BDBM50572090 CHEMBL4854627

SMILES CCC(=O)N1CCN(Cc2nc3ccccc3n2Cc2cccc(C)c2)CC1

InChI Key InChIKey=CGOFIQVXLFMZKA-UHFFFAOYSA-N

Data  5 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
Find this compound or compounds like it in BindingDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 5 hits for monomerid = 50572090   

TargetAldehyde dehydrogenase 1A1(Human)
China Pharmaceutical University

Curated by ChEMBL
LigandPNGBDBM50572090(CHEMBL4854627)
Affinity DataIC50: 626nMAssay Description:Inhibition of human ALDH1A1 assessed as NADH formation using propionaldehyde as substrate by spectrophotometryMore data for this Ligand-Target Pair
In Depth
Date in BDB:
8/21/2022
Entry Details Article
PubMed
TargetRetinal dehydrogenase 2(Human)
China Pharmaceutical University

Curated by ChEMBL
LigandPNGBDBM50572090(CHEMBL4854627)
Affinity DataIC50: 2.09E+3nMAssay Description:Inhibition of human ALDH1A2 assessed as NADH formation using propionaldehyde as substrate by spectrophotometryMore data for this Ligand-Target Pair
In Depth
Date in BDB:
8/21/2022
Entry Details Article
PubMed
TargetAldehyde dehydrogenase family 1 member A3(Human)
China Pharmaceutical University

Curated by ChEMBL
LigandPNGBDBM50572090(CHEMBL4854627)
Affinity DataIC50: 1.68E+3nMAssay Description:Inhibition of human ALDH1A3 assessed as NADH formation using propionaldehyde as substrate by spectrophotometryMore data for this Ligand-Target Pair
In Depth
Date in BDB:
8/21/2022
Entry Details Article
PubMed
TargetAldehyde dehydrogenase, mitochondrial(Human)
China Pharmaceutical University

Curated by ChEMBL
LigandPNGBDBM50572090(CHEMBL4854627)
Affinity DataIC50: 3.23E+3nMAssay Description:Inhibition of human ALDH2 assessed as NADH formation using propionaldehyde as substrate by spectrophotometryMore data for this Ligand-Target Pair
In Depth
Date in BDB:
8/21/2022
Entry Details Article
PubMed
TargetAldehyde dehydrogenase, dimeric NADP-preferring(Human)
China Pharmaceutical University

Curated by ChEMBL
LigandPNGBDBM50572090(CHEMBL4854627)
Affinity DataIC50: 2.31E+3nMAssay Description:Inhibition of human ALDH3A1 assessed as NADH formation using propionaldehyde as substrate by spectrophotometryMore data for this Ligand-Target Pair
In Depth
Date in BDB:
8/21/2022
Entry Details Article
PubMed