Literature DB >> 31978686

Dihydropyridines as potential α-amylase and α-glucosidase inhibitors: Synthesis, in vitro and in silico studies.

Hina Yousuf1, Shahbaz Shamim1, Khalid Mohammed Khan2, Sridevi Chigurupati3, Shehryar Hameed1, Muhammad Naseem Khan4, Muhammad Taha5, Minhajul Arfeen3.   

Abstract

Dihydropyridine derivatives 1-31 were synthesized via one-pot solvent free condition and screened for in vitro against α-amylase and α-glucosidase enzyme. The synthetic derivatives 1-31 showed good α-amylase inhibition in the range of IC50 = 2.21 ± 0.06-9.97 ± 0.08 µM, as compared to the standard drug acarbose (IC50 = 2.01 ± 0.1 µM) and α-glucosidase inhibition in the range of IC50 = 2.31 ± 0.09-9.9 ± 0.1 µM as compared to standard acarbose (IC50 = 2.07 ± 0.1 µM), respectively. To determine the mode of binding interactions of synthetic molecules with active sites of enzyme, molecular docking studies were also performed. Different spectroscopic techniques such as 1H, 13C NMR, EI-MS, and HREI-MS were used to characterize all the synthetic compounds.
Copyright © 2020 Elsevier Inc. All rights reserved.

Entities:  

Keywords:  Dihydropyridine; In silico studies; In vitro; Structure-activity relationship (SAR); Synthesis; α-amylase; α-glucosidase

Mesh:

Substances:

Year:  2020        PMID: 31978686     DOI: 10.1016/j.bioorg.2020.103581

Source DB:  PubMed          Journal:  Bioorg Chem        ISSN: 0045-2068            Impact factor:   5.275


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