BDBM50527783 CHEMBL4436671

SMILES COc1cccc(c1)-c1cn2cc(ccc2n1)-c1ccc(F)cc1

InChI Key InChIKey=QKDWKEBEXXTPKF-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 = 50527783   

TargetAldehyde dehydrogenase family 1 member A3(Human)
University of Pisa

Curated by ChEMBL
LigandPNGBDBM50527783(CHEMBL4436671)
Affinity DataIC50: 2.12E+4nMAssay Description:Inhibition of recombinant human 6His-tagged ALDH1A3 expressed in Escherichia coli BL21(DE3) using acetaldehyde as substrate preincubated for 5 mins f...More data for this Ligand-Target Pair
In Depth
Date in BDB:
2/25/2021
Entry Details Article
PubMed