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Target
Cathepsin S
Ligand
BDBM50320041
Substrate
n/a
Meas. Tech.
ChEMBL_635108 (CHEMBL1119418)
IC50
3.6±n/a nM
Citation
 Chen, JC; Uang, BJ; Lyu, PC; Chang, JY; Liu, KJ; Kuo, CC; Hsieh, HP; Wang, HC; Cheng, CS; Chang, YH; Chang, MD; Chang, WS; Lin, CC Design and synthesis of alpha-ketoamides as cathepsin S inhibitors with potential applications against tumor invasion and angiogenesis. J Med Chem 53:4545-9 (2010) [PubMed]  Article 
Target
Name:
Cathepsin S
Synonyms:
CATS_HUMAN | CTSS | Cathepsin S (Cat S) | cathepsin S preproprotein
Type:
Protein
Mol. Mass.:
37507.38
Organism:
Homo sapiens (Human)
Description:
P25774
Residue:
331
Sequence:
MKRLVCVLLVCSSAVAQLHKDPTLDHHWHLWKKTYGKQYKEKNEEAVRRLIWEKNLKFVMLHNLEHSMGMHSYDLGMNHLGDMTSEEVMSLMSSLRVPSQWQRNITYKSNPNRILPDSVDWREKGCVTEVKYQGSCGACWAFSAVGALEAQLKLKTGKLVSLSAQNLVDCSTEKYGNKGCNGGFMTTAFQYIIDNKGIDSDASYPYKAMDQKCQYDSKYRAATCSKYTELPYGREDVLKEAVANKGPVSVGVDARHPSFFLYRSGVYYEPSCTQNVNHGVLVVGYGDLNGKEYWLVKNSWGHNFGEEGYIRMARNKGNHCGIASFPSYPEI
  
Inhibitor
Name:
BDBM50320041
Synonyms:
CHEMBL1083919 | Glycine, N-[(3S)-4-benzyloxy-3-[[[2-[(2-chloro-5-(methylsulfanyl)benzoyl)amino]cyclohexyl-Lalanyl]carbonyl]amino]-1,2-dioxobutyl], ethyl ester
Type:
Small organic molecule
Emp. Form.:
C32H40ClN3O7S
Mol. Mass.:
646.194
SMILES:
CCOC(=O)CNC(=O)C(=O)C(COCc1ccccc1)NC(=O)[C@H](CC1CCCCC1)NC(=O)c1cc(SC)ccc1Cl |r|
Structure:
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