Reaction Details Report a problem with these data
Target
Cathepsin S
Ligand
BDBM129696
Substrate
n/a
Meas. Tech.
Inhibition Assay
pH
6.5±n/a
IC50
2.3±n/a nM
Citation
 Banner, D; Haap, W; Luebbers, T; Peters, J Pyrrolidine derivatives US Patent  US8802665 Publication Date 8/12/2014 
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:
BDBM129696
Synonyms:
US8802665, 29
Type:
Small organic molecule
Emp. Form.:
C28H36ClN5O6S
Mol. Mass.:
606.133
SMILES:
CC(C)(C)OC(=O)N1CCN(CC1)C1(CC1)C(=O)N1C[C@@H](C[C@H]1C(=O)NC1(CC1)C#N)S(=O)(=O)c1ccccc1Cl |r|
Structure:
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