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TargetCathepsin K
LigandBDBM50252502
Substrate/Competitorn/a
Meas. Tech.ChEMBL_487681 (CHEMBL1009449)
IC50 6±n/a nM
Citation Irie, OEhara, TIwasaki, AYokokawa, FSakaki, JHirao, HKanazawa, TTeno, NHoriuchi, MUmemura, IGunji, HMasuya, KHitomi, YIwasaki, GNonomura, KTanabe, KFukaya, HKosaka, TSnell, CRHallett, A Discovery of selective and nonpeptidic cathepsin S inhibitors. Bioorg Med Chem Lett18:3959-62 (2008) [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:
BDBM50252502
n/a
NameBDBM50252502
Synonyms:6-(4-chlorobenzyl)-7-(cyclohexylmethyl)-7H-pyrrolo[2,3-d]pyrimidine-2-carbonitrile | CHEMBL492633
TypeSmall organic molecule
Emp. Form.C21H21ClN4
Mol. Mass.364.871
SMILESClc1ccc(Cc2cc3cnc(nc3n2CC2CCCCC2)C#N)cc1
Structure
Search PDB for entries with ligand similarity:Similarity to this molecule at least: