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Target
Cathepsin K
Ligand
BDBM50214554
Substrate
n/a
Meas. Tech.
ChEMBL_456336 (CHEMBL888347)
IC50
87±n/a nM
Citation
 Léger, S; Bayly, CI; Black, WC; Desmarais, S; Falgueyret, JP; Massé, F; Percival, MD; Truchon, JF Primary amides as selective inhibitors of cathepsin K. Bioorg Med Chem Lett 17:4328-32 (2007) [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:
BDBM50214554
Synonyms:
(S)-4-methyl-2-[(S)-2,2,2-trifluoro-1-(4'-methanesulfonyl-biphenyl-4-yl)-ethylamino]-pentanoic acid ((S)-1-benzylcarbamoyl-3-methylsulfanyl-propyl)-amide | CHEMBL249275
Type:
Small organic molecule
Emp. Form.:
C33H40F3N3O4S2
Mol. Mass.:
663.814
SMILES:
CSCC[C@H](NC(=O)[C@H](CC(C)C)N[C@@H](c1ccc(cc1)-c1ccc(cc1)S(C)(=O)=O)C(F)(F)F)C(=O)NCc1ccccc1
Structure:
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