Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'cGMP-dependent protein kinase' and Ligand = 'BDBM50211817'   

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)	BDBM50211817 (4-(7-(azetidin-1-ylmethyl)-2-(4-fluorophenyl)H-imi...) Show SMILES CC(C)(C)CNc1nccc(n1)-c1c(nc2cc(CN3CCC3)ccn12)-c1ccc(F)cc1 Show InChI InChI=1S/C26H29FN6/c1-26(2,3)17-29-25-28-11-9-21(30-25)24-23(19-5-7-20(27)8-6-19)31-22-15-18(10-14-33(22)24)16-32-12-4-13-32/h5-11,14-15H,4,12-13,16-17H2,1-3H3,(H,28,29,30)	UniProtKB/TrEMBL GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	0.450	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Inhibition of Et-PKG				Bioorg Med Chem Lett 17: 3558-61 (2007) Article DOI: 10.1016/j.bmcl.2007.04.041 BindingDB Entry DOI: 10.7270/Q20P0ZQH
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