Molecular Modeling Studies of Thiophenyl C-Aryl Glucoside SGLT2 Inhibitors as Potential Antidiabetic Agents

Figure 1

(a) Thiophenyl ring (template structure). (b) Alignment of thiophenyl derivatives. (c) Contribution charts of the descriptors for the 2D QSAR model-1. (d) Plot of observed versus predicted activity by 2D QSAR model-1. (e) Contribution plot for steric and electrostatic interactions GA-PLS model. (f) Plot of observed versus predicted activity by 3D QSAR GA-PLS model. (g) Contribution plot for steric and electrostatic interactions SA-PLS model. (h) Plot of observed versus predicted activity by 3D QSAR SA-PLS model. (i) Contribution plot for steric, hydrophobic, and electrostatic interactions SW-PLS model. (j) Plot of observed versus predicted activity by 3D QSAR SW-PLS model.

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