In silico molecular docking studies and MM/GBSA analysis of coumarin-carbonodithioate hybrid derivatives divulge the anticancer potential against breast cancer

SV Pattar, SA Adhoni, CM Kamanavalli… - Beni-Suef University …, 2020 - Springer
Background There are many biomarkers associated with breast cancer. Higher expression
of PIK3CA (Phosphoinositide 3-kinase Cα), in its upregulated form, is associated with Hr+ …

Natural terpenoids as neuroinflammatory inhibitors in LPS-stimulated BV-2 microglia

Y Xu, H Wei, J Gao - Mini reviews in medicinal chemistry, 2021 - ingentaconnect.com
Neuroinflammation is a typical feature of many neurodegenerative diseases, including
Alzheimer's disease and Parkinson's disease. Microglia, the resident immune cells of the …

Exploring the novel heterocyclic derivatives as lead molecules for design and development of potent anticancer agents

I Azad, M Nasibullah, T Khan, F Hassan… - Journal of Molecular …, 2018 - Elsevier
This paper deals with in silico evaluation of newly proposed heterocyclic derivatives in
search of potential anticancer activity. Best possible drug candidates have been proposed …

[PDF][PDF] In silico pharmacokinetics and molecular docking studies of lead compounds derived from Diospyros mespiliformis

AH Ahmed, YI Alkali - PharmaTutor, 2019 - scholar.archive.org
Pharmacokinetics and toxicity profile along with efficacy are the major determinants for
successful drug development. This study was carried out to determine the pharmacokinetic …

Antibacterial and antioxidant activities of extracts and isolated compounds from the roots extract of Cucumis prophetarum and in silico study on DNA gyrase and …

W Galma, M Endale, E Getaneh, R Eswaramoorthy… - BMC chemistry, 2021 - Springer
Background Cucumis prophetarum is traditionally used to treat liver and lung disorders,
heart failure, diarrhea, gonorrhea, skin infections, intestinal problems and cancer. In the …

Isopropyl caffeate: a caffeic acid derivative—antioxidant potential and toxicity

AB Lira, CA Montenegro, KM de Oliveira… - Oxidative Medicine …, 2018 - Wiley Online Library
Phenolic compounds, among them isopropyl caffeate, possess antioxidant potential, but not
without toxicity and/or adverse effects. The present study aimed to evaluate the antioxidant …

[PDF][PDF] Antihypertensive effect of rutin: Pharmacological and computational approach

RM GANGA, PP GOUD, SR NVL - Asian Journal of Pharmaceutical …, 2019 - academia.edu
Objective: Phenolic compounds, such as flavonoids, have aroused great scientific interest
due to their diverse pharmacological activities. Several studies suggested that flavonoids act …

Identification of potent inhibitors against transmembrane serine protease 2 for developing therapeutics against SARS-CoV-2

AA Mamun, F Akter, M Khan, SS Ahmed… - Journal of …, 2022 - Taylor & Francis
In viral binding and entry, the Spike (S) protein of SARS-CoV-2 uses transmembrane serine
protease 2 (TMPRSS2) for priming to cleavage themselves. In this study, we have screened …

[PDF][PDF] Inhibition of α-amylase and α-glucosidase by (6rs)-22-hydroxy-23, 24, 25, 26, 27-pentanor-vitamin-d3-6, 19-sulfurdioxide-adduct, manoalide and 5β-cholestane …

VV Sonkamble, NS Wagh, LH Kamble - Int J Pharm Pharm Sci, 2018 - researchgate.net
Objective: This investigation includes characterization of phytochemicals from acetone
extract of Helianthus annuus L. seeds responsible for αamylase and α-glucosidase …

[PDF][PDF] Discovery of two diacetylene glycosides as human uridine-cytidine kinase 2 inhibitors: an in silico approach

MA Mohamed, AI Dirar, S Hamdoun - Journal of Applied …, 2016 - japsonline.com
Natural products continue today, in a never-ending quest, to provide new lead compounds.
Yet, the path to a marketed drug involves a long and exhaustive journey through basic …