Exploring Benzo[b][1,4]Thiazine Derivatives: Multitarget Inhibition, Structure–Activity Relationship, Molecular Docking, and ADMET Analysis
Yazarlar (12)
Alishba
University Of Karachi, Pakistan
Irfan Ali
University Of Karachi, Pakistan
Shehryar Hameed
University Of Karachi, Pakistan
Khalid Mohammed Khan
University Of Karachi, Pakistan
Uzma Salar
University Of Karachi, Pakistan
Muhammad Taha
Imam Abdulrahman Bin Faisal University, Suudi Arabistan
Dr. Öğr. Üyesi Nastaran Sadeghian Bartin Üniversitesi, Türkiye
Doç. Dr. Parham Taslimi Bartin Üniversitesi, Türkiye
Prof. Dr. Burak Tuzun Cumhuriyet Üniversitesi, Türkiye
Doç. Dr. Dilşad ÖZERKAN Kastamonu Üniversitesi, Türkiye
Huri Dedeakayogullari
Biruni Üniversitesi, Türkiye
Prof. Dr. Engin Ulukaya Istanbul Üniversitesi, Türkiye
Makale Türü Açık Erişim Özgün Makale (SSCI, AHCI, SCI, SCI-Exp dergilerinde yayınlanan tam makale)
Dergi Adı Chemistryselect (Q3)
Dergi ISSN 2365-6549 Wos Dergi Scopus Dergi
Dergi Tarandığı Indeksler SCI-Expanded
Makale Dili Türkçe Basım Tarihi 10-2024
Cilt / Sayı / Sayfa 9 / 38 / – DOI 10.1002/slct.202404087
Makale Linki http://dx.doi.org/10.1002/slct.202404087
UAK Araştırma Alanları
Hücre Biyolojisi
Özet
A series of benzothiazine derivatives (1–17) were synthesized via an intermolecular cyclocondensation reaction involving 2‐aminothiophenol (i) and substituted phenacyl bromide (ii). Structural elucidation of these synthetic derivatives utilized EI–MS, HR‐EIMS, 1H NMR, and 13C NMR spectroscopic techniques. The synthesized analogs were evaluated against key enzyme targets (acetylcholinesterase (AChE), butyrylcholinesterase (BChE), and α‐glucosidase (α‐Glu)) and tested for cytotoxicity against various cancer cell lines. Six compounds were selected based on their inhibition profiles, exhibiting significant inhibitory potential against enzymes. In silico studies corroborated the observed inhibitory activities, aligning closely with experimental outcomes. Additionally, an ADME/T study provided insights into pharmacokinetic and safety profiles, identifying promising candidates for future drug development efforts.
Anahtar Kelimeler
ADME/T | Alzheimer's disease | Cancer | Diabetes | Synthesis
BM Sürdürülebilir Kalkınma Amaçları
Atıf Sayıları
Web of Science 8
Scopus 10
Google Scholar 12
Exploring Benzo[b][1,4]Thiazine Derivatives: Multitarget Inhibition, Structure–Activity Relationship, Molecular Docking, and ADMET Analysis

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