Fig. 9

Molecular docking interactions of ENU with risk model genes. (A) The chemical structure of ENU. (B) The bar graph shows the Vina docking scores for ENU with various proteins, with lower scores indicating stronger binding affinities. (C) Detailed molecular docking interaction between ENU and MGMT. (D) Molecular docking interaction between ENU and CA12. Hydrogen bonds and interaction sites are marked, with residues involved in binding interactions labeled (e.g., W65, H119)