1,2,3-Triazole substituted phthalocyanine metal complexes as potential inhibitors for anticholinesterase and antidiabetic enzymes with molecular docking studies

Koçyiğit, Ümit M.; Taslımı, Parham; Tüzün, Burak; Yakan, Hasan; MUĞLU, Halit; Güzel, Emre

doi:10.1080/07391102.2020.1857842

1,2,3-Triazole substituted phthalocyanine metal complexes as potential inhibitors for anticholinesterase and antidiabetic enzymes with molecular docking studies

Yazarlar (6)

Ümit M. Koçyiğit Cumhuriyet Üniversitesi, Türkiye

Doç. Dr. Parham Taslımı Bartin Üniversitesi, Türkiye

Burak Tüzün Cumhuriyet Üniversitesi, Türkiye

Doç. Dr. Hasan Yakan Ondokuz Mayis Üniversitesi, Türkiye

Prof. Dr. Halit MUĞLU Kastamonu Üniversitesi, Türkiye

Prof. Dr. Emre Güzel Sakarya University Of Applied Sciences, Türkiye

Makale Türü	Özgün Makale (SSCI, AHCI, SCI, SCI-Exp dergilerinde yayınlanan tam makale)
Dergi Adı	Journal of Biomolecular Structure and Dynamics (Q2)
Dergi ISSN	0739-1102 Wos Dergi Scopus Dergi
Dergi Tarandığı Indeksler	SCI-Expanded
Makale Dili	Türkçe	Basım Tarihi	05-2022
Cilt / Sayı / Sayfa	40 / 10 / 4429–4439	DOI	10.1080/07391102.2020.1857842
Makale Linki	http://dx.doi.org/10.1080/07391102.2020.1857842

Özet

In recent years, acetylcholinesterase (AChE) and α-glycosidase (α-gly) inhibition have emerged as a promising and important approach for pharmacological intervention in many diseases such as glaucoma, epilepsy, obesity, cancer, and Alzheimer's. In this manner, the preparation and enzyme inhibition activities of peripherally 1,2,3-triazole group substituted metallophthalocyanine derivatives with strong absorption in the visible region were presented. These novel metallophthalocyanine derivatives (2-6) effectively inhibited AChE, with Ki values in the range of 40.11 ± 5.61 to 78.27 ± 15.42 µM. For α-glycosidase, the most effective Ki values of compounds 1 and 2 were with Ki values of 16.11 ± 3.13 and 18.31 ± 2.42 µM, respectively. Also, theoretical calculations were investigated to compare the chemical and biological activities of the ligand (1) and its metal complexes (2–6). Biological activities of 1 and its complexes against acetylcholinesterase for ID 4M0E (AChE) and α-glycosidase for ID 1R47 (α-gly) are calculated. Theoretical calculations were compatible with the experimental results and these 1,2,3-triazole substituted phthalocyanine metal complexes were found to be efficient inhibitors for anticholinesterase and antidiabetic enzymes. Communicated by Ramaswamy H. Sarma.

Anahtar Kelimeler

DFT studies | enzyme inhibition | molecular docking | Phthalocyanine | triazole

BM Sürdürülebilir Kalkınma Amaçları

Atıf Sayıları
Scopus	37

1,2,3-Triazole substituted phthalocyanine metal complexes as potential inhibitors for anticholinesterase and antidiabetic enzymes with molecular docking studies

Dergi Adı	JOURNAL OF BIOMOLECULAR STRUCTURE & DYNAMICS
Yayıncı	Taylor and Francis Ltd.
Açık Erişim	Hayır
ISSN	0739-1102
E-ISSN	1538-0254
CiteScore	8,3
SJR	0,552
SNIP	0,792

1,2,3-Triazole substituted phthalocyanine metal complexes as potential inhibitors for anticholinesterase and antidiabetic enzymes with molecular docking studies

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