BDBM109216 CB29 (derivative 6)::US9320722, 6

SMILES CS(=O)(=O)c1ccc(Nc2ccc(NCC3CCCC3)cc2)c(c1)S(C)(=O)=O

InChI Key InChIKey=BARPUXMHQYAPRU-UHFFFAOYSA-N

Data  4 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 4 hits for monomerid = 109216   

TargetAldehyde dehydrogenase 1A1(Human)
Indiana University

LigandPNGBDBM109216(CB29 (derivative 6) | US9320722, 6)
Affinity DataIC50: 3.20E+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 Depth
Date in BDB:
5/16/2014
Entry Details Article
PubMed
TargetAldehyde dehydrogenase 1A1(Human)
Indiana University

LigandPNGBDBM109216(CB29 (derivative 6) | US9320722, 6)
Affinity DataIC50: 3.20E+4nMpH: 7.5Assay Description:IC50 values were determined for CB29 and its analogs using propionaldehyde as the substrate for ALDH1A1 and ALDH2 or benzaldehyde as the substrate fo...More data for this Ligand-Target Pair
In Depth
Date in BDB:
5/1/2017
Entry Details
US Patent

TargetAldehyde dehydrogenase, dimeric NADP-preferring(Human)
Indiana University Research and Technology

US Patent
LigandPNGBDBM109216(CB29 (derivative 6) | US9320722, 6)
Affinity DataIC50: 4.00E+4nMpH: 7.5Assay Description:IC50 values were determined for CB29 and its analogs using propionaldehyde as the substrate for ALDH1A1 and ALDH2 or benzaldehyde as the substrate fo...More data for this Ligand-Target Pair
In Depth
Date in BDB:
5/1/2017
Entry Details
US Patent

TargetAldehyde dehydrogenase, dimeric NADP-preferring(Human)
Indiana University Research and Technology

US Patent
LigandPNGBDBM109216(CB29 (derivative 6) | US9320722, 6)
Affinity DataIC50: 4.00E+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 Depth
Date in BDB:
5/16/2014
Entry Details Article
PubMed