Reaction Details Report a problem with these data
Target
Cathepsin B
Ligand
BDBM50174304
Substrate
n/a
Meas. Tech.
ChEMBL_326055 (CHEMBL864544)
IC50
100±n/a nM
Citation
Lescop, C; Herzner, H; Siendt, H; Bolliger, R; Henneböhle, M; Weyermann, P; Briguet, A; Courdier-Fruh, I; Erb, M; Foster, M; Meier, T; Magyar, JP; von Sprecher, A Novel cell-penetrating alpha-keto-amide calpain inhibitors as potential treatment for muscular dystrophy. Bioorg Med Chem Lett 15:5176-81 (2005) [PubMed] Article
More Info.:
Target
Name:
Cathepsin B
Synonyms:
APP secretase | APPS | CATB_HUMAN | CPSB | CTSB | Cathepsin B heavy chain | Cathepsin B light chain | Cathepsin B1
Type:
Enzyme
Mol. Mass.:
37819.69
Organism:
Homo sapiens (Human)
Description:
gi_63102437
Residue:
339
Sequence:
MWQLWASLCCLLVLANARSRPSFHPLSDELVNYVNKRNTTWQAGHNFYNVDMSYLKRLCGTFLGGPKPPQRVMFTEDLKLPASFDAREQWPQCPTIKEIRDQGSCGSCWAFGAVEAISDRICIHTNAHVSVEVSAEDLLTCCGSMCGDGCNGGYPAEAWNFWTRKGLVSGGLYESHVGCRPYSIPPCEHHVNGSRPPCTGEGDTPKCSKICEPGYSPTYKQDKHYGYNSYSVSNSEKDIMAEIYKNGPVEGAFSVYSDFLLYKSGVYQHVTGEMMGGHAIRILGWGVENGTPYWLVANSWNTDWGDNGFFKILRGQDHCGIESEVVAGIPRTDQYWEKI
Inhibitor
Name:
BDBM50174304
Synonyms:
CHEMBL198962 | N-((S)-1-((S)-1-(4-chlorophenyl)-4-(ethylamino)-3,4-dioxobutan-2-ylamino)-3-methyl-1-oxobutan-2-yl)-5-(1,2-dithiolan-3-yl)pentanamide
Type:
Small organic molecule
Emp. Form.:
C25H36ClN3O4S2
Mol. Mass.:
542.154
SMILES:
CCNC(=O)C(=O)[C@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](NC(=O)CCCCC1CCSS1)C(C)C