Brief Information of the Compound and Protein
Compound Name
propan-2-yl 2-[3-acetyl-5-[[(2S,3R)-3-hydroxy-4-[(3-methoxyphenyl)methylamino]-1-phenylbutan-2-yl]carbamoyl]-2,4-dimethyl-4H-pyridin-1-yl]acetate
    Show/Hide
PubChem ID
CID: 46704268
SID: 98461708
Canonical SMILES
COc1cccc(CNC[C@@H](O)[C@H](Cc2ccccc2)NC(=O)C2=CN(CC(=O)OC(C)C)C(C)=C(C2C)C(C)=O)c1
    Show/Hide
Compound Formula C33H43N3O6
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
CL000006 HEK293 Homo sapiens (Human)  1
1
IC50 = 26100 nM
   TI
   LI
   LO
   TS