BDBM223464 US9320722, CD3

SMILES O=C1Nc2ccccc2C11Oc2ccccc2C2CC(=NN12)c1ccccc1

InChI Key InChIKey=PLTMMVSHYQKBKL-UHFFFAOYSA-N

Data  3 IC50

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

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 223464   

TargetAldehyde dehydrogenase 1A1(Homo sapiens (Human))
Indiana University Research and Technology

US Patent
LigandPNGBDBM223464(US9320722, CD3)
Affinity DataIC50:  6.50E+3nMpH: 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 DepthDetails US Patent
TargetAldehyde dehydrogenase, dimeric NADP-preferring(Homo sapiens (Human))
Indiana University Research and Technology

US Patent
LigandPNGBDBM223464(US9320722, CD3)
Affinity DataIC50:  3.85E+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 DepthDetails US Patent
TargetAldehyde dehydrogenase, mitochondrial(Homo sapiens (Human))
Indiana University Research and Technology

US Patent
LigandPNGBDBM223464(US9320722, CD3)
Affinity DataIC50:  4.18E+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 DepthDetails US Patent