Brief Information of the Compound and Protein
Compound Name
 Compound Info 
US9085576, 140
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 PubChem ID
CID: 118796783
Canonical SMILES
NC1=N[C@](CF)([C@@H]2C[C@@H]2O1)c1cc(NC(=O)c2ccc(OCC#C)cn2)cc(F)c1Cl
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Compound Formula C21H17ClF2N4O3
Compound Structure
Protein Name
 Protein Info 
Cathepsin D
Protein Classification
Enzyme
>
Protease
>
Aspartic protease
>
Aspartic protease AA clan
>
Aspartic protease A1A subfamily
Uniprot ID
P07339
Gene Name
CTSD
Table of Molecular Bioactivities Related to the Compound and Protein
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000011 CHO
 Cell Line Info 
Cricetulus griseus (Chinese hamster)  1
1
IC50 = 86900 nM
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   LI
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   TS