Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Rho-associated protein kinase 2' and Ligand = 'BDBM50358708'   

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))	BDBM50358708 (CHEMBL1922044) Show SMILES COc1cccc(CN(CCN2CCCC2)C(=O)c2cc3ccc(nc3[nH]2)-c2cn[nH]c2)c1 Show InChI InChI=1S/C25H28N6O2/c1-33-21-6-4-5-18(13-21)17-31(12-11-30-9-2-3-10-30)25(32)23-14-19-7-8-22(28-24(19)29-23)20-15-26-27-16-20/h4-8,13-16H,2-3,9-12,17H2,1H3,(H,26,27)(H,28,29)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	18	n/a	n/a	n/a	n/a	n/a	n/a
The Scripps Research Institute Curated by ChEMBL					Assay Description Inhibition of ROCK2				Bioorg Med Chem Lett 21: 7113-8 (2011) Article DOI: 10.1016/j.bmcl.2011.09.084 BindingDB Entry DOI: 10.7270/Q2F1905N
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