Bioactive compounds from mangosteen (Garcinia mangostana L.) as an antiviral agent via dual inhibitor mechanism against SARSCoV- 2: an in silico approach
Pharmacognosy Journal
; 14(1):85-90, 2022.
Article
in English
| CAB Abstracts | ID: covidwho-1903772
ABSTRACT
Severe acute respiratory syndrome coronavirus 2 (SARS-CoV-2) is the virus that causes COVID-19 which is responsible for respiratory illness infection in humans. The virus was first identified in China in 2019 and later spread to other countries worldwide. This study aims to identify the bioactive compounds from mangosteen (Garcinia mangostana L.) as an antiviral agent via dual inhibitor mechanisms against two SARS-CoV-2 proteases through the in silico approach. The three-dimensional structure of various bioactive compounds of mangosteen from the database was examined. Furthermore, all the target compounds were analyzed for drug, antiviral activity prediction, virtual screening, molecular interactions, and threedimensional structure visualization. It aimed to determine the potential of the bioactive compounds from mangosteen that can serve as antiviral agents to fight SARS-CoV-2. Results showed that the bioactive compounds from mangosteen have the prospective to provide antiviral agents that contradict the virus via dual inhibitory mechanisms. In summary, the binding of the various bioactive compounds from mangosteen results in low binding energy and is expected to have the ability to induce any activity of the target protein binding reaction. Therefore, it allows various bioactive compounds from mangosteen to act as dual inhibitory mechanisms for COVID-19 infection.
Prion, Viral, Bacterial and Fungal Pathogens of Humans [VV210]; Non-food/Non-feed Plant Products [SS200]; Animal and in vitro Models for Pharmaceuticals [VV450]; Horticultural Crops [FF003]; Composition and Quality of Non-food/Non-feed Plant Products [SS230]; Pesticides and Drugs; Control [HH405]; Non-wood Forest Products [KK540]; medicinal plants; coronavirus disease 2019; plant extracts; human diseases; viral diseases; antiviral properties; mangosteens; chemical composition; chemical structure; plant composition; non-wood forest products; Severe acute respiratory syndrome coronavirus 2; Garcinia mangostana; man; plants; Severe acute respiratory syndrome-related coronavirus; Betacoronavirus; Coronavirinae; Coronaviridae; Nidovirales; positive-sense ssRNA Viruses; ssRNA Viruses; RNA Viruses; viruses; Garcinia; Clusiaceae; Malpighiales; eudicots; angiosperms; Spermatophyta; eukaryotes; Homo; Hominidae; primates; mammals; vertebrates; Chordata; animals; SARS-CoV-2; drug plants; medicinal herbs; officinal plants; viral infections; anti-viral properties; chemical constituents of plants; minor forest products; non-timber forest products
Full text:
Available
Collection:
Databases of international organizations
Database:
CAB Abstracts
Language:
English
Journal:
Pharmacognosy Journal
Year:
2022
Document Type:
Article
Similar
MEDLINE
...
LILACS
LIS