BDBM50151022 8-Ethyl-2-[3-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)-propyl]-3H-quinazolin-4-one::CHEMBL187062

SMILES: CCc1cccc2c1nc(CCCN1CCC(=CC1)c1ccccc1)[nH]c2=O

InChI Key: InChIKey=BLYSXDLBXMMRGT-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 = 50151022   

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))	BDBM50151022 (8-Ethyl-2-[3-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl...) Show SMILES CCc1cccc2c1nc(CCCN1CCC(=CC1)c1ccccc1)[nH]c2=O |c:17| Show InChI InChI=1S/C24H27N3O/c1-2-18-10-6-11-21-23(18)25-22(26-24(21)28)12-7-15-27-16-13-20(14-17-27)19-8-4-3-5-9-19/h3-6,8-11,13H,2,7,12,14-17H2,1H3,(H,25,26,28)	PDB MMDB UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	66	n/a	n/a	n/a	n/a	n/a	n/a
Fujisawa Pharmaceutical Co., Ltd. Curated by ChEMBL					Assay Description In vitro inhibitory concentration against human recombinant Poly (ADP-ribose) polymerase 1				J Med Chem 47: 4151-4 (2004) Article DOI: 10.1021/jm0499256 BindingDB Entry DOI: 10.7270/Q21G0KQ6
					More data for this Ligand-Target Pair