Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'cGMP-dependent protein kinase' and Ligand = 'BDBM50168168'   

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
cGMP-dependent protein kinase (Eimeria tenella)	BDBM50168168 (4-[5-(1-Methyl-piperidin-4-yl)-2-thiazol-2-yl-1H-p...) Show SMILES CN1CCC(CC1)c1cc(c([nH]1)-c1nccs1)-c1ccncc1 Show InChI InChI=1S/C18H20N4S/c1-22-9-4-14(5-10-22)16-12-15(13-2-6-19-7-3-13)17(21-16)18-20-8-11-23-18/h2-3,6-8,11-12,14,21H,4-5,9-10H2,1H3	UniProtKB/TrEMBL GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	39.7	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description In vitro inhibition of Eimeria tenella cGMP-dependent protein kinase				Bioorg Med Chem Lett 15: 3296-301 (2005) Article DOI: 10.1016/j.bmcl.2005.04.060 BindingDB Entry DOI: 10.7270/Q24M9421
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