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Target
Cathepsin K
Ligand
BDBM50106071
Substrate
n/a
Meas. Tech.
ChEBML_48341
IC50
1400±n/a nM
Citation
 Smith, RA; Bhargava, A; Browe, C; Chen, J; Dumas, J; Hatoum-Mokdad, H; Romero, R Discovery and parallel synthesis of a new class of cathepsin K inhibitors. Bioorg Med Chem Lett 11:2951-4 (2001) [PubMed]  Article 
Target
Name:
Cathepsin K
Synonyms:
CATK_HUMAN | CTSK | CTSO | CTSO2 | Cathepsin O | Cathepsin O2 | Cathepsin X
Type:
Enzyme
Mol. Mass.:
36975.68
Organism:
Homo sapiens (Human)
Description:
P43235
Residue:
329
Sequence:
MWGLKVLLLPVVSFALYPEEILDTHWELWKKTHRKQYNNKVDEISRRLIWEKNLKYISIHNLEASLGVHTYELAMNHLGDMTSEEVVQKMTGLKVPLSHSRSNDTLYIPEWEGRAPDSVDYRKKGYVTPVKNQGQCGSCWAFSSVGALEGQLKKKTGKLLNLSPQNLVDCVSENDGCGGGYMTNAFQYVQKNRGIDSEDAYPYVGQEESCMYNPTGKAAKCRGYREIPEGNEKALKRAVARVGPVSVAIDASLTSFQFYSKGVYYDESCNSDNLNHAVLAVGYGIQKGNKHWIIKNSWGENWGNKGYILMARNKNNACGIANLASFPKM
  
Inhibitor
Name:
BDBM50106071
Synonyms:
(S)-1-(2-Oxo-2-phenyl-ethyl)-piperidine-2-carboxylic acid {(1S,2S)-1-[(E)-2-(4-chloro-phenyl)-vinyl]-2-methyl-butyl}-amide | CHEMBL329731
Type:
Small organic molecule
Emp. Form.:
C27H33ClN2O2
Mol. Mass.:
453.016
SMILES:
CC[C@H](C)[C@H](NC(=O)[C@@H]1CCCCN1CC(=O)c1ccccc1)\C=C\c1ccc(Cl)cc1
Structure:
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