Reaction Details Report a problem with these data
Target
Cathepsin K
Ligand
BDBM50137391
Substrate
n/a
Meas. Tech.
ChEBML_48321
Ki
9.0±n/a nM
Citation
Kim, TS; Hague, AB; Lee, TI; Lian, B; Tegley, CM; Wang, X; Burgess, TL; Qian, YX; Ross, S; Tagari, P; Lin, CH; Mayeda, C; Dao, J; Jordan, S; Mohr, C; Cheetham, J; Viswanadhan, V; Tasker, AS (4-Piperidinylphenyl)aminoethyl amides as a novel class of non-covalent cathepsin K inhibitors. Bioorg Med Chem Lett 14:87-90 (2003) [PubMed] Article
More Info.:
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:
BDBM50137391
Synonyms:
((R)-1-{3-Phenyl-1-[(4-piperidin-1-yl-phenylamino)-methyl]-propylcarbamoyl}-ethyl)-carbamic acid benzyl ester | CHEMBL353633
Type:
Small organic molecule
Emp. Form.:
C32H40N4O3
Mol. Mass.:
528.685
SMILES:
C[C@@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H](CCc1ccccc1)CNc1ccc(cc1)N1CCCCC1