Reaction Details |
| Report a problem with these data |
Target | Cathepsin K |
---|
Ligand | BDBM19832 |
---|
Substrate/Competitor | BDBM19480 |
---|
Meas. Tech. | Enzyme Inhibition Assay |
---|
pH | 5.5±n/a |
---|
Temperature | 295.15±n/a K |
---|
IC50 | 700±n/a nM |
---|
Citation | Crane, SN; Black, WC; Palmer, JT; Davis, DE; Setti, E; Robichaud, J; Paquet, J; Oballa, RM; Bayly, CI; McKay, DJ; Somoza, JR; Chauret, N; Seto, C; Scheigetz, J; Wesolowski, G; Massé, F; Desmarais, S; Ouellet, M Beta-substituted cyclohexanecarboxamide: a nonpeptidic framework for the design of potent inhibitors of cathepsin K. J Med Chem49:1066-79 (2006) [PubMed] Article |
---|
More Info.: | Get all data from this article, Inhibition_Run data, Solution Info, Assay Method |
---|
|
Cathepsin K |
---|
Name: | Cathepsin K |
Synonyms: | CATK_RABIT | CTSK |
Type: | Enzyme |
Mol. Mass.: | 36879.51 |
Organism: | Oryctolagus cuniculus (rabbit) |
Description: | n/a |
Residue: | 329 |
Sequence: | MWGLKVLLLPVVSFALHPEEILDTQWELWKKTYSKQYNSKVDEISRRLIWEKNLKHISIH
NLEASLGVHTYELAMNHLGDMTSEEVVQKMTGLKVPPSRSHSNDTLYIPDWEGRTPDSID
YRKKGYVTPVKNQGQCGSCWAFSSVGALEGQLKKKTGKLLNLSPQNLVDCVSENYGCGGG
YMTNAFQYVQRNRGIDSEDAYPYVGQDESCMYNPTGKAAKCRGYREIPEGNEKALKRAVA
RVGPVSVAIDASLTSFQFYSKGVYYDENCSSDNVNHAVLAVGYGIQKGNKHWIIKNSWGE
SWGNKGYILMARNKNNACGIANLASFPKM
|
|
|
BDBM19832 |
---|
BDBM19480 |
---|
Name | BDBM19832 |
Synonyms: | (1R,2R)-2-{[(3-aminophenyl)sulfanyl]methyl}-N-(cyanomethyl)cyclohexane-1-carboxamide | Cyclohexanecarboxamide derivative, 12p | racemic mixture |
Type | Small organic molecule |
Emp. Form. | C16H21N3OS |
Mol. Mass. | 303.422 |
SMILES | Nc1cccc(SC[C@@H]2CCCC[C@H]2C(=O)NCC#N)c1 |r| |
Structure |
|