Reaction Details Report a problem with these data
Target
Cathepsin K
Ligand
BDBM50251429
Substrate
n/a
Meas. Tech.
ChEMBL_490329 (CHEMBL982026)
IC50
0.015±n/a nM
Citation
 Hagmann, WK The many roles for fluorine in medicinal chemistry. J Med Chem 51:4359-69 (2008) [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:
BDBM50251429
Synonyms:
4'-Piperazin-1-yl-biphenyl-4-carboxylic acid [(S)-1-(cyanomethyl-carbamoyl)-3-methyl-butyl]-amide | CHEMBL480317
Type:
Small organic molecule
Emp. Form.:
C25H31N5O2
Mol. Mass.:
433.5459
SMILES:
CC(C)C[C@H](NC(=O)c1ccc(cc1)-c1ccc(cc1)N1CCNCC1)C(=O)NCC#N |r|
Structure:
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