BDBM50177504 (E)-[(2S)-2-{[(tert-butoxy)carbonyl]amino}hexylidene]amino morpholine-4-carboxylate::CHEMBL204537

SMILES: CCCC[C@H](NC(=O)OC(C)(C)C)C=NOC(=O)N1CCOCC1

InChI Key: InChIKey=ZSLOQCJCMJUQOV-ZDUSSCGKSA-N

Data: 1 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 1 hit for monomerid = 50177504   

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))	BDBM50177504 ((E)-[(2S)-2-{[(tert-butoxy)carbonyl]amino}hexylide...) Show SMILES CCCC[C@H](NC(=O)OC(C)(C)C)C=NOC(=O)N1CCOCC1 |w:14.14| Show InChI InChI=1S/C16H29N3O5/c1-5-6-7-13(18-14(20)23-16(2,3)4)12-17-24-15(21)19-8-10-22-11-9-19/h12-13H,5-11H2,1-4H3,(H,18,20)/t13-/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	1.10E+3	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Curated by ChEMBL					Assay Description Inhibition of recombinant human cathepsin K in a fluorescence assay				Bioorg Med Chem Lett 16: 978-83 (2006) Article DOI: 10.1016/j.bmcl.2005.10.108 BindingDB Entry DOI: 10.7270/Q2X929VS
					More data for this Ligand-Target Pair