BDBM50309223 6-(4-fluoro-3-(1,8-diazaspiro[4.5]decane-8-carbonyl)benzyl)-4,5-dimethylpyridazin-3(2H)-one::CHEMBL598145

SMILES: Cc1c(C)c(=O)[nH]nc1Cc1ccc(F)c(c1)C(=O)N1CCC2(CCCN2)CC1

InChI Key: InChIKey=WDRUPQIBBGZODL-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 = 50309223   

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))	BDBM50309223 (6-(4-fluoro-3-(1,8-diazaspiro[4.5]decane-8-carbony...) Show SMILES Cc1c(C)c(=O)[nH]nc1Cc1ccc(F)c(c1)C(=O)N1CCC2(CCCN2)CC1 Show InChI InChI=1S/C22H27FN4O2/c1-14-15(2)20(28)26-25-19(14)13-16-4-5-18(23)17(12-16)21(29)27-10-7-22(8-11-27)6-3-9-24-22/h4-5,12,24H,3,6-11,13H2,1-2H3,(H,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	2.60	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Rome Curated by ChEMBL					Assay Description Inhibition of PARP1				Bioorg Med Chem Lett 20: 1100-5 (2010) Article DOI: 10.1016/j.bmcl.2009.11.087 BindingDB Entry DOI: 10.7270/Q2Z89CJ6
					More data for this Ligand-Target Pair