BDBM27519 4-(morpholin-4-yl)-N-{8-oxo-9-azatetracyclo[8.7.0.0^{2,7}.0^{11,16}]heptadeca-1(10),2(7),3,5,11(16),12,14-heptaen-13-yl}butanamide::indeno[1,2-c]isoquinolinone, 5d

SMILES: O=C(CCCN1CCOCC1)Nc1ccc2Cc3c([nH]c(=O)c4ccccc34)-c2c1

InChI Key: InChIKey=ULUOHIWKHZERBU-UHFFFAOYSA-N

Data: 1 IC50

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

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 27519   

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))	BDBM27519 (4-(morpholin-4-yl)-N-{8-oxo-9-azatetracyclo[8.7.0....) Show SMILES O=C(CCCN1CCOCC1)Nc1ccc2Cc3c([nH]c(=O)c4ccccc34)-c2c1 Show InChI InChI=1S/C24H25N3O3/c28-22(6-3-9-27-10-12-30-13-11-27)25-17-8-7-16-14-21-18-4-1-2-5-19(18)24(29)26-23(21)20(16)15-17/h1-2,4-5,7-8,15H,3,6,9-14H2,(H,25,28)(H,26,29)	PDB MMDB UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	400	n/a	n/a	n/a	n/a	8.0	22
Inotek Pharmaceuticals Corporation					Assay Description The potency of inhibition on purified PARP enzyme was determined for selected compounds, and the potency was compared with that of 3-aminobenzamide (...				J Med Chem 48: 5100-3 (2005) Article DOI: 10.1021/jm0502891 BindingDB Entry DOI: 10.7270/Q2GF0RT9
					More data for this Ligand-Target Pair