BDBM50567378 CHEMBL4846491

SMILES COc1cccc(c1)C(C)Sc1nc2n(C)ncc2c(=O)n1-c1ccccc1

InChI Key InChIKey=DZRKMUUJUQIHKM-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 = 50567378   

TargetAldehyde dehydrogenase 1A1(Human)
University of Michigan

Curated by ChEMBL
LigandPNGBDBM50567378(CHEMBL4846491)
Affinity DataIC50: 451nMAssay Description:Inhibition of human ALDH1A1 assessed as NADH formation using propionaldehyde as substrate by spectrophotometeryMore data for this Ligand-Target Pair
In Depth
Date in BDB:
8/19/2022
Entry Details Article
PubMed
TargetRetinal dehydrogenase 2(Human)
University of Michigan

Curated by ChEMBL
LigandPNGBDBM50567378(CHEMBL4846491)
Affinity DataIC50: 108nMAssay Description:Inhibition of human ALDH1A2 assessed as NADH formation using propionaldehyde as substrate by spectrophotometeryMore data for this Ligand-Target Pair
In Depth
Date in BDB:
8/19/2022
Entry Details Article
PubMed
TargetAldehyde dehydrogenase family 1 member A3(Human)
University of Michigan

Curated by ChEMBL
LigandPNGBDBM50567378(CHEMBL4846491)
Affinity DataIC50: 174nMAssay Description:Inhibition of human ALDH1A3 assessed as NADH formation using propionaldehyde as substrate by spectrophotometeryMore data for this Ligand-Target Pair
In Depth
Date in BDB:
8/19/2022
Entry Details Article
PubMed