In Silico Design of Human IMPDH Inhibitors Using Pharmacophore Mapping and Molecular Docking Approaches

Figure 2

(a) 3D spatial relationship and geometric parameters of hypo-07. Pharmacophore features colored as follows: H-bond acceptor (green), H-bond donor (magenta), hydrophobic_aliphatic group (cyan) and hydrophobic_aromatic group (sky blue). (b) Hypo-07 mapping with active compound 5. (c) Hypo-07 mapping with active compound 20. (d) Hypo-07 mapping with moderate active compound 22.

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