Chemical and Molecular Engineering | Article | Published 2024

Sitralning biologik faolligini virtual skrining usullari yordamida o'rganish

Authors:

Dilshod Mansurov

Collection: FarDU.Ilmiy xabarlar jurnali (Aniq va tabiiy fanlar)
Keywords: SwissADME, PASS Online, Molekulyar doking, BOILED-Egg, sitral, virtual skrining.

Abstract

Ushbu maqolada virtual skrining usullaridan foydalangan holda efir moylari tarkibida uchraydigan terepenoidlar sinfiga mansub bo‘lgan sitralning biologik faolligini o‘rganish natijalari yoritilgan. Tadqiqot sitralning potensial biologik ta’sirini bashorat qilish uchun hisoblash usullarini qo‘llaydi, bunda virtual skrining usullari yordamida dorivor moddalarni topish uchun iqtisodiy va vaqtni tejovchi strategiya sifatida foydalaniladi. Fermentlar yoki retseptorlar kabi sitral va maqsadli biomolekulalar o‘rtasidagi o‘zaro ta’sirlarni tahlil qilish orqali ushbu tadqiqot sitralning farmakologik xususiyatlariga asoslangan molekulyar mexanizmlarni ochishga qaratilgan. Olingan natijalar sitralning terapevtik potensialini yaxshiroq tushunishga yordam beradi va turli kasalliklar va sharoitlarga qaratilgan kelajakdagi dori-darmonlarni ishlab chiqish uchun qimmatli tadqiqot ma’lumotlarini beradi.

References

  1. Saddiq, Amna A., and Suzan A. Khayyat. (2010). Chemical and antimicrobial studies of monoterpene: Citral. Pesticide Biochemistry and Physiology, 98.1: 89-93.
  2. Leite, Maria Clerya Alvino, et al. (2014). Evaluation of antifungal activity and mechanism of action of citral against Candida albicans. Evidence-Based Complementary and Alternative Medicine.
  3. Sharma, Sandeep, et al. (2021). Chemical properties and therapeutic potential of citral, a monoterpene isolated from lemongrass. Medicinal Chemistry 17.1:2-12.
  4. Lohidakshan, Krishnakumar, et al. (2018) Pass and Swiss ADME collaborated in silico docking approach to the synthesis of certain pyrazoline spacer compounds for dihydrofolate reductase inhibition and antimalarial activity. Bangladesh Journal of Pharmacology, 13.1: 23-29.
  6. Huang, Ya-Ru, et al. (2022). Research progress of extraction method and biological activity of natural citral. 3217-3228.
  7. Onawunmi, Grace O. (1989). Evaluation of the antimicrobial activity of citral. Letters in applied microbiology, 9.3:105-108.
  8. Thielmann, J., and P. Muranyi. (2019). Review on the chemical composition of Litsea cubeba essential oils and the bioactivity of its major constituents citral and limonene. Journal of essential oil research, 31.5: 361-378.
  9. Daina, Antoine, Olivier Michielin, and Vincent Zoete. (2017). “SwissADME: a free web tool to evaluate pharmacokinetics, drug-likeness and medicinal chemistry friendliness of small molecules. Scientific reports, 7.1: 42717.
  10. Mahanthesh, M. T., et al. (2020). “Swiss ADME prediction of phytochemicals present in Butea monosperma (Lam.) Taub. Journal of Pharmacognosy and Phytochemistry, 9.3: 1799-1809.
  11. Ranjith, D., and C. Ravikumar. (2019). “Swiss ADME predictions of pharmacokinetics and drug-likeness properties of small molecules present in Ipomoea mauritiana Jacq. Journal of Pharmacognosy and Phytochemistry, 8.5: 2063-2073.
  12. Al Azzam, Khaldun M., El-Sayed Negim, and Hassan Y. Aboul-Enein. (2022). “ADME studies of TUG-770 (a GPR-40 inhibitor agonist) for the treatment of type 2 diabetes using SwissADME predictor: In silico study. Journal of Applied Pharmaceutical Science, 12.4: 159-169.
  13. Bakchi, Bulti, et al. (2022). An overview on applications of SwissADME web tool in the design and development of anticancer, antitubercular and antimicrobial agents: A medicinal chemist’s perspective. Journal of Molecular Structure, 1259: 132712.
  14. Ayar, Arif, et al. (2022). Antioxidant, cytotoxic activity and pharmacokinetic studies by Swiss Adme, Molinspiration, Osiris and DFT of PhTAD-substituted dihydropyrrole derivatives. Current Computer-aided Drug Design, 18.1: 52-63.
  15. Dilshod Mansurov, Alisher Khaitbaev, Khamid Khaitbaev. (2023). Phytoncides: exploring their chemical composition, diverse biological activities and modern scientific applications. O‘zbekiston Milliy universiteti xabarlari, [3/2/1] ISSN 2181-7324 http://journals.nuu.uz/.
  16. Рахмонов Б.Д., Мансуров Д.А., Якубов У.М. (2023). Autodock дастури ёрдамида эпилепсия оқсили билан хиназолон-4 ҳосилаларининг боғланишини ўрганиш” Educational Research in Universal Sciences ISSN: 2181-3515 2 (4), 955-958
  18. Mansurov D.A., D.A. Ubaydullayev, T.S. Xoliqov. (2023). Salitsil, antronil kislota, anis spirit va psevdoefedrinlarning biologik faolliklarini Pass (online) dasturida o‘rganish. Funksional polimerlarning fundamental va amaliy jihatlari, 406-408.
  19. Mansurov D.A, Shukurullayeva, F.J Abduxaliqov. (2023). Gossipolning 3-xlorobenzilgidrazidli hosilasining biologik faolligini nazariy o‘rganish. Educational Research in Universal Sciences, 2 (2), 300-302.
  20. Mansurov D.A., Ganiyeva I., Negmatova M., Hudoynazarov I.A. (2023). Studying the results of binding of menthol, limonene and geraniols with bacterial protein "2BL8" by AutoDock Tools program. O‘zbekiston milliy universiteti xabarlari, 3, 423-426.
  21. Habib, Shagufta, et al. (2020). In silico, in-vitro and in vivo screening of biological activities of citral. International Journal for Vitamin and Nutrition Research.
  22. Zhou, Haien, Nengguo Tao, and Lei Jia. (2014). Antifungal activity of citral, octanal and α-terpineol against Geotrichum citri-aurantii. Food Control 37: 277-283.
  23. Pucci, Marzia, et al. (2020). Biological properties of a citral-enriched fraction of Citrus limon essential oil. Foods 9.9: 1290.
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