BDBM50278015 CHEMBL4170286

SMILES Oc1nn(CC2CC2)nc1C(=O)Nc1cccc(c1)C(F)(F)F

InChI Key InChIKey=XIIFYYUKZDSLTK-UHFFFAOYSA-N

Data  1 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50278015   

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

Curated by ChEMBL
LigandPNGBDBM50278015(CHEMBL4170286)
Affinity DataIC50: 5.00E+4nMAssay Description:Inhibition of recombinant human AKR1C3 expressed in Escherichia coli BL21 (DE) using [14C]androstenedione as substrate in presence of NADPH generatin...More data for this Ligand-Target Pair
In Depth
Date in BDB:
6/4/2020
Entry Details Article
PubMed