BDBM50137823 ((S)-1-Formyl-3,3-dimethyl-butyl)-carbamic acid tert-butyl ester::CHEMBL94150

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

InChI Key: InChIKey=BABQUZZMJCHKKX-VIFPVBQESA-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 = 50137823   

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))	BDBM50137823 (((S)-1-Formyl-3,3-dimethyl-butyl)-carbamic acid te...) Show SMILES CC(C)(C)C[C@H](NC(=O)OC(C)(C)C)C=O Show InChI InChI=1S/C12H23NO3/c1-11(2,3)7-9(8-14)13-10(15)16-12(4,5)6/h8-9H,7H2,1-6H3,(H,13,15)/t9-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	250	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Curated by ChEMBL					Assay Description Inhibiory activity against recombinant human cathepsin K				Bioorg Med Chem Lett 14: 275-8 (2003) BindingDB Entry DOI: 10.7270/Q2GM86PN
					More data for this Ligand-Target Pair				3D Structure (docked)