Networkodynamic approach to perceive the key phytoconstituents of E. officinalis (Amla) as natural BACE1 inhibitors: an in-silico study DOI

Dhairiya Agarwal,

Jatin Malik,

Neeru Bhanwala

et al.

Journal of Biomolecular Structure and Dynamics, Journal Year: 2023, Volume and Issue: 42(22), P. 12304 - 12316

Published: Oct. 20, 2023

Alzheimer's disease (AD) is a deteriorating neural disorder, and currently, available drugs are ineffective in its treatment.

Language: Английский

Synthesis, crystal structure, Hirshfeld surface, computational and biological studies of spiro-oxindole derivatives as MDM2-p53 inhibitors DOI
Monisha Sivanandhan,

Sutha Ragupathy,

A. Thangamani

et al.

Molecular Diversity, Journal Year: 2024, Volume and Issue: unknown

Published: Aug. 29, 2024

Language: Английский

Citations

0
Computational studies to explore tea catechins and theaflavins as drug candidates DOI
Susmit Mhatre, Vandana Patravale

Elsevier eBooks, Journal Year: 2024, Volume and Issue: unknown, P. 671 - 680

Published: Oct. 1, 2024

Language: Английский

Citations

0
Human Riboviruses: A Comprehensive Study DOI

Gauravya Mohan,

Akangkha Choudhury,

Javeed Ia Bhat

et al.

Journal of Molecular Evolution, Journal Year: 2024, Volume and Issue: unknown

Published: Dec. 31, 2024

Language: Английский

Citations

0
Statins mimic and free radical scavenging potential of phytoconstituents of methanolic pod extract of Prosopis cineraria (L.) Druce DOI

Noopur Jaipal,

Heera Ram, Pramod Kumar

et al.

Vegetos, Journal Year: 2023, Volume and Issue: 37(4), P. 1357 - 1369

Published: July 24, 2023

Language: Английский

Citations

1
Predictive Assessment of the Antiviral Properties of Imperata cylindrica against SARS‐CoV‐2 DOI Creative Commons
Frank Eric Tatsing Foka, Hazel Tumelo Mufhandu

Advances in Virology, Journal Year: 2024, Volume and Issue: 2024(1)

Published: Jan. 1, 2024

The omicron variant and its sublineages are highly contagious, they still constitute a global source of concern despite vaccinations. Hospitalizations mortality rates resulting from infections by these variants common. existing therapeutic alternatives have presented various setbacks such as low potency, poor pharmacokinetic profiles, drug resistance. need for alternative options cannot be overemphasized. Plants their phytochemicals present interesting characteristics that make them suitable candidates the development antiviral agents. This study aimed to investigate potential Imperata cylindrica ( I. ). Specifically, objective this was identify display inhibitory effects against SARS‐CoV‐2 main protease (M pro ), conserved protein among coronaviruses. Molecular docking in silico assays were used assess 72 phytocompounds found ligands M (6LU7) target. Only eight (bifendate, cylindrene, tabanone, siderin, 5‐hydroxy‐2‐[2‐(2‐hydroxyphenyl)ethyl]‐4H‐1‐benzopyran‐4‐one, maritimin, 5‐methoxyflavone, flavone) displayed high binding affinities with scores ranging −5.6 kcal/mol −9.1 kcal/mol. toxicological revealed tabanone best safest phytochemical an agent coronavirus protease. Thus, served baseline further vitro vivo assessment validate findings.

Language: Английский

Citations

0
Therapeutic Management with Repurposing Approaches: A Mystery During COVID-19 Outbreak DOI

Soumik Chaudhury,

Paranjeet Kaur, Deepali Gupta

et al.

Current Molecular Medicine, Journal Year: 2023, Volume and Issue: 24(6), P. 712 - 733

Published: June 14, 2023

The ubiquitous pandemic that emerged due to COVID-19 affected the whole planet. People all over globe became vulnerable unpredictable emergence of coronavirus. sudden respiratory disease in coronavirus infected several patients. This human life drastically, from mild symptoms severe illness, leading mortality. is an exceptionally communicable caused by SARS-CoV-2. According a genomic study, viral spike RBD interactions with host ACE2 protein strains and interaction between highlighted potential change affinity virus causing outbreak progenitor type SARS-CoV-2, which could be principal reservoir, phylogenetically related SARS-like bat virus. Other research works reported intermediary hosts for transmission viruses humans include cats, bats, snakes, pigs, ferrets, orangutans, monkeys. Even arrival vaccines individuals getting vaccinated treated FDAapproved repurposed drugs like Remdesivir, first foremost steps aimed towards possible control minimization community social distancing, self-realization, self-health care. In this review paper, we discussed summarized various approaches methodologies adopted proposed researchers help management zoonotic following approaches.

Language: Английский

Citations

0
Networkodynamic approach to perceive the key phytoconstituents of E. officinalis (Amla) as natural BACE1 inhibitors: an in-silico study DOI

Dhairiya Agarwal,

Jatin Malik,

Neeru Bhanwala

et al.

Journal of Biomolecular Structure and Dynamics, Journal Year: 2023, Volume and Issue: 42(22), P. 12304 - 12316

Published: Oct. 20, 2023

Alzheimer's disease (AD) is a deteriorating neural disorder, and currently, available drugs are ineffective in its treatment.

Language: Английский

Citations

0