Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Rho-associated protein kinase 2' and Ligand = 'BDBM50319717'   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/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))	BDBM50319717 (CHEMBL1084051 | rac-N-(7-chloro-1-oxo-1,2-dihydroi...) Show SMILES CCc1cccc(c1)C1CNCC1C(=O)Nc1cc2cc[nH]c(=O)c2cc1Cl Show InChI InChI=1S/C22H22ClN3O2/c1-2-13-4-3-5-14(8-13)17-11-24-12-18(17)22(28)26-20-9-15-6-7-25-21(27)16(15)10-19(20)23/h3-10,17-18,24H,2,11-12H2,1H3,(H,25,27)(H,26,28)	PDB MMDB KEGG UniProtKB/SwissProt 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
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