BDBM50296558 CHEMBL560133::N-(2-(6-oxo-6,7,8,9-tetrahydro-3H-pyrrolo[3,2-f]isoquinolin-1-yl)ethyl)picolinamide

SMILES: O=C(NCCc1c[nH]c2ccc3C(=O)NCCc3c12)c1ccccn1

InChI Key: InChIKey=DFFPYDJJMPQRKQ-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 = 50296558   

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))	BDBM50296558 (CHEMBL560133 | N-(2-(6-oxo-6,7,8,9-tetrahydro-3H-p...) Show SMILES O=C(NCCc1c[nH]c2ccc3C(=O)NCCc3c12)c1ccccn1 Show InChI InChI=1S/C19H18N4O2/c24-18-14-4-5-15-17(13(14)7-10-21-18)12(11-23-15)6-9-22-19(25)16-3-1-2-8-20-16/h1-5,8,11,23H,6-7,9-10H2,(H,21,24)(H,22,25)	PDB MMDB UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	44	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