Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Cathepsin K' and Ligand = 'BDBM50313527'   

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))	BDBM50313527 (4-(3-morpholinopropyl)-3,5-dioxo-2-(3-(trifluorome...) Show SMILES FC(F)(F)c1cccc(c1)-n1nc(C#N)c(=O)n(CCCN2CCOCC2)c1=O Show InChI InChI=1S/C18H18F3N5O3/c19-18(20,21)13-3-1-4-14(11-13)26-17(28)25(16(27)15(12-22)23-26)6-2-5-24-7-9-29-10-8-24/h1,3-4,11H,2,5-10H2	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	112	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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