Brief Information of the Compound and Protein
Compound Name
N-[3-[(6R)-8-amino-6-(difluoromethyl)-4-oxa-7-azaspiro[2.5]oct-7-en-6-yl]-4-fluorophenyl]-5-cyano-3-methylpyridine-2-carboxamide
    Show/Hide
PubChem ID
CID: 145962826
Canonical SMILES
Cc1cc(cnc1C(=O)Nc1ccc(F)c(c1)[C@@]1(COC2(CC2)C(N)=N1)C(F)F)C#N
    Show/Hide
Compound Formula C21H18F3N5O2
Compound Structure
Protein Name
Beta-secretase 1
Protein Classification
Enzyme
>
Protease
>
Aspartic protease
>
Aspartic protease AA clan
>
Aspartic protease A1A subfamily
Uniprot ID
P56817
Gene Name
BACE1
Table of Molecular Bioactivities Related to the Compound and Protein
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000011 CHO Cricetulus griseus (Chinese hamster)  1
1
IC50 = 4 nM
   TI
   LI
   LO
   TS
Biochemical Assays
1 IC50 = 25 nM