Reaction Details Report a problem with these data
Target
Cathepsin S
Ligand
BDBM50410968
Substrate
n/a
Meas. Tech.
ChEMBL_365371 (CHEMBL863025)
Ki
240±n/a nM
Citation
 Palmer, JT; Hirschbein, BL; Cheung, H; McCarter, J; Janc, JW; Yu, ZW; Wesolowski, G Keto-1,3,4-oxadiazoles as cathepsin K inhibitors. Bioorg Med Chem Lett 16:2909-14 (2006) [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:
BDBM50410968
Synonyms:
CHEMBL210625
Type:
Small organic molecule
Emp. Form.:
C19H25F3N4O4
Mol. Mass.:
430.4214
SMILES:
CCC[C@H](NC(=O)[C@H](CC(C)C)NCC(F)(F)F)C(=O)c1nnc(o1)-c1ccco1
Structure:
Search PDB for entries with ligand similarity: