Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Cathepsin K' and Ligand = 'BDBM50079595'   

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))	BDBM50079595 (((R)-1-{[2-((S)-1-Benzyloxycarbonylamino-3-methyl-...) Show SMILES CC(C)C[C@H](NC(=O)OCc1ccccc1)c1nc(cs1)C(=O)NN1CC[C@@](CC(C)C)(NC(=O)OCc2ccccc2)C1=O Show InChI InChI=1S/C33H41N5O6S/c1-22(2)17-26(35-31(41)43-19-24-11-7-5-8-12-24)29-34-27(21-45-29)28(39)37-38-16-15-33(30(38)40,18-23(3)4)36-32(42)44-20-25-13-9-6-10-14-25/h5-14,21-23,26H,15-20H2,1-4H3,(H,35,41)(H,36,42)(H,37,39)/t26-,33-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	33	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
SmithKline Beecham Pharmaceuticals Curated by ChEMBL					Assay Description Compound was tested for its inhibitory activity against human osteoclast cathepsin K				Bioorg Med Chem Lett 9: 1907-10 (1999) BindingDB Entry DOI: 10.7270/Q2M61JGJ
					More data for this Ligand-Target Pair