BDBM50319729 CHEMBL1083748::rac-N-(7-chloro-1-oxo-1,2-dihydroisoquinolin-6-yl)-4-(3-methoxyphenyl)pyrrolidine-3-carboxamide

SMILES: COc1cccc(c1)C1CNCC1C(=O)Nc1cc2cc[nH]c(=O)c2cc1Cl

InChI Key: InChIKey=QGLWCJJKZQZWHR-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 = 50319729   

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
Rho-associated protein kinase 2 (Homo sapiens (Human))	BDBM50319729 (CHEMBL1083748 | rac-N-(7-chloro-1-oxo-1,2-dihydroi...) Show SMILES COc1cccc(c1)C1CNCC1C(=O)Nc1cc2cc[nH]c(=O)c2cc1Cl Show InChI InChI=1S/C21H20ClN3O3/c1-28-14-4-2-3-12(7-14)16-10-23-11-17(16)21(27)25-19-8-13-5-6-24-20(26)15(13)9-18(19)22/h2-9,16-17,23H,10-11H2,1H3,(H,24,26)(H,25,27)	PDB MMDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4	n/a	n/a	n/a	n/a	n/a	n/a
Boehringer-Ingelheim Pharmaceuticals, Inc. Curated by ChEMBL					Assay Description Inhibition of ROCK2 by luciferase based ATP detection assay				Bioorg Med Chem Lett 20: 3746-9 (2010) Article DOI: 10.1016/j.bmcl.2010.04.069 BindingDB Entry DOI: 10.7270/Q2XD12MD
					More data for this Ligand-Target Pair