Target
Cathepsin S
Ligand
BDBM50030821
Substrate
n/a
Meas. Tech.
ChEMBL_1438542 (CHEMBL3385532)
IC50
3930±n/a nM
Citation
 Jadhav, PKSchiffler, MAGavardinas, KKim, EJMatthews, DPStaszak, MACoffey, DSShaw, BWCassidy, KCBrier, RAZhang, YChristie, RMMatter, WFQing, KDurbin, JDWang, YDeng, GG Discovery of Cathepsin S Inhibitor LY3000328 for the Treatment of Abdominal Aortic Aneurysm. ACS Med Chem Lett 5:1138-42 (2014) [PubMed]  Article 
Target
Name:
Cathepsin S
Synonyms:
CATS_MOUSE | Cats | Ctss
Type:
Enzyme
Mol. Mass.:
38476.67
Organism:
Mus musculus (Mouse)
Description:
O70370
Residue:
340
Sequence:
MRAPGHAAIRWLFWMPLVCSVAMEQLQRDPTLDYHWDLWKKTHEKEYKDKNEEEVRRLIWEKNLKFIMIHNLEYSMGMHTYQVGMNDMGDMTNEEILCRMGALRIPRQSPKTVTFRSYSNRTLPDTVDWREKGCVTEVKYQGSCGACWAFSAVGALEGQLKLKTGKLISLSAQNLVDCSNEEKYGNKGCGGGYMTEAFQYIIDNGGIEADASYPYKATDEKCHYNSKNRAATCSRYIQLPFGDEDALKEAVATKGPVSVGIDASHSSFFFYKSGVYDDPSCTGNVNHGVLVVGYGTLDGKDYWLVKNSWGLNFGDQGYIRMARNNKNHCGIASYCSYPEI
  
Inhibitor
Name:
BDBM50030821
Synonyms:
CHEMBL3342552
Type:
Small organic molecule
Emp. Form.:
C22H27N3O
Mol. Mass.:
349.4693
SMILES:
CN1CCN(CC1)c1ccc2CCCC(NC(=O)c3ccccc3)c2c1
Structure:
Search PDB for entries with ligand similarity: