[HTML][HTML] Identification of bioactive molecules from Triphala (Ayurvedic herbal formulation) as potential inhibitors of SARS-CoV-2 main protease (Mpro) through …

M Rudrapal, I Celik, J Khan, MA Ansari… - Journal of King Saud …, 2022 - Elsevier
Severe acute respiratory syndrome coronavirus disease (SARS-CoV-2) induced coronavirus
disease 2019 (COVID-19) pandemic is the present worldwide health emergency. The global …

[HTML][HTML] Evaluation of clove phytochemicals as potential antiviral drug candidates targeting SARS-CoV-2 Main protease: computational docking, molecular dynamics …

A Chandra Manivannan, A Malaisamy… - Frontiers in Molecular …, 2022 - frontiersin.org
The severe acute respiratory syndrome coronavirus 2 (SARS-CoV-2) virus can cause a
sudden respiratory disease spreading with a high mortality rate arising with unknown …

Molecular docking of neohesperidin dihydrochalcone with the main components of SARS-CoV-2

Q Aljelehawy - Nano Micro Biosystems, 2023 - nmb-journal.com
Neohesperidin dihydrochalcone is an artificial sweetener with remarkable antioxidant
activity, stable to basic or acidic conditions and elevated temperatures. This bioactive …

A computational simulation appraisal of banana lectin as a potential anti-SARS-CoV-2 candidate by targeting the receptor-binding domain

SS Hessel, FM Dwivany, IM Zainuddin… - Journal of Genetic …, 2023 - Elsevier
Background The ongoing concern surrounding coronavirus disease 2019 (COVID-19)
primarily stems from continuous mutations in the genome of the severe acute respiratory …

An investigation for the interaction of gamma oryzanol with the Mpro of SARS-CoV-2 to combat COVID-19: DFT, molecular docking, ADME and molecular dynamics …

APS Raman, MB Singh, VK Vishvakarma… - Journal of …, 2023 - Taylor & Francis
COVID-19 has affected more or less every nation across the world and affected the economy
very badly. Infection of this virus in human took the life of millions. We have already faced the …

[HTML][HTML] Potential antiviral peptides targeting the SARS-CoV-2 spike protein

I Khater, A Nassar - BMC Pharmacology and Toxicology, 2022 - Springer
Background The coronavirus disease caused by the severe acute respiratory syndrome
coronavirus 2 (SARS-CoV-2) infection became an international pandemic and created a …

[HTML][HTML] Active Compounds in Zingiber officinale as Possible Redox Inhibitors of 5-Lipoxygenase Using an In Silico Approach

JS Ley-Martínez, JE Ortega-Valencia… - International Journal of …, 2022 - mdpi.com
5-Lipoxygenase (5-LOX) converts arachidonic acid to lipidic inflammatory mediators such as
leukotrienes (LTs). In diseases such as asthma, LTs contribute to a physiopathology that …

[HTML][HTML] Repurposing of neprilysin inhibitor 'sacubitrilat'as an anti-cancer drug by modulating epigenetic and apoptotic regulators

N Kumbhar, S Nimal, D Patil, VF Kaiser, J Haupt… - Scientific Reports, 2023 - nature.com
Modifications in the epigenetic landscape have been considered a hallmark of cancer.
Histone deacetylation is one of the crucial epigenetic modulations associated with the …

[HTML][HTML] DRaW: prediction of COVID-19 antivirals by deep learning—an objection on using matrix factorization

SM Hashemi, A Zabihian, M Hooshmand… - BMC …, 2023 - Springer
Background Due to the high resource consumption of introducing a new drug, drug
repurposing plays an essential role in drug discovery. To do this, researchers examine the …

Approaches Towards Better Immunosuppressive Agents

J Walczak, D Iwaszkiewicz-Grześ… - Current Topics in …, 2024 - ingentaconnect.com
Several classes of compounds are applied in clinics due to their immunosuppressive
properties in transplantology and the treatment of autoimmune diseases. Derivatives of …