BDBM50177502 CHEMBL203766::{(S)-1-[(3,4-dihydro-1H-isoquinoline-2-carbonyl)-hydrazonomethyl]-pentyl}-carbamic acid tert-butyl ester

SMILES: CCCC[C@H](NC(=O)OC(C)(C)C)C=NNC(=O)N1CCc2ccccc2C1

InChI Key: InChIKey=VIUQMXJVHBBQGQ-SFHVURJKSA-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 = 50177502   

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))	BDBM50177502 (CHEMBL203766 | {(S)-1-[(3,4-dihydro-1H-isoquinolin...) Show SMILES CCCC[C@H](NC(=O)OC(C)(C)C)C=NNC(=O)N1CCc2ccccc2C1 |w:14.14| Show InChI InChI=1S/C21H32N4O3/c1-5-6-11-18(23-20(27)28-21(2,3)4)14-22-24-19(26)25-13-12-16-9-7-8-10-17(16)15-25/h7-10,14,18H,5-6,11-13,15H2,1-4H3,(H,23,27)(H,24,26)/t18-/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	93	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