[HTML][HTML] Prediction of COVID-19 manipulation by selective ACE inhibitory compounds of Potentilla reptant root: In silico study and ADMET profile

Y Xu, M Al-Mualm, EM Terefe… - Arabian Journal of …, 2022 - Elsevier
In the novel SARS-CoV-2 (COVID-19) as a global emergency event, the main reason of the
cardiac injury from COVID-19 is angiotensin-converting enzyme 2 (ACE2) targeting in SARS …

Synthesis, in silico, in vitro and in vivo evaluations of isatin aroylhydrazones as highly potent anticonvulsant agents

S Emami, M Valipour, FK Komishani… - Bioorganic …, 2021 - Elsevier
In this study, a series of new isatin aroylhydrazones (5a-e and 6a-e) was synthesized and
evaluated for their anticonvulsant activities. The (Z)-configuration of compounds was …

Inhibitory Effect of Delphinidin on Oxidative Stress Induced by H2O2 in HepG2 Cells

J Xu, Y Zhang, G Ren, R Yang, J Chen… - Oxidative Medicine …, 2020 - Wiley Online Library
Chronic liver diseases (CLDs) are correlated with oxidative stress induced by the
accumulation of intracellular reactive oxygen species (ROS). In this study, we employed …

DFT, molecular docking, and ADMET studies for the adsorption behavior and anti-inflammatory activity of thiazole by B12N12 and OH-B12N12 nanoclusters

F Pan, AT Jalil, F Alsaikhan, M Adil, AJ Kadhim… - Diamond and Related …, 2023 - Elsevier
To assess the interaction of thiazole (TZL) with the pure and hydroxyl-functionalized boron
nitride (OH-B 12 N 12) nanoclusters, we used density functional theory (DFT) and molecular …

[HTML][HTML] Improved anti-inflammatory and anticancer properties of celecoxib loaded zinc oxide and magnesium oxide nanoclusters: a molecular docking and density …

N Sun, MJ Ansari, ANK Lup, M Javan, A Soltani… - Arabian Journal of …, 2022 - Elsevier
Present study offers great prospects for the adsorption of anti-inflammatory celecoxib
molecule (CXB) over the surface of zinc oxide (Zn 12 O 12) and magnesium oxide (Mg 12 O …

Brazilian green propolis: chemical composition of essential oil and their in vitro antioxidant, antibacterial and antiproliferative activities

RL Quintino, AC Reis, CC Fernandes… - Brazilian Archives of …, 2020 - SciELO Brasil
Propolis is a resinous substance collected and processed by Apis mellifera from parts of
plants, buds and exudates. In Minas Gerais (MG) state, Brazil, green propolis is produced …

[HTML][HTML] Chromenone-based GSK-3β inhibitors as potential therapeutic targets for cardiovascular diseases: In silico study, molecular dynamics, and ADMET profiles

M Zhang, S Zhou, NH Obaid, US Altimari… - Arabian Journal of …, 2022 - Elsevier
Glycogen synthase kinase-3 beta (GSK-3β) regulates glycogen metabolism and many
different cellulars, including apoptosis, signaling, and neural. It is a crucial therapeutic …

Potentilla reptans L. preconditioning regulates H19 and MIAT long noncoding RNAs in H9C2 myoblasts Ischemia/Reperfusion model

H Mirzaei, A Salehi, B Javan, A Enayati… - … Medicine and Therapies, 2023 - Springer
The present study aimed to evaluate the effect of the ethyl acetate fraction of P. reptans root
(PEF) preconditioning on expressions of lncRNAs H19 and MIAT in H9C2 myoblasts I/R …

In silico design of hydrazone antioxidants and analysis of their free radical-scavenging mechanism by thermodynamic studies

IO Alisi, A Uzairu, SE Abechi - Beni-Suef University Journal of Basic and …, 2019 - Springer
Background Antioxidants are very crucial in maintaining the normal function of body cells, as
they scavenge excess free radical in the body. A set of hydrazone antioxidants was …

[HTML][HTML] Repurposing of monacolin K decorated BN nanoparticle on inhibition of HMG-CoA reductase: In silico approach

V Khori, M Zahedi, H Mirzaei, A Jabbari… - Chemical Physics …, 2023 - Elsevier
To identify a novel inhibitor of 3‑hydroxy-3-methyl-glutaryl-coenzyme A (HMG-CoA)
reductase, the current perspective has shifted toward a B 12 N 12 nanocage that also has …