Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Rho-associated protein kinase 2' and Ligand = 'BDBM50358687'   

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))	BDBM50358687 (CHEMBL1922139) Show SMILES COc1cccc(CNC(=O)c2[nH]c3cc(ccc3c2CN2CCOCC2)-c2cn[nH]c2)c1 Show InChI InChI=1S/C25H27N5O3/c1-32-20-4-2-3-17(11-20)13-26-25(31)24-22(16-30-7-9-33-10-8-30)21-6-5-18(12-23(21)29-24)19-14-27-28-15-19/h2-6,11-12,14-15,29H,7-10,13,16H2,1H3,(H,26,31)(H,27,28)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3	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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