In silico screening of potent bioactive compounds from honeybee products against COVID-19 target enzymes

被引:0
作者
Moataz A. Shaldam
Galal Yahya
Nashwa H. Mohamed
Mohamed M. Abdel-Daim
Yahya Al Naggar
机构
[1] Kafr EL Sheikh University,Department of Pharmaceutical Chemistry, Faculty of Pharmacy
[2] Zagazig University,Microbiology and Immunology Department, Faculty of Pharmacy
[3] Technical University of Kaiserslautern,Department of Molecular Genetics, Faculty of Biology
[4] Hospitals of Zagazig University,Department of Zoology, College of Science
[5] King Saud University,Pharmacology Department, Faculty of Veterinary Medicine
[6] Suez Canal University,Zoology Department, Faculty of Science
[7] Tanta University,General Zoology, Institute for Biology
[8] Martin Luther University Halle-Wittenberg,undefined
来源
Environmental Science and Pollution Research | 2021年 / 28卷
关键词
COVID-19; Honeybee products; Phenolic compounds; Molecular docking; Drug repurposing; Natural products;
D O I
暂无
中图分类号
学科分类号
摘要
After the early advent of the Coronavirus Disease 2019 (COVID-19) pandemic, myriads of FDA-approved drugs have been massively repurposed for COVID-19 treatment based on molecular docking against selected protein targets that play fundamental roles in the replication cycle of the novel coronavirus. Honeybee products are well known of their nutritional values and medicinal effects. Bee products contain bioactive compounds in the form of a collection of phenolic acids, flavonoids, and terpenes of natural origin that display wide spectrum antiviral effects. We revealed by molecular docking the profound binding affinity of 14 selected phenolics and terpenes present in honey and propolis (bees glue) against the main protease (Mpro) and RNA-dependent RNA polymerase (RdRp) enzymes of the novel SARS-CoV-2 virus (the causative agent of COVID-19) using AutoDock Vina software. Of these compounds, p-coumaric acid, ellagic acid, kaempferol, and quercetin have the strongest interaction with the SARS-CoV-2 target enzymes, and it may be considered an effective COVID-19 inhibitor.
引用
收藏
页码:40507 / 40514
页数:7
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