BDBM50363064 CHEMBL1944855

SMILES COc1ccc2n(CC(O)=O)c3c(CCN(Cc4ccccc4)C3=S)c2c1

InChI Key InChIKey=AQRNXCAVWZCQSU-UHFFFAOYSA-N

Data  3 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 3 hits for monomerid = 50363064   

TargetAldo-keto reductase family 1 member B1(Human)
University of Toyama

Curated by ChEMBL
LigandPNGBDBM50363064(CHEMBL1944855)
Affinity DataIC50: 150nMAssay Description:Inhibition of human recombinant AKR1B1 expressed in Escherichia coli BL21 cells using pyridine-3-aldehyde as substrate by spectrophotometryMore data for this Ligand-Target Pair
In Depth
Date in BDB:
7/22/2012
Entry Details Article
PubMed
TargetAldo-keto reductase family 1 member B10(Human)
University of Toyama

Curated by ChEMBL
LigandPNGBDBM50363064(CHEMBL1944855)
Affinity DataIC50: 2.90E+3nMAssay Description:Inhibition of recombinant N-His6-tagged AKR1B10 expressed in Escherichia coli BL21 cells using pyridine-3-aldehyde as substrate by spectrophotometryMore data for this Ligand-Target Pair
In Depth
Date in BDB:
7/22/2012
Entry Details Article
PubMed
TargetAldo-keto reductase family 1 member A1(Human)
University of Toyama

Curated by ChEMBL
LigandPNGBDBM50363064(CHEMBL1944855)
Affinity DataIC50: 1.20E+4nMAssay Description:Inhibition of human recombinant AKR1A1 expressed in Escherichia coli BL21 cells using D-glucuronate as substrate by spectrophotometryMore data for this Ligand-Target Pair
In Depth
Date in BDB:
7/22/2012
Entry Details Article
PubMed