Phyllanthus emblica: a comprehensive review of its phytochemical composition and pharmacological properties

AT Prananda, A Dalimunthe, U Harahap… - Frontiers in …, 2023 - frontiersin.org
Phyllanthus emblica Linn, a prominent member of the euphorbiaceae family, exhibits
extensive distribution across a multitude of tropical and subtropical nations. Referred to as …

[HTML][HTML] Neuroprotective potential of flavonoids in brain disorders

S Hasan, N Khatri, ZN Rahman, AA Menezes, J Martini… - Brain Sciences, 2023 - mdpi.com
Flavonoids are a large subgroup of polyphenols known to be sourced from over 6000
natural products, including fruits, vegetables, bark, and herbs. Due to their antioxidant …

Computational pharmacology and computational chemistry of 4-hydroxyisoleucine: Physicochemical, pharmacokinetic, and DFT-based approaches

I Ahmad, AE Kuznetsov, AS Pirzada, KF Alsharif… - Frontiers in …, 2023 - frontiersin.org
Computational pharmacology and chemistry of drug-like properties along with
pharmacokinetic studies have made it more amenable to decide or predict a potential drug …

Novel zinc (II) and copper (II) complexes of 2-((2-hydroxyethyl) amino) quinoline-3-carbaldehyde for antibacterial and antioxidant activities: A combined experimental …

T Damena, MB Alem, D Zeleke, T Desalegn… - ACS …, 2022 - ACS Publications
In the present work, two novel complexes of zinc (II) and copper (II) were synthesized from
the ligand 2-((2-hydroxyethyl) amino) quinoline-3-carbaldehyde (H 2 L) in a 1: 2 metal-to …

Physicochemical properties, drug likeness, ADMET, DFT studies, and in vitro antioxidant activity of oxindole derivatives

I Ahmad, H Khan, G Serdaroğlu - Computational Biology and Chemistry, 2023 - Elsevier
Poor pharmacokinetic and safety profiles create significant hurdles in the drug development
process. This work focuses on a detailed understanding of drug discovery interplay among …

[HTML][HTML] Insights into the pharmacological effects of flavonoids: the systematic review of computer modeling

A Taldaev, R Terekhov, I Nikitin, A Zhevlakova… - International Journal of …, 2022 - mdpi.com
Computer modeling is a method that is widely used in scientific investigations to predict the
biological activity, toxicity, pharmacokinetics, and synthesis strategy of compounds based on …

[HTML][HTML] Spectroscopic (FT-IR, FT-Raman, NMR and UV–visible), ADMET and molecular docking investigation of aztreonam as anti-tuberculosis agent

N Mani, S Suresh, M Govindammal, S Kannan… - Chemical Physics …, 2023 - Elsevier
Abstract The FT-IR and FT-Raman spectra was recorded within the range of 4000-500 cm−
1 and compared with the theoretically obtained spectra. The 13 C and 1 H NMR chemical …

In vitro and in silico perspectives on the activation of antioxidant responsive element by citrus-derived flavonoids

T Guan, C Bian, Z Ma - Frontiers in Nutrition, 2023 - frontiersin.org
Introduction Oxidative stress plays an essential role in the pathogenesis of chronic diseases.
Disrupting the Keap1-Nrf2 pathway by binding Keap1 is identified as a potential strategy to …

Synthesis, biological evaluation, and in silico studies of new CDK2 inhibitors based on pyrazolo[3,4-d]pyrimidine and pyrazolo[4,3-e][1,2,4]triazolo[1,5-c]pyrimidine …

AA Mandour, IF Nassar, MT Abdel Aal… - Journal of enzyme …, 2022 - Taylor & Francis
Cyclin-dependent kinase inhibition is considered a promising target for cancer treatment for
its crucial role in cell cycle regulation. Pyrazolo pyrimidine derivatives were well established …

Synthesis, in-vitro inhibition of cyclooxygenases and in silico studies of new isoxazole derivatives

W Alam, H Khan, M Saeed Jan, U Rashid… - Frontiers in …, 2023 - frontiersin.org
Isoxazole belongs to the class of five-membered heterocyclic compounds. The process of
develo** new drugs has significantly gained attention due to inadequate pharmacokinetic …