BDBM50466733 CHEMBL4280914

SMILES COc1cc(cc(c1O)[N+]([O-])=O)C1c2c(CC(C)(C)C)n[nH]c2OC(N)=C1C#N

InChI Key InChIKey=SZKDXWMBTWXHLI-UHFFFAOYSA-N

Data  2 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 2 hits for monomerid = 50466733   

TargetAldo-keto reductase family 1 member C1(Human)
Guangzhou Medical University

Curated by ChEMBL
LigandPNGBDBM50466733(CHEMBL4280914)
Affinity DataIC50: 844nMAssay Description:Inhibition of recombinant human AKR1C1 expressed in Escherichia coli BL21 cells in presence of 9,10-phenanthrenequinone and NADPH by fluorescence ass...More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/18/2020
Entry Details Article
PubMed
TargetAldo-keto reductase family 1 member C3(Human)
Guangzhou Medical University

Curated by ChEMBL
LigandPNGBDBM50466733(CHEMBL4280914)
Affinity DataIC50: 480nMAssay Description:Inhibition of recombinant human AKR1C3 expressed in Escherichia coli BL21 cells in presence of 9,10-phenanthrenequinone and NADPH by fluorescence ass...More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/18/2020
Entry Details Article
PubMed