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. 2020 Jan 30;59(16):6342–6366. doi: 10.1002/anie.201900585

Figure 15.

Figure 15

A) Elaboration of initial hit NSC23766 using structure guided design to yield potent derivatives. Structures similar to known aggregators are shown in blue. Toxicophores/structural alerts are shown in purple. B) Crystal structure of NSC23766 bound to Rac1. Important residues forming the pocket, including critical residue W56, are shown.75