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Emami, Leila, Sadeghian, Sara, Moghtader Mansouri, Maryam, Sabet, Razieh, Faghih, Zeinab, Halimi, Sedigheh, Khabnadideh, Soghra, Rezaei, Zahra. (1404). Design, Synthesis, Molecular Docking of Novel Quinazolinone-azole Derivatives as Anticancer A gents. سامانه مدیریت نشریات علمی, 11(2), 163-172. doi: 10.30476/tips.2025.105887.1285
Leila Emami; Sara Sadeghian; Maryam Moghtader Mansouri; Razieh Sabet; Zeinab Faghih; Sedigheh Halimi; Soghra Khabnadideh; Zahra Rezaei. "Design, Synthesis, Molecular Docking of Novel Quinazolinone-azole Derivatives as Anticancer A gents". سامانه مدیریت نشریات علمی, 11, 2, 1404, 163-172. doi: 10.30476/tips.2025.105887.1285
Emami, Leila, Sadeghian, Sara, Moghtader Mansouri, Maryam, Sabet, Razieh, Faghih, Zeinab, Halimi, Sedigheh, Khabnadideh, Soghra, Rezaei, Zahra. (1404). 'Design, Synthesis, Molecular Docking of Novel Quinazolinone-azole Derivatives as Anticancer A gents', سامانه مدیریت نشریات علمی, 11(2), pp. 163-172. doi: 10.30476/tips.2025.105887.1285
Emami, Leila, Sadeghian, Sara, Moghtader Mansouri, Maryam, Sabet, Razieh, Faghih, Zeinab, Halimi, Sedigheh, Khabnadideh, Soghra, Rezaei, Zahra. Design, Synthesis, Molecular Docking of Novel Quinazolinone-azole Derivatives as Anticancer A gents. سامانه مدیریت نشریات علمی, 1404; 11(2): 163-172. doi: 10.30476/tips.2025.105887.1285

Design, Synthesis, Molecular Docking of Novel Quinazolinone-azole Derivatives as Anticancer A gents

Trends in Pharmaceutical Sciences and Technologies
مقاله 6، دوره 11، شماره 2، شهریور 2025، صفحه 163-172    اصل مقاله (808.64 K)
نوع مقاله: Original Article
شناسه دیجیتال (DOI): 10.30476/tips.2025.105887.1285
نویسندگان
Leila Emami1؛ Sara Sadeghian1؛ Maryam Moghtader Mansouri1؛ Razieh Sabet1؛ Zeinab Faghih2؛ Sedigheh Halimi1؛ Soghra Khabnadideh* 1، 2؛ Zahra Rezaei* 1
1Department of Medicinal Chemistry, School of Pharmacy, Shiraz University of Medical Sceinces, Shiraz, Iran.
2Pharmaceutical Sciences Research Center, Shiraz University of Medical Sciences, Shiraz, Iran.
چکیده
Cancer encompasses a diverse group of diseases characterized by uncontrolled cell division, leading to immune system impairment and the potential to metastasize to other regions of the body. Globally, cancer represents a significant threat to public health, ranking as the second most prevalent cause of death following cardiovascular diseases. Quinazoline and azole derivatives are important classes of compounds in medicinal chemistry with a wide variety of biological activities. Here, five quinazoline-azole hybrids were designed and synthesized as cytotoxic agents. The chemical structures of new compounds were confirmed using spectroscopic methods. Molecular docking studies were done on epidermal growth factor receptor (EGFR) as a potential target for quinazoline and azole derivatives. The binding energies and interactions of these ligands toward the active site of EGFR were analyzed in comparison with erlotinib. Interestingly, all compounds showed lower binding energies than erlotinib. In silico physicochemical parameters and ADME profiling calculations were also performed.

تازه های تحقیق

Soghra Khabnadideh (Google Scholar)

Zahra Rezaei (Google Scholar)

کلیدواژه‌ها
Quinazoline؛ Azole؛ Cytotoxic agent؛ EGFR
سایر فایل های مرتبط با مقاله
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