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Target
Cathepsin K
Ligand
BDBM50106075
Substrate
n/a
Meas. Tech.
ChEBML_48341
IC50
1200±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:
BDBM50106075
Synonyms:
(S)-1-[2-Oxo-2-(3,4,5-trimethoxy-phenyl)-ethyl]-piperidine-2-carboxylic acid [(1S,2S)-2-methyl-1-((E)-styryl)-butyl]-amide | CHEMBL319522
Type:
Small organic molecule
Emp. Form.:
C30H40N2O5
Mol. Mass.:
508.649
SMILES:
CC[C@H](C)[C@H](NC(=O)[C@@H]1CCCCN1CC(=O)c1cc(OC)c(OC)c(OC)c1)\C=C\c1ccccc1
Structure:
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