2,3-Dihydroquinazolin-4(1H)-one derivatives as potent aldose reductase inhibitors: a combined experimental and computational study
Yazarlar (4)
Doç. Dr. Feyzi Sinan TOKALI Kafkas Üniversitesi, Türkiye
Yeliz Demir Ardahan Üniversitesi, Türkiye
Nurgül Abul Atatürk Üniversitesi, Türkiye
Doç. Dr. Halil Şenol Bezm-İ Âlem Vakıf Üniversitesi, Türkiye
| Makale Türü | Özgün Makale (SSCI, AHCI, SCI, SCI-Exp dergilerinde yayınlanan tam makale) | ||
| Dergi Adı | Bioorganic Chemistry (Q1) | ||
| Dergi ISSN | 0045-2068 Dergi Bilgileri (2026) | ||
| Dergi Tarandığı Indeksler | SCI-Expanded | ||
| Makale Dili | İngilizce | Basım Tarihi | 09-2026 |
| Cilt / Sayı / Sayfa | 180 / 1 / – | DOI | 10.1016/j.bioorg.2026.110081 |
| Makale Linki | https://doi.org/10.1016/j.bioorg.2026.110081 | ||
| UAK Araştırma Alanları |
Organik Kimya
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| Özet |
| Abstract A series of sixteen 2,3-dihydroquinazolin-4(1 H )-one derivatives was designed and synthesized to evaluate their potential as aldose reductase (ALR2) inhibitors for the management of diabetic complications. The synthesized compounds were structurally characterized by FT-IR, NMR, and HRMS analyses, and their inhibitory activities were assessed through in vitro enzyme assays. All compounds exhibited notable ALR2 inhibition, with K i values ranging from 0.052 to 1.272 μM. Among them, compound 9 demonstrated the highest potency ( K i = 0.052 μM), showing approximately 21-fold stronger activity than the reference inhibitor epalrestat ( K i = 1.124 μM). Structure-activity relationship analysis revealed that para-positioned electron-donating substituents and optimally positioned hydrogen-bond donor groups significantly enhance inhibitory activity, while ortho substitution adversely affects binding … |
| Anahtar Kelimeler |
| 2,3-dihydroquinazolin-4(1H)-one | Aldose reductase | ALR2 | Inhibition | Molecular dynamics |
Science Direct
2,3-Dihydroquinazolin-4(1H)-one derivatives as potent aldose reductase inhibitors: a combined experimental and computational study
BM Sürdürülebilir Kalkınma Amaçları
| Atıf Sayıları | |
| Web of Science | 1 |
| Scopus | 2 |
| Google Scholar | 3 |