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Target
Cathepsin S
Ligand
BDBM315295
Substrate
n/a
Meas. Tech.
Cathepsin Enzyme Inhibition Assay
IC50
280±n/a nM
Citation
 Haap, W; Kuehne, H; Mauser, H Piperidine derivatives US Patent  US10172843 Publication Date 1/8/2019 
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:
BDBM315295
Synonyms:
Acetic acid 2-(6-chloro- 3-{1-[5-methyl-2-(4- trifluoromethyl-phenyl)- 1H-imidazol-4- ylmethyl]-piperidin-4- yl}-2-oxo-2,3-dihydro- benzoimidazol-1-yl)- ethyl ester | US10172843, Example 29
Type:
Small organic molecule
Emp. Form.:
C28H29ClF3N5O3
Mol. Mass.:
576.01
SMILES:
CC(=O)OCCn1c2cc(Cl)ccc2n(C2CCN(Cc3nc([nH]c3C)-c3ccc(cc3)C(F)(F)F)CC2)c1=O
Structure:
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