BDBM50296545 1-(2-((1H-pyrazol-4-yl)methylamino)ethyl)-8,9-dihydro-3H-pyrrolo[3,2-f]isoquinolin-6(7H)-one::CHEMBL569363

SMILES: O=C1NCCc2c1ccc1[nH]cc(CCNCc3cn[nH]c3)c21

InChI Key: InChIKey=GBNXZKUIQKSFDY-UHFFFAOYSA-N

Data: 1 IC50

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50296545   

Target/Host (Institution)	Ligand	Target/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	pH	Temp °C
Poly [ADP-ribose] polymerase 1 (Homo sapiens (Human))	BDBM50296545 (1-(2-((1H-pyrazol-4-yl)methylamino)ethyl)-8,9-dihy...) Show SMILES O=C1NCCc2c1ccc1[nH]cc(CCNCc3cn[nH]c3)c21 Show InChI InChI=1S/C17H19N5O/c23-17-14-1-2-15-16(13(14)4-6-19-17)12(10-20-15)3-5-18-7-11-8-21-22-9-11/h1-2,8-10,18,20H,3-7H2,(H,19,23)(H,21,22)	PDB MMDB UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	340	n/a	n/a	n/a	n/a	n/a	n/a
IRBM--Merck Research Laboratories Rome Curated by ChEMBL					Assay Description Inhibition of PARP1 in human HeLa cells by microplate scintillation counting				Bioorg Med Chem Lett 19: 4042-5 (2009) Article DOI: 10.1016/j.bmcl.2009.06.031 BindingDB Entry DOI: 10.7270/Q2WH2Q09
					More data for this Ligand-Target Pair