BDBM50076553 CHEMBL1538964

SMILES CC(C)CCn1c(CN2CCOCC2)nc2n(C)c(=O)n(C)c(=O)c12

InChI Key InChIKey=RWDUJGFYBUYWIE-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 = 50076553   

TargetAldehyde dehydrogenase 1A1(Homo sapiens (Human))
Indiana University

Curated by ChEMBL
LigandPNGBDBM50076553(CHEMBL1538964)
Affinity DataIC50:  5.80E+3nMAssay Description:Inhibition of recombinant human ALDH1A1 using propionaldehyde as substrate preincubated for 2 mins with NAD+ followed by substrate addition by UV-Vis...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetAldehyde dehydrogenase X, mitochondrial(Homo sapiens (Human))
Indiana University

Curated by ChEMBL
LigandPNGBDBM50076553(CHEMBL1538964)
Affinity DataIC50: >1.00E+5nMAssay Description:Inhibition of recombinant human ALDH1B1 using propionaldehyde as substrate preincubated for 2 mins with NAD+ followed by substrate addition by UV-Vis...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetAldehyde dehydrogenase, mitochondrial(Homo sapiens (Human))
Indiana University

Curated by ChEMBL
LigandPNGBDBM50076553(CHEMBL1538964)
Affinity DataIC50: >1.00E+5nMAssay Description:Inhibition of recombinant human ALDH2 using propionaldehyde as substrate preincubated for 2 mins with NAD+ followed by substrate addition by UV-Vis s...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed