BDBM50601404 CHEMBL5197861

SMILES CC(C)c1ccc(cc1)C(=O)N1CCN(CCC(=O)N(Cc2ccccc2F)c2cn(C)c(=O)n(C)c2=O)CC1

InChI Key InChIKey=IIGWBRVHUPATTH-UHFFFAOYSA-N

Data  1 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 1 hit for monomerid = 50601404   

TargetAldehyde dehydrogenase 1A1(Human)
China Pharmaceutical University

Curated by ChEMBL
LigandPNGBDBM50601404(CHEMBL5197861)
Affinity DataIC50: 429nMAssay Description:Inhibition of recombinant human ALDH1A1 using propionaldehyde as a substrate incubated for 15 mins followed by substrate addition by fluorescence bas...More data for this Ligand-Target Pair
In Depth
Date in BDB:
6/24/2023
Entry Details
PubMed