Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Cathepsin K' and Ligand = 'BDBM50313517'   

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
Cathepsin K (Homo sapiens (Human))	BDBM50313517 (4-ethyl-3,5-dioxo-2-(3-(trifluoromethyl)phenyl)-2,...) Show SMILES CCn1c(=O)c(nn(-c2cccc(c2)C(F)(F)F)c1=O)C#N Show InChI InChI=1S/C13H9F3N4O2/c1-2-19-11(21)10(7-17)18-20(12(19)22)9-5-3-4-8(6-9)13(14,15)16/h3-6H,2H2,1H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.50E+3	n/a	n/a	n/a	n/a	n/a	n/a
Schering-Plough Corporation Curated by ChEMBL					Assay Description Inhibition of human recombinant cathepsin K by fluorescence assay				Bioorg Med Chem Lett 20: 1488-90 (2010) Article DOI: 10.1016/j.bmcl.2010.01.116 BindingDB Entry DOI: 10.7270/Q2RN380F
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