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C96 was generated from a virtual screen using PI3Kγ as the subject against 800,000 compounds in total from Specs and ChemBridge Chemicals. The molecular docking and scoring were accomplished by using the Schrodinger (Glide), HTVS, SP, and XP modes, followed by Sybyl clustering. Top hits were then verified at the cell-based experiments and singled out for further studies.
