BDBM50662325 CHEMBL6172449

SMILES COc1ccccc1N1CCN(C(=O)c2cccc(S(=O)(=O)n3cnc(-c4cccnc4)n3)c2)CC1

InChI Key InChIKey=COAKVLIUHHOTOC-UHFFFAOYSA-N

Data  1 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
Find this compound or compounds like it in BindingDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50662325   

TargetAldo-keto reductase family 1 member C3(Human)
University of Texas at Austin

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50662325BDBM50662325(CHEMBL6172449)
Affinity DataIC50: 1.00E+4nMAssay Description:Inhibition of AKR1C3 in human COLO 205 cells by Cell based AKR activity assayMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In Depth
Date in BDB:
6/5/2026
Entry Details
PubMed