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TargetCathepsin K
LigandBDBM50336095
Substrate/Competitorn/a
Meas. Tech.ChEMBL_718115 (CHEMBL1671568)
IC50 0.3±n/a nM
Citation Isabel, EMellon, CBoyd, MJChauret, NDeschênes, DDesmarais, SFalgueyret, JPGauthier, JYKhougaz, KLau, CKLéger, SLevorse, DALi, CSMassé, FPercival, MDRoy, BScheigetz, JThérien, MTruong, VLWesolowski, GYoung, RNZamboni, RBlack, WC Difluoroethylamines as an amide isostere in inhibitors of cathepsin K. Bioorg Med Chem Lett21:920-3 (2011) [PubMed]  Article
More Info.:Get all data from this article,  Assay Method
 
Cathepsin K
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:
MWGLKVLLLPVVSFALYPEEILDTHWELWKKTHRKQYNNKVDEISRRLIWEKNLKYISIH
NLEASLGVHTYELAMNHLGDMTSEEVVQKMTGLKVPLSHSRSNDTLYIPEWEGRAPDSVD
YRKKGYVTPVKNQGQCGSCWAFSSVGALEGQLKKKTGKLLNLSPQNLVDCVSENDGCGGG
YMTNAFQYVQKNRGIDSEDAYPYVGQEESCMYNPTGKAAKCRGYREIPEGNEKALKRAVA
RVGPVSVAIDASLTSFQFYSKGVYYDESCNSDNLNHAVLAVGYGIQKGNKHWIIKNSWGE
NWGNKGYILMARNKNNACGIANLASFPKM
Blast this sequence in BindingDB or PDB
  Blast E-value cutoff:
BDBM50336095
n/a
NameBDBM50336095
Synonyms:1-(4'-((S)-1-((S)-1-(1-cyanocyclopropylamino)-4-fluoro-4-methyl-1-oxopentan-2-ylamino)-2,2,2-trifluoroethyl)-2-fluorobiphenyl-4-yl)cyclopropanecarboxamide | CHEMBL1669442
TypeSmall organic molecule
Emp. Form.C28H29F5N4O2
Mol. Mass.548.5475
SMILESCC(C)(F)C[C@H](N[C@@H](c1ccc(cc1)-c1ccc(cc1F)C1(CC1)C(N)=O)C(F)(F)F)C(=O)NC1(CC1)C#N |r|
Structure
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