Brief Information of the Compound and Protein
Compound Name
[[4-[2-(1,3-benzothiazol-2-yl)-2-(benzotriazol-1-yl)-3-[4-[difluoro(phosphono)methyl]phenyl]propyl]phenyl]-difluoromethyl]phosphonic acid
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PubChem ID
CID: 44265698
Canonical SMILES
OP(O)(=O)C(F)(F)c1ccc(CC(Cc2ccc(cc2)C(F)(F)P(O)(O)=O)(c2nc3ccccc3s2)n2nnc3ccccc23)cc1
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Compound Formula C30H24F4N4O6P2S
Compound Structure
Protein Name
Tyrosine-protein phosphatase non-receptor type 1
Protein Classification
Enzyme
>
Phosphatase
>
Protein Phosphatase
>
Tyrosine protein phosphatase
Uniprot ID
P18031
Gene Name
PTPN1
Table of Molecular Bioactivities Related to the Compound and Protein
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000013 Sf9 Spodoptera frugiperda (Fall armyworm)  1
1
IC50 = 88 nM
   TI
   LI
   LO
   TS
Biochemical Assays
1 IC50 = 18 nM