Target
Cathepsin K
Ligand
BDBM50201794
Substrate
n/a
Meas. Tech.
ChEMBL_1625296 (CHEMBL3867765)
Ki
11±n/a nM
Citation
 Aguda, AHLavallee, VCheng, PBott, TMMeimetis, LGLaw, SNguyen, NTWilliams, DEKaleta, JVillanueva, IDavies, JAndersen, RJBrayer, GDBrömme, D Affinity Crystallography: A New Approach to Extracting High-Affinity Enzyme Inhibitors from Natural Extracts. J Nat Prod 79:1962-70 (2016) [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:
BDBM50201794
Synonyms:
CHEMBL3897445
Type:
Small organic molecule
Emp. Form.:
C20H40N10O5
Mol. Mass.:
500.5956
SMILES:
CC(C)[C@H](NC(=O)[C@H](CO)NC(=O)NCCCCNC(N)=N)C(=O)N[C@H]1CCCN(C1O)C(N)=N |r|
Structure:
Search PDB for entries with ligand similarity: