Design, Synthesis and Molecular Modeling Studies of Triazole Derivatives as Aromatase İnhibitors. (PubMed, Chem Biol Drug Des)
Among the tested derivatives, compounds 6e and 6g exhibited significant cytotoxic activity against MCF-7 cells, with IC₅₀ values of 19.96 μM and 15.75 μM, respectively, demonstrating stronger activity than the reference drug cisplatin (21.42 μM). Molecular docking analysis demonstrated that the selected compounds exhibited binding interactions similar to letrozole within the aromatase active site. Based on combined cytotoxicity, enzyme inhibition, molecular docking, and ADME predictions, compound 6l emerged as the most promising candidate as a potential non-steroidal aromatase inhibitor.