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SMILES: Oc1ccccc1-c1[nH]c2cccc3C(=O)NCCc1c23

InChI Key: InChIKey=YZBWCLUYSPOXFH-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50120727   
Target/Host
(Institution)		LigandTarget/Host
Links		Ligand
Links		Trg + Lig
Links		Ki
nM		ΔG°
kcal/mole		IC50
nM		Kd
nM		EC50/IC50
nM		koff
s-1		kon
M-1s-1		pHTemp
°C
Poly [ADP-ribose] polymerase 1


(Homo sapiens (Human))		BDBM50120727
PNG
(2-(2-Hydroxy-phenyl)-1,3,4,5-tetrahydro-azepino[5,...)
Show SMILES Oc1ccccc1-c1[nH]c2cccc3C(=O)NCCc1c23
Show InChI InChI=1S/C17H14N2O2/c20-14-7-2-1-4-10(14)16-11-8-9-18-17(21)12-5-3-6-13(19-16)15(11)12/h1-7,19-20H,8-9H2,(H,18,21)
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PubMed
 23n/an/an/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
In vitro inhibitory activity towards human poly(ADP-ribose) polymerase 1 (PARP-1).

J Med Chem 45: 4961-74 (2002)


BindingDB Entry DOI: 10.7270/Q2T152ZP
More data for this
Ligand-Target Pair