Synthesis, Anticancer Assessment, and Molecular Docking of Novel Chalcone-Thienopyrimidine Derivatives in HepG2 and MCF-7 Cell Lines

Figure 12

Binding mode/interactions of 3a (shown as sticks colored by element) in Bcl-2: (a) 3D binding mode of 3a overlaid with the cocrystallized DRO (yellow sticks) into the active site of Bcl-2; (b) 2D binding mode of 3a showing the hydrogen bonds and electrostatic and hydrophobic interactions with amino acids in Bcl-2.

(a)

(b)