BDBM50585947 CHEMBL5093301

SMILES Cc1cc(C=O)ccc1N1CCCC1

InChI Key InChIKey=OOQCMWBRBGSKQX-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 = 50585947   

TargetAldehyde dehydrogenase 1A1(Human)
University of Bradford

Curated by ChEMBL
LigandPNGBDBM50585947(CHEMBL5093301)
Affinity DataIC50: 800nMAssay Description:Inhibition of N-terminal-His6 tagged recombinant human ALDH1A1 assessed as reduction in NADH production using hexanal and NAD+ as substrate by fluori...More data for this Ligand-Target Pair
In Depth
Date in BDB:
3/7/2023
Entry Details Article
PubMed
TargetAldehyde dehydrogenase family 1 member A3(Human)
University of Bradford

Curated by ChEMBL
LigandPNGBDBM50585947(CHEMBL5093301)
Affinity DataIC50: 1.15E+3nMAssay Description:Inhibition of N-terminal-His6 tagged recombinant human ALDH1A3 assessed as reduction in NADH production using hexanal and NAD+ as substrate by fluori...More data for this Ligand-Target Pair
In Depth
Date in BDB:
3/7/2023
Entry Details Article
PubMed