In silico identification of potential inhibitors from Cinnamon against main protease and spike glycoprotein of SARS CoV-2

D Prasanth, M Murahari, V Chandramohan… - Journal of …, 2021 - Taylor & Francis
Cinnamon has been utilized to remedy a lot of afflictions of humans. Literary works illustrate
that it possesses numerous biological activities. Our research study is intended to recognize …

Disease-modifying treatment of Parkinson's disease by phytochemicals: Targeting multiple pathogenic factors

M Naoi, W Maruyama, M Shamoto-Nagai - Journal of Neural Transmission, 2022 - Springer
Parkinson's disease is characterized by typical motor symptoms, loss of dopamine neurons
in the substantia nigra, and accumulation of Lewy body composed of mutated α-synuclein …

[HTML][HTML] Some nanocarrier's properties and chemical interaction mechanisms with flavones

C Espíndola - Molecules, 2023 - mdpi.com
Flavones such as 7, 8-dihydroxyflavone (tropoflavin), 5, 6, 7-trihydroxyflavone (baicalein),
3′, 4′, 5, 6-tetrahydroxyflavone (luteolin), 3, 3′, 4′, 5, 5′, 7-hexahydroxyflavone …

Computational insights into tetracyclines as inhibitors against SARS-CoV-2 Mpro via combinatorial molecular simulation calculations

S Bharadwaj, KE Lee, VD Dwivedi, SG Kang - Life Sciences, 2020 - Elsevier
The COVID-19 pandemic raised by SARS-CoV-2 is a public health emergency. However,
lack of antiviral drugs and vaccine against human coronaviruses demands a concerted …

Anti-dengue infectivity evaluation of bioflavonoid from Azadirachta indica by dengue virus serine protease inhibition

VD Dwivedi, S Bharadwaj, S Afroz, N Khan… - Journal of …, 2021 - Taylor & Francis
Dengue virus (DENV) serine protease enzyme, ie NS2B-NS3pro (non-structural protein 2B-
non-structural protein 3) has been approved as prime drug target for the drug discovery …

[HTML][HTML] Therapeutic effects of Crataegus monogyna inhibitors against breast cancer

GM Basavarajappa, A Rehman… - Frontiers in …, 2023 - frontiersin.org
Breast cancer is a silent killer disorder among women and a serious economic burden in
healthcare management. Every 19 s, a woman is diagnosed with breast cancer, and every …

Identification of potential biogenic chalcones against antibiotic resistant efflux pump (AcrB) via computational study

S Rathod, S Dey, S Pawar, R Dhavale… - Journal of …, 2023 - Taylor & Francis
The cases of bacterial multidrug resistance are increasing every year and becoming a
serious concern for human health. Multidrug efflux pumps are key players in the formation of …

Structural modelling and in silico pharmacology of β-carboline alkaloids as potent 5-HT1A receptor antagonists and reuptake inhibitors

YO Ayipo, WA Alananzeh, I Ahmad… - Journal of …, 2023 - Taylor & Francis
Abstract Serotonin (5-HT) antagonists and reuptake inhibitors (SARIs) are atypical
antidepressants for managing major depressive disorder. They are oftentimes applied as …

Screening of natural compounds from Cyperus rotundus Linn against SARS-CoV-2 main protease (Mpro): An integrated computational approach

SB Kumar, S Krishna, S Pradeep, DE Mathews… - Computers in biology …, 2021 - Elsevier
Abstract Coronavirus disease 2019 (COVID-19) is a viral respiratory disease that has been
spreading across the globe. The World Health Organization (WHO) declared it as a public …

[HTML][HTML] Structure-Based Identification of Natural Products as SARS-CoV-2 Mpro Antagonist from Echinacea angustifolia Using Computational Approaches

S Bharadwaj, SA El-Kafrawy, TA Alandijany, LH Bajrai… - Viruses, 2021 - mdpi.com
Coronavirus disease-19 (COVID-19) pandemic, caused by the novel SARS-CoV-2 virus,
continues to be a global threat. The number of cases and deaths will remain escalating due …