BDBM50093373 2-(3'-METHOXYPHENYL) BENZIMIDAZOLE-4-CARBOXAMIDE::2-(3-Methoxy-phenyl)-1H-benzoimidazole-4-carboxylic acid amide::CHEMBL134022

SMILES: COc1cccc(c1)-c1nc2c(cccc2[nH]1)C(N)=O

InChI Key: InChIKey=NVVWVYYHTKCIAE-UHFFFAOYSA-N

Data: 1 KI

PDB links: 1 PDB ID matches this monomer.

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 = 50093373   

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))	BDBM50093373 (2-(3'-METHOXYPHENYL) BENZIMIDAZOLE-4-CARBOXAMIDE |...) Show SMILES COc1cccc(c1)-c1nc2c(cccc2[nH]1)C(N)=O Show InChI InChI=1S/C15H13N3O2/c1-20-10-5-2-4-9(8-10)15-17-12-7-3-6-11(14(16)19)13(12)18-15/h2-8H,1H3,(H2,16,19)(H,17,18)	PDB MMDB UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL DrugBank MMDB PC cid PC sid PDB UniChem Patents Similars	PDB PubMed	6	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
The University Curated by ChEMBL					Assay Description In vitro inhibition against human full length PARP protein				J Med Chem 43: 4084-97 (2000) BindingDB Entry DOI: 10.7270/Q2MP52HJ
					More data for this Ligand-Target Pair				3D Structure (crystal)