BDBM50309237 6-(3-(4-(1-(cyclopropylmethylamino)cyclohexanecarbonyl)piperazine-1-carbonyl)-4-fluorobenzyl)-4,5-dimethylpyridazin-3(2H)-one::CHEMBL605844

SMILES: Cc1c(Cc2ccc(F)c(c2)C(=O)N2CCN(CC2)C(=O)C2(CCCCC2)NCC2CC2)n[nH]c(=O)c1C

InChI Key: InChIKey=YDLDPHUTWRACHD-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 = 50309237   

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))	BDBM50309237 (6-(3-(4-(1-(cyclopropylmethylamino)cyclohexanecarb...) Show SMILES Cc1c(Cc2ccc(F)c(c2)C(=O)N2CCN(CC2)C(=O)C2(CCCCC2)NCC2CC2)n[nH]c(=O)c1C Show InChI InChI=1S/C29H38FN5O3/c1-19-20(2)26(36)33-32-25(19)17-22-8-9-24(30)23(16-22)27(37)34-12-14-35(15-13-34)28(38)29(10-4-3-5-11-29)31-18-21-6-7-21/h8-9,16,21,31H,3-7,10-15,17-18H2,1-2H3,(H,33,36)	PDB MMDB UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.5	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