Brief Information of the Compound and Protein
Compound Name
[(2R,3S,4R,5R)-5-[6-chloro-4-(cyclopentylamino)pyrazolo[3,4-d]pyrimidin-1-yl]-3,4-dihydroxyoxolan-2-yl]methoxymethylphosphonic acid
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PubChem ID
CID: 135348940
Canonical SMILES
O[C@H]1[C@@H](O)[C@@H](O[C@@H]1COCP(O)(O)=O)n1ncc2c(NC3CCCC3)nc(Cl)nc12
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Compound Formula C16H23ClN5O7P
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
CL000011 CHO Cricetulus griseus (Chinese hamster)  2
1
IC50 = 2.6 nM
   TI
   LI
   LO
   TS
2
IC50 = 11 nM
   TI
   LI
   LO
   TS
CL000084 SK-OV-3 Homo sapiens (Human)  1
1
IC50 = 0.55 nM
   TI
   LI
   LO
   TS
Biochemical Assays
1 IC50 = 0.86 nM