BDBM50306286 1,2,3,8,9,9a-hexahydro-7H-benzo[de]-1,7-naphthyridin-7-one::CHEMBL608994

SMILES: O=C1NCC2NCCc3cccc1c23

InChI Key: InChIKey=STFMKRBMUMYLTM-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 = 50306286   

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))	BDBM50306286 (1,2,3,8,9,9a-hexahydro-7H-benzo[de]-1,7-naphthyrid...) Show SMILES O=C1NCC2NCCc3cccc1c23 Show InChI InChI=1S/C11H12N2O/c14-11-8-3-1-2-7-4-5-12-9(6-13-11)10(7)8/h1-3,9,12H,4-6H2,(H,13,14)	PDB MMDB UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	140	n/a	n/a	n/a	n/a	n/a	n/a
IRBM-Merck Research Laboratories Rome Curated by ChEMBL					Assay Description Inhibition of human PARP1 by scintillation proximity assay				Bioorg Med Chem Lett 20: 448-52 (2010) Article DOI: 10.1016/j.bmcl.2009.12.002 BindingDB Entry DOI: 10.7270/Q2GT5N91
					More data for this Ligand-Target Pair