BDBM213898 BDBM214111::US9283222, Table 3, Compound 5

SMILES COc1ccc(C(=O)CCC(=O)Nc2cccc(Cc3n[nH]c(=O)c4c3CCCC4)c2)cc1

InChI Key InChIKey=AMCZIPHXRVMECL-UHFFFAOYSA-N

Data  2 KI

  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 = 213898   

TargetPoly [ADP-ribose] polymerase 1(Human)
Abbvie

US Patent
LigandChemical structure of BindingDB Monomer ID 213898BDBM213898(US9283222, Table 3, Compound 5 | BDBM214111)
Affinity DataKi:  1.90nMpH: 8.0Assay Description:PARP1 assay was conducted in PARP assay buffer containing 50 mM Tris pH 8.0, 1 mM DTT, 4 mM MgCl2. PARP reactions contained 1.5 uM [3H]-NAD+ (1.6 uCi...More data for this Ligand-Target Pair
In Depth
Date in BDB:
2/27/2017
Entry Details
US Patent

TargetPoly [ADP-ribose] polymerase 1(Human)
Abbvie

US Patent
LigandChemical structure of BindingDB Monomer ID 213898BDBM213898(US9283222, Table 3, Compound 5 | BDBM214111)
Affinity DataKi:  2nMpH: 8.0Assay Description:PARP1 assay was conducted in PARP assay buffer containing 50 mM Tris pH 8.0, 1 mM DTT, 4 mM MgCl2. PARP reactions contained 1.5 uM [3H]-NAD+ (1.6 uCi...More data for this Ligand-Target Pair
In Depth
Date in BDB:
2/27/2017
Entry Details
US Patent