The chemical structures of lead molecules, and the structural relationships among these potential antiviral agents for Dengue virus.
<p><b>(a)</b> The molecular structures of lead compounds identified as top binders to the Domain III (DIII) of the Dengue virus E protein for each serotype. The compounds belong to two main classes: Nucleotide analogues (148197, 191763, 133406, 10705, 17473) and phenol ether (8296)...
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2024
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| Summary: | <p><b>(a)</b> The molecular structures of lead compounds identified as top binders to the Domain III (DIII) of the Dengue virus E protein for each serotype. The compounds belong to two main classes: Nucleotide analogues (148197, 191763, 133406, 10705, 17473) and phenol ether (8296). <b>(b)</b> Structural superimposition of the lead molecules identified from DIII binding for Dengue virus 1 (magenta), Dengue virus 2 (blue), Dengue virus 3 (orange), and Dengue virus 4 (green). Note identified small molecules bind at similar region across the serotypes.</p> |
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