BDBM50276943 2-[4-(1-Oxyl-2,2,5,5-tetramethyl-2,5-dihydro-1H-pyrrol-3-ylmethoxy)-3-methoxyphenyl]-1H-benzimidazol-4-carboxylic Acid Amide::CHEMBL516617

SMILES: COc1cc(ccc1OCC1=CC(C)(C)N(O)C1(C)C)-c1nc2c(cccc2[nH]1)C(N)=O

InChI Key: InChIKey=KMDHEURVVIXQBU-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 = 50276943   

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 (Rattus norvegicus)	BDBM50276943 (2-[4-(1-Oxyl-2,2,5,5-tetramethyl-2,5-dihydro-1H-py...) Show SMILES COc1cc(ccc1OCC1=CC(C)(C)N(O)C1(C)C)-c1nc2c(cccc2[nH]1)C(N)=O |t:11| Show InChI InChI=1S/C24H28N4O4/c1-23(2)12-15(24(3,4)28(23)30)13-32-18-10-9-14(11-19(18)31-5)22-26-17-8-6-7-16(21(25)29)20(17)27-22/h6-12,30H,13H2,1-5H3,(H2,25,29)(H,26,27)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	472	n/a	n/a	n/a	n/a	n/a	n/a
University of Pecs Curated by ChEMBL					Assay Description Inhibition of rat liver PARP1 by scintillation counting				J Med Chem 52: 1619-29 (2009) Article DOI: 10.1021/jm801476y BindingDB Entry DOI: 10.7270/Q29S1QXH
					More data for this Ligand-Target Pair