Combined Three Dimensional Quantitative Structure Activity Relationships (3D-...

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Combined Three Dimensional Quantitative Structure Activity
Relationships (3D-QSAR) Modeling and Molecular Docking Studies on
Naphthoquinone Analogs as Proteasome Inhibitors
Guanhong Xu, Zhou Zhou and Fei Li*
Department of Medicinal Chemistry, School of Pharmacy, Nanjing Medical University, China
Abstract: Proteasome inhibitors have been proved to be effective in regulated intracellular proteolysis. Three
Dimensional Quantitative Structure Activity Relationships and Molecular docking methods were performed on
naphthoquinone analogs as proteasome inhibitors. The bioactive conformation was explored by docking the potent
compound 29 into the