BDBM213972 US9283222, 33

SMILES O=c1[nH]nc(Cc2ccc(CNCCc3cccc(C(F)(F)F)c3)cc2)c2c1CCCC2

InChI Key InChIKey=CEXRQOVXTXHZGH-UHFFFAOYSA-N

Data  1 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 1 hit for monomerid = 213972   

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

US Patent
LigandChemical structure of BindingDB Monomer ID 213972BDBM213972(US9283222, 33)
Affinity DataKi:  347nMpH: 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