Target
Cathepsin B
Ligand
BDBM50033408
Substrate
n/a
Meas. Tech.
ChEMBL_1434318 (CHEMBL3386422)
IC50
2400±n/a nM
Citation
 Thomas, AAHunt, KWNewhouse, BWatts, RJLiu, XVigers, GSmith, DRhodes, SPBrown, KDOtten, JNBurkard, MCox, AAGeck Do, MKDutcher, DRana, SDeLisle, RKRegal, KWright, ADGroneberg, RLiao, JScearce-Levie, KSiu, MPurkey, HELyssikatos, JP 8-Tetrahydropyran-2-yl chromans: highly selective beta-site amyloid precursor protein cleaving enzyme 1 (BACE1) inhibitors. J Med Chem 57:10112-29 (2014) [PubMed]  Article 
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:
BDBM50033408
Synonyms:
CHEMBL3357656
Type:
Small organic molecule
Emp. Form.:
C20H19FN4O3
Mol. Mass.:
382.3883
SMILES:
[H][C@]12CCCO[C@]1([H])[C@@]1(N=C(N)N(C)C1=O)c1cc(ccc1O2)-c1cccnc1F |r,t:10|
Structure:
Search PDB for entries with ligand similarity: