Brief Information of the Compound and Protein
Compound Name
[[(2R,3S,4R,5R)-3,4-dihydroxy-5-[4-(naphthalen-2-ylmethoxyamino)-2-oxopyrimidin-1-yl]oxolan-2-yl]methoxy-hydroxyphosphoryl]methylphosphonic acid
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PubChem ID
CID: 155516372
Canonical SMILES
O[C@@H]1[C@@H](COP(O)(=O)CP(O)(O)=O)O[C@H]([C@@H]1O)n1cc\c(=N/OCc2ccc3ccccc3c2)[nH]c1=O
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Compound Formula C21H25N3O11P2
Compound Structure
Protein Name
5'-nucleotidase
Protein Classification
Enzyme
>
Phosphatase
Uniprot ID
P21589
Gene Name
NT5E
Table of Molecular Bioactivities Related to the Compound and Protein
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000111 MDA-MB-231 Homo sapiens (Human)  1
1
Ki = 6.29 nM
   TI
   LI
   LO
   TS
CL000013 Sf9 Spodoptera frugiperda (Fall armyworm)  1
1
Ki = 6.88 nM
   TI
   LI
   LO
   TS