Brief Information of the Compound and Protein
Compound Name
2-[3-(aminomethyl)azetidin-1-yl]-8-N-(cyclopropylmethyl)-4-N-(2-methylsulfanylphenyl)pyrimido[5,4-d]pyrimidine-4,8-diamine
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PubChem ID
CID: 70695887
Canonical SMILES
CSc1ccccc1Nc1nc(nc2c(NCC3CC3)ncnc12)N1CC(CN)C1
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Compound Formula C21H26N8S
Compound Structure
Protein Name
Ketohexokinase
Protein Classification
Enzyme
>
Transferase
Uniprot ID
P50053
Gene Name
KHK
Table of Molecular Bioactivities Related to the Compound and Protein
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000063 Hep-G2 Homo sapiens (Human)  1
1
IC50 = 590 nM
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