BDBM50555608 CHEMBL4745360

SMILES NC(=N)SCc1ccc(CN2C(=O)C(=O)c3cc(Br)cc(Br)c23)cc1

InChI Key InChIKey=XMLXTCOXMRBGGZ-UHFFFAOYSA-N

Data  3 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50555608   

TargetAldehyde dehydrogenase 1A1(Human)
The Pennsylvania State University College of Medicine

Curated by ChEMBL
LigandPNGBDBM50555608(CHEMBL4745360)
Affinity DataIC50: 230nMAssay Description:Inhibition of ALDH1A1 (unknown origin) assessed as NADH formation using propionaldehyde as substrateMore data for this Ligand-Target Pair
In Depth
Date in BDB:
3/26/2022
Entry Details Article
PubMed
TargetAldehyde dehydrogenase, mitochondrial(Human)
The Pennsylvania State University College of Medicine

Curated by ChEMBL
LigandPNGBDBM50555608(CHEMBL4745360)
Affinity DataIC50: 1.54E+3nMAssay Description:Inhibition of ALDH2 (unknown origin) assessed as NADH formation using acetaldehyde as substrateMore data for this Ligand-Target Pair
In Depth
Date in BDB:
3/26/2022
Entry Details Article
PubMed
TargetAldehyde dehydrogenase, dimeric NADP-preferring(Human)
The Pennsylvania State University College of Medicine

Curated by ChEMBL
LigandPNGBDBM50555608(CHEMBL4745360)
Affinity DataIC50: 193nMAssay Description:Inhibition of ALDH3A1 (unknown origin) assessed as NADH formation using 4-nitrobenzaldehyde as substrateMore data for this Ligand-Target Pair
In Depth
Date in BDB:
3/26/2022
Entry Details Article
PubMed