BDBM50139480 (S)-tert-butyl 1,2-dioxo-1-(thiophen-2-ylmethylamino)heptan-3-ylcarbamate::CHEMBL439649::[(S)-1-(Thiophen-2-ylmethyl)-aminooxalyl]-pentyl)-carbamic acid tert-butyl ester

SMILES: CCCC[C@H](NC(=O)OC(C)(C)C)C(=O)C(=O)NCc1cccs1

InChI Key: InChIKey=OVNAALASBQXMOG-ZDUSSCGKSA-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 = 50139480   

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))	BDBM50139480 ((S)-tert-butyl 1,2-dioxo-1-(thiophen-2-ylmethylami...) Show SMILES CCCC[C@H](NC(=O)OC(C)(C)C)C(=O)C(=O)NCc1cccs1 Show InChI InChI=1S/C17H26N2O4S/c1-5-6-9-13(19-16(22)23-17(2,3)4)14(20)15(21)18-11-12-8-7-10-24-12/h7-8,10,13H,5-6,9,11H2,1-4H3,(H,18,21)(H,19,22)/t13-/m0/s1	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	3.39E+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))	BDBM50139480 ((S)-tert-butyl 1,2-dioxo-1-(thiophen-2-ylmethylami...) Show SMILES CCCC[C@H](NC(=O)OC(C)(C)C)C(=O)C(=O)NCc1cccs1 Show InChI InChI=1S/C17H26N2O4S/c1-5-6-9-13(19-16(22)23-17(2,3)4)14(20)15(21)18-11-12-8-7-10-24-12/h7-8,10,13H,5-6,9,11H2,1-4H3,(H,18,21)(H,19,22)/t13-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	3.40E+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