Synthesis, molecular docking study of thiazole derivatives and exploring their dual inhibitor potentials against α-amylase and α-glucosidase

被引：13

作者：

Ullah, Hayat ^{[1
]}

Ahmad, Nisar ^{[2
]}

Rahim, Fazal ^{[2
]}

Uddin, Imad ^{[3
]}

Hayat, Shawkat ^{[2
]}

Zada, Hussan ^{[2
]}

Zaman, Khalid ^{[2
]}

Farooqi, Kamran ^{[2
]}

Bakhtiar, Manahil ^{[2
]}

Khan, Irshad Ullah ^{[2
]}

Rehman, Ashfaq Ur ^{[4
,5
]}

Wadood, Abdul ^{[5
]}

机构：

[1] Univ Okara, Dept Chem, Okara 56300, Punjab, Pakistan

[2] Hazara Univ, Dept Chem, Mansehra 21300, Khyber Pakhtunk, Pakistan

[3] Univ Haripur, Dept Chem, Haripur 22620, Khyber Pakhtunk, Pakistan

[4] Univ Calif Irvine, Dept Mol Biol & Biochem, Irvine, CA 92697 USA

[5] Abdul Wali Khan Univ Mardan, Dept Biochem, Mardan 23200, Pakistan

来源：

CHEMICAL DATA COLLECTIONS | 2022年 / 41卷

关键词：

Synthesis; Thiazole; alpha-amylase; alpha-glucosidase; Structure-activity relationship; Molecular docking; NONLINEAR-OPTICAL PROPERTIES; IN-VITRO EVALUATION; BETA-GLUCURONIDASE; BIOLOGICAL EVALUATION; ANALOGS; ACETYLCHOLINESTERASE; THIOSEMICARBAZIDES;

D O I：

10.1016/j.cdc.2022.100932

中图分类号：

O6 [化学];

学科分类号：

0703 ;

摘要：

Diabetes mellitus is one of the most chronic metabolic diseases. The current study comprises of evaluation of thiazole as an antidiabetic agent. A library of sixteen derivatives was synthesized, characterized through different spectroscopic techniques, and evaluated against alpha-amylase and alpha-glucosidase enzymes. All derivatives displayed varied degree of alpha-amylase inhibition ranging from 0.6 +/- 0.05 to 32.20 +/- 0.50 mu M and alpha-glucosidase activity ranging from 0.50 +/- 0.05 to 32.70 +/- 0.50 mu M as compared to standard drug acarbose (IC50 = 8.90 +/- 0.10 mu M and 9.10 +/- 0.10 mu M respectively). In both cases; derivative 6 (IC50 = 0.6 +/- 0.05 mu M & 0.50 +/- 0.05 mu M) were found potent among the series. Structural activity relationship has been established for all derivatives which mainly depend upon nature, position, and number of substituent/s on the phenyl ring. A molecular docking study was carried out to find the binding interaction of the most potent derivatives with active sites of enzymes.

引用

页数：13

共 48 条

[1]

Adeghate E, 2001, Arch Physiol Biochem, V109, P197, DOI 10.1076/apab.109.3.197.11588

[2] An update on the etiology and epidemiology of diabetes mellitus [J].