Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Rho-associated protein kinase 2' and Ligand = 'BDBM50309103'   

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))	BDBM50309103 (3-(4-methyl-1,4-diazepan-1-yl)-5-(1H-pyrrolo[2,3-b...) Show SMILES CN1CCCN(CC1)c1nc(cnc1N)-c1ccnc2[nH]ccc12 Show InChI InChI=1S/C17H21N7/c1-23-7-2-8-24(10-9-23)17-15(18)21-11-14(22-17)12-3-5-19-16-13(12)4-6-20-16/h3-6,11H,2,7-10H2,1H3,(H2,18,21)(H,19,20)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	530	n/a	n/a	n/a	n/a	n/a	n/a
AMRI Curated by ChEMBL					Assay Description Inhibition of human recombinant ROCK2				Bioorg Med Chem Lett 20: 1137-40 (2010) Article DOI: 10.1016/j.bmcl.2009.12.012 BindingDB Entry DOI: 10.7270/Q2QR4X7J
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