BDBM109223 CB29 (derivative 13)

SMILES CNS(=O)(=O)c1ccc(Nc2ccc(NC(=O)CC(C)C)cc2)c(c1)[N+]([O-])=O

InChI Key InChIKey=XELCNUCXLHKOSD-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 = 109223   

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

LigandPNGBDBM109223(CB29 (derivative 13))
Affinity DataIC50:  1.16E+4nMAssay Description:To determine the IC50 values for CB29 and its analogues, propionaldehyde was used as the substrate for ALDH1A1 and ALDH2 and benzaldehyde was used as...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetAldehyde dehydrogenase, dimeric NADP-preferring(Homo sapiens (Human))
Indiana University

LigandPNGBDBM109223(CB29 (derivative 13))
Affinity DataIC50:  4.23E+4nMAssay Description:To determine the IC50 values for CB29 and its analogues, propionaldehyde was used as the substrate for ALDH1A1 and ALDH2 and benzaldehyde was used as...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed