Dual Binding Site and Selective Acetylcholinesterase Inhibitors Derived from Integrated Pharmacophore Models and Sequential Virtual Screening

Figure 1

Chemical structures of training set and test set compounds for AChE (A) and BuChE (B) (1–99) together with their biological activity data IC₅₀ (nM) (AChE)/(BuChE), in parentheses [10–14]. ^∗ND: not determined.