BDBM50593725 CHEMBL5206583

SMILES COc1ccc(Cn2nnc(O)c2C(=O)Nc2cccc(c2)-c2ccc(O)cc2)cc1

InChI Key InChIKey=NCLJKNLYEQNEIN-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 = 50593725   

TargetAldo-keto reductase family 1 member C3(Human)
University of Turin

Curated by ChEMBL
LigandPNGBDBM50593725(CHEMBL5206583)
Affinity DataIC50: 310nMAssay Description:Inhibition of recombinant human AKR1C3 transfected in Escherichia coli BL21 (DE) assessed as reduction in NADPH production using S-tetralol as substr...More data for this Ligand-Target Pair
In Depth
Date in BDB:
6/21/2023
Entry Details
PubMed