Atatürk Üniversitesi Atatürk Üniversitesi
Ara
Yayınlara dön
Makale Tam Makale Uluslararası 2021

The biological activities, molecular docking studies, and anticancer effects of 1-arylsuphonylpyrazole derivatives

Parham Taslimi, Yavuz Erden, Sabir Mamedov, Lala Zeynalova, Nina Ladokhina, Recep Tas, Burak Tuzun, Afsun Sujayev, Nastaran Sadeghian, Saleh H. Alwasel, İlhami Gülçin

JOURNAL OF BIOMOLECULAR STRUCTURE & DYNAMICS Cilt 39 · Sayı 9 · ss. 3336–3346 · 01.06.2021
DOI ile aç

Özet

This work is devoted to definition of the direction of reaction between 1-benzenesulfonylimino pyridinium chloride and alpha- or beta-halo-containing sulfamides, chloroacetic acid, 1-chloro-2,3-dihydroxypropane, etc. The optimal conditions for the synchronous reaction of heterocyclization are determined. Benzenesulfonyliminopyridinium chloride was obtained to form pyrazolopyridines with 1,2-polarophiles, and pyridazine pyridines with 1,3-polarophiles. These novel derivatives were found as effective inhibitors of the alpha-glycosidase with K-i values in the range of 13.66 +/- 2.63-60.63 +/- 12.71 nM. The molecules (II-X) against enzyme were compared theoretically with the help of molecular docking to compare biological activities. The results were compared with the numerical values of the parameters obtained from molecular docking calculations and found to be in great agreement with the experimental results. However, ADME analysis of molecules was performed. Also, the compounds exhibited significant anticancer effect depending on the doses administered. Communicated by Ramaswamy H. Sarma

Anahtar kelimeler

IDENTIFICATION IN-VITRO GROWTH INHIBITION antioxidant SOLUBILITY Molecular docking enzyme inhibition anticancer DISCOVERY PROTEIN BORON COMPLEXES Pyrazolpiridines pyridazole pyridines

Atıf için künye

Taslimi, P., Erden, Y., Mamedov, S., Zeynalova, L., Ladokhina, N., Tas, R., Tuzun, B., Sujayev, A., Sadeghian, N., Alwasel, S. H., & Gülçin, İ. (2021). The biological activities, molecular docking studies, and anticancer effects of 1-arylsuphonylpyrazole derivatives. JOURNAL OF BIOMOLECULAR STRUCTURE & DYNAMICS, 39(9), 3336–3346. https://doi.org/10.1080/07391102.2020.1763838

BibTeX 
@article{taslimi2021-67978,
  author = {Taslimi, Parham and Erden, Yavuz and Mamedov, Sabir and Zeynalova, Lala and Ladokhina, Nina and Tas, Recep and Tuzun, Burak and Sujayev, Afsun and Sadeghian, Nastaran and Alwasel, Saleh H. and Gülçin, İlhami},
  title = {The biological activities, molecular docking studies, and anticancer effects of 1-arylsuphonylpyrazole derivatives},
  journal = {JOURNAL OF BIOMOLECULAR STRUCTURE & DYNAMICS},
  year = {2021},
  volume = {39},
  number = {9},
  pages = {3336--3346},
  issn = {0739-1102},
  doi = {10.1080/07391102.2020.1763838},
  url = {https://akademik.atauni.edu.tr/yayinlar/67978-the-biological-activities-molecular-docking-studies-and-anticancer-effects-of-1}
}