Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Rho-associated protein kinase 1' and Ligand = 'BDBM50299364'   

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 1 (Homo sapiens (Human))	BDBM50299364 (6-(piperazin-1-yl)-N2-(pyridin-4-yl)-N4-(1,2,3,4-t...) Show SMILES C1CN(CCN1)c1nc(NC2CCc3ccccc3C2)nc(Nc2ccncc2)n1 Show InChI InChI=1S/C22H26N8/c1-2-4-17-15-19(6-5-16(17)3-1)26-21-27-20(25-18-7-9-23-10-8-18)28-22(29-21)30-13-11-24-12-14-30/h1-4,7-10,19,24H,5-6,11-15H2,(H2,23,25,26,27,28,29)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	23	n/a	n/a	n/a	n/a	n/a	n/a
Ligand Pharmaceuticals, Inc. Curated by ChEMBL					Assay Description Inhibition of ROCK1 by IMAP assay				Bioorg Med Chem Lett 19: 6027-31 (2009) Article DOI: 10.1016/j.bmcl.2009.09.046 BindingDB Entry DOI: 10.7270/Q2668D7P
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