by ITC analysisMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sidPDB
In Depth
Date in BDB:
6/5/2026
Entry Details
PubMed
TargetSon of sevenless homolog 2(Homo sapiens)
Vanderbilt University School of Medicine

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50659279BDBM50659279(CHEMBL6161927)
Affinity DataKd:  3.31E+5nMAssay Description:Binding affinity to N-terminal GST tagged SOS2 (562 to 1047 residues) (unknown origin) extracted from Escherichia coli strain BL21 (DE3) assessed as ...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sidPDB
In Depth
Date in BDB:
6/5/2026
Entry Details
PubMedPDB3D3D Structure (crystal)