Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'cGMP-dependent protein kinase' and Ligand = 'BDBM50265429'   

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)	BDBM50265429 (4-[7-(1-Benzylpiperidin-4-yl)-2-(4-fluorophenyl)-i...) Show SMILES Nc1nccc(n1)-c1c(nc2cc(ccn12)C1CCN(Cc2ccccc2)CC1)-c1ccc(F)cc1 Show InChI InChI=1S/C29H27FN6/c30-24-8-6-22(7-9-24)27-28(25-10-14-32-29(31)33-25)36-17-13-23(18-26(36)34-27)21-11-15-35(16-12-21)19-20-4-2-1-3-5-20/h1-10,13-14,17-18,21H,11-12,15-16,19H2,(H2,31,32,33)	UniProtKB/TrEMBL GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	0.110	n/a	n/a	n/a	n/a	n/a	n/a
SCYNEXIS, Inc. Curated by ChEMBL					Assay Description Inhibition of Eimeria tenella cGMP-dependent protein kinase				Eur J Med Chem 43: 1123-51 (2008) Article DOI: 10.1016/j.ejmech.2007.09.013 BindingDB Entry DOI: 10.7270/Q28C9W1H
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