BDBM50139491 ((S)-1-Phenylaminooxalyl-pentyl)-carbamic acid tert-butyl ester::(S)-tert-butyl 1,2-dioxo-1-(phenylamino)heptan-3-ylcarbamate::CHEMBL164535

SMILES: CCCC[C@H](NC(=O)OC(C)(C)C)C(=O)C(=O)Nc1ccccc1

InChI Key: InChIKey=PKXJEJYKOSJWIQ-AWEZNQCLSA-N

Data: 2 IC50

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50139491   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Cathepsin K (Homo sapiens (Human))	BDBM50139491 (((S)-1-Phenylaminooxalyl-pentyl)-carbamic acid ter...) Show SMILES CCCC[C@H](NC(=O)OC(C)(C)C)C(=O)C(=O)Nc1ccccc1 Show InChI InChI=1S/C18H26N2O4/c1-5-6-12-14(20-17(23)24-18(2,3)4)15(21)16(22)19-13-10-8-7-9-11-13/h7-11,14H,5-6,12H2,1-4H3,(H,19,22)(H,20,23)/t14-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	6.31E+3	n/a	n/a	n/a	n/a	n/a	n/a
Chinese Academy of Sciences Curated by ChEMBL					Assay Description Inhibition of human cathepsin K				Eur J Med Chem 45: 667-81 (2010) Article DOI: 10.1016/j.ejmech.2009.11.010 BindingDB Entry DOI: 10.7270/Q29C6ZP1
					More data for this Ligand-Target Pair
Cathepsin K (Homo sapiens (Human))	BDBM50139491 (((S)-1-Phenylaminooxalyl-pentyl)-carbamic acid ter...) Show SMILES CCCC[C@H](NC(=O)OC(C)(C)C)C(=O)C(=O)Nc1ccccc1 Show InChI InChI=1S/C18H26N2O4/c1-5-6-12-14(20-17(23)24-18(2,3)4)15(21)16(22)19-13-10-8-7-9-11-13/h7-11,14H,5-6,12H2,1-4H3,(H,19,22)(H,20,23)/t14-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	n/a	n/a	6.30E+3	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Curated by ChEMBL					Assay Description Inhibitory activity against human cathepsin K				Bioorg Med Chem Lett 14: 719-22 (2004) BindingDB Entry DOI: 10.7270/Q2QV3KX1
					More data for this Ligand-Target Pair