Brief Information of the Compound and Protein
Compound Name
 Compound Info 
(4R)-4'-fluoro-7'-[(3-methyloxetan-3-yl)methoxy]-2'-pyridin-3-ylspiro[5H-1,3-oxazole-4,9'-xanthene]-2-amine
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 PubChem ID
CID: 89997464
Canonical SMILES
CC1(COc2ccc3Oc4c(F)cc(cc4[C@@]4(COC(N)=N4)c3c2)-c2cccnc2)COC1
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Compound Formula C25H22FN3O4
Compound Structure
Protein Name
 Protein Info 
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
CL000025 HEK-293T
 Cell Line Info 
Homo sapiens (Human)  1
1
IC50 = 178 nM
   TI
   LI
   LO
   TS
Biochemical Assays
1 IC50 = 71 nM