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1.
Asian Journal of Medical Sciences ; 13(2):37-42, 2022.
Article in English | Academic Search Complete | ID: covidwho-1686400

ABSTRACT

Background: Novel coronavirus infections cause major morbidity and mortality globally in the all age groups, including the pediatric population. Viral respiratory infections in children may act as a source of infection especially those with asymptomatic SARS-CoV-2 infections. Aims and Objectives: The aim is to analyze the SARS-CoV-2 characteristics in pediatric age group. Materials and Methods: Ninety seven children neonate to 5 years age tested positive by RT-PCR were included in the study. Detailed data on socio-demography, epidemiology, clinical characteristics, laboratory findings, comorbidities, management, and outcome of the study population were collected. Results: Sex distribution showed 47 (48.4%) male and 50 (51.5%) female. Among these 97, 5 children (5.1%) were <28 days of age, 30 children were (31%) neonate to infant age, and 62 children were (63.9%) above 1 year but <5 years of age. The group was divided into two-one with 56 children (57.7%) who were discharged, 2nd with 41 (42.3%) hospitalized children. 1st group was asymptomatic (64.3%)/mildly symptomatic (35.7%). In 2nd group 36.5% were moderately symptomatic, 29.2% were with severe complications, and 34.3% of children were critical--22 (52.6%) required PICU admission--17 children (41.4%) required mechanical ventilation and 36 (87.8%) required respiratory support. Conclusion: Reports state that COVID-19 infection is mild in the pediatric population but our findings suggest that some children can develop severe/critical infection requiring hospitalization, respiratory support, and mechanical ventilation. [ FROM AUTHOR] Copyright of Asian Journal of Medical Sciences is the property of Manipal Colleges of Medical Sciences and its content may not be copied or emailed to multiple sites or posted to a listserv without the copyright holder's express written permission. However, users may print, download, or email articles for individual use. This may be abridged. No warranty is given about the accuracy of the copy. Users should refer to the original published version of the material for the full . (Copyright applies to all s.)

2.
J Biomol Struct Dyn ; 39(15): 5768-5778, 2021 Sep.
Article in English | MEDLINE | ID: covidwho-1390294

ABSTRACT

The entire human population over the globe is currently facing appalling conditions due to the spread of infection from coronavirus disease-2019 (COVID-19). The spike glycoprotein of severe acute respiratory syndrome coronavirus 2 (SARS-CoV-2) present on the surface of the virion mediates the virus entry into the host cells and therefore is targeted by several scientific groups as a novel drug target site. The spike glycoprotein binds to the human angiotensin-converting enzyme-2 (hACE2) cell surface receptor abundantly expressed in lung tissues, and this binding phenomenon is a primary determinant of cell tropism and pathogenesis. The binding and internalization of the virus is the primary and most crucial step in the process of infection, and therefore the molecules targeting the inhibition of this process certainly hold a significant therapeutic value. Thus, we systematically applied the computational techniques to identify the plausible inhibitor from a chosen set of well characterized diaryl pyrimidine analogues which may disrupt interfacial interaction of spike glycoprotein (S) at the surface of hACE2. Using molecular docking, molecular dynamics (MD) simulation and binding free energy calculation, we have identified AP-NP (2-(2-amino-5-(naphthalen-2-yl)pyrimidin-4-yl)phenol), AP-3-OMe-Ph (2-(2-amino-5-(3-methoxyphenyl)pyrimidin-4-yl)phenol) and AP-4-Me-Ph (2-(2-amino-5-(p-tolyl) pyrimidin-4-yl)phenol) from a group of diaryl pyrimidine derivatives which appears to bind at the interface of the hACE2-S complex with low binding free energy. Thus, pyrimidine derivative AP-NP may be explored as an effective inhibitor for hACE2-S complex. Furthermore, in vitro and in vivo studies will strengthen the use of these inhibitors as suitable drug candidates against SARS-COV-2. Communicated by Ramaswamy H. Sarma.


Subject(s)
COVID-19 , Pharmaceutical Preparations , Humans , Molecular Docking Simulation , Molecular Dynamics Simulation , Pyrimidines/pharmacology , SARS-CoV-2 , Spike Glycoprotein, Coronavirus
3.
Heliyon ; 6(9): e05007, 2020 Sep.
Article in English | MEDLINE | ID: covidwho-802605

ABSTRACT

The coronavirus disease 2019 (COVID-19), the pandemic that originated in China has already spread into more than 190 countries, resulting in huge loss of human life and many more are at the stake of losing it; if not intervened with the best therapeutics to contain the disease. For that aspect, various scientific groups are continuously involved in the development of an effective line of treatment to control the novel coronavirus from spreading rapidly. Worldwide scientists are evaluating various biomolecules and synthetic inhibitors against COVID-19; where the nucleic acid-based molecules may be considered as potential drug candidates. These molecules have been proved potentially effective against SARS-CoV, which shares high sequence similarity with SARS-CoV-2. Recent advancements in nucleic acid-based therapeutics are helpful in targeted drug delivery, safely and effectively. The use of nucleic acid-based molecules also known to regulate the level of gene expression inside the target cells. This review mainly focuses on various nucleic acid-based biologically active molecules and their therapeutic potentials in developing vaccines for SARS-CoV-2.

4.
Med Drug Discov ; 7: 100049, 2020 Sep.
Article in English | MEDLINE | ID: covidwho-728766

ABSTRACT

The Bacillus Calmette-Guerin vaccine (BCG vaccine) designed to prevent tuberculosis in children has been shown to induce a adaptive immune response in the body to fight against bacteria as well as other parasites and viruses. This knowledge has been reciprocated to generate the idea that this vaccine can also offer protection against severe acute respiratory syndrome coronavirus-2 (SARS-COV-2). Some recent pre-print articles have highlighted that countries with mass BCG immunizations seems to have a lower incidence of coronavirus disease 2019 (COVID-19) compared to those without BCG immunization. There are yet no experimental proof of any such association and the world health organisation (WHO) is currently testing the theory with clinical trials on selected cohorts. Epidemiologists and other scientific experts has expressed both their hope and concern simultaneously regarding the success theory of BCG vaccination to prevent COVID-19. Though its still not verified in any way whether the BCG vaccination can actually prevent COVID-19 or not but we believe a thorough analytical research in this regard is indeed worth a shot.

5.
J Biomol Struct Dyn ; 39(16): 6306-6316, 2021 Oct.
Article in English | MEDLINE | ID: covidwho-671285

ABSTRACT

Spike glycoprotein, a class I fusion protein harboring the surface of SARS-CoV-2 (SARS-CoV-2S), plays a seminal role in the viral infection starting from recognition of the host cell surface receptor, attachment to the fusion of the viral envelope with the host cells. Spike glycoprotein engages host Angiotensin-converting enzyme 2 (ACE2) receptors for entry into host cells, where the receptor recognition and attachment of spike glycoprotein to the ACE2 receptors is a prerequisite step and key determinant of the host cell and tissue tropism. Binding of spike glycoprotein to the ACE2 receptor triggers a cascade of structural transitions, including transition from a metastable pre-fusion to a post-fusion form, thereby allowing membrane fusion and internalization of the virus. From ancient times people have relied on naturally occurring substances like phytochemicals to fight against diseases and infection. Among these phytochemicals, flavonoids and non-flavonoids have been the active sources of different anti-microbial agents. We performed molecular docking studies using 10 potential naturally occurring compounds (flavonoids/non-flavonoids) against the SARS-CoV-2 spike protein and compared their affinity with an FDA approved repurposed drug hydroxychloroquine (HCQ). Further, our molecular dynamics (MD) simulation and energy landscape studies with fisetin, quercetin, and kamferol revealed that these molecules bind with the hACE2-S complex with low binding free energy. The study provided an indication that these molecules might have the potential to perturb the binding of hACE2-S complex. In addition, ADME analysis also suggested that these molecules consist of drug-likeness property, which may be further explored as anti-SARS-CoV-2 agents. Communicated by Ramaswamy H. Sarma.


Subject(s)
COVID-19 , Spike Glycoprotein, Coronavirus , Drug Development , Humans , Molecular Docking Simulation , Molecular Dynamics Simulation , Phytochemicals , Protein Binding , SARS-CoV-2 , Spike Glycoprotein, Coronavirus/metabolism
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