Identification of novel inhibitors for TNFα, TNFR1 and TNFα-TNFR1 complex using pharmacophore-based approaches
MS Saddala, H Huang - Journal of translational medicine, 2019 - Springer
Background Tumor necrosis factor α (TNFα) is a multifunctional cytokine with a potent pro-
inflammatory effect. It is a validated therapeutic target molecule for several disorders related …
inflammatory effect. It is a validated therapeutic target molecule for several disorders related …
[HTML][HTML] Molecular docking evaluation of celecoxib on the boron nitride nanostructures for alleviation of cardiovascular risk and inflammatory
Y Cao, M Noori, M Nazari, ANK Lup, A Soltani… - Arabian Journal of …, 2022 - Elsevier
Celecoxib (CXB) is a nonsteroidal anti-inflammatory drug (NSAID) that can be used to treat
rheumatoid arthritis and ischemic heart disease. In this research, density functional theory …
rheumatoid arthritis and ischemic heart disease. In this research, density functional theory …
TNF-α Inhibitors from natural compounds: An overview, CADD approaches, and their exploration for anti-inflammatory agents
IJ dos Santos Nascimento… - … Chemistry & High …, 2022 - ingentaconnect.com
Inflammation is a natural process that occurs in the organism in response to harmful external
agents. Despite being considered beneficial, exaggerated cases can cause severe …
agents. Despite being considered beneficial, exaggerated cases can cause severe …
Datura stramonium Flowers as a Potential Natural Resource of Bioactive Molecules: Identification of Anti-Inflammatory Agents and Molecular Docking Analysis
B Damergi, R Essid, N Fares, N Khadraoui, L Ageitos… - Molecules, 2023 - mdpi.com
The present study investigated the antioxidant, antibacterial, antiviral and anti-inflammatory
activities of different aerial parts (flowers, leaves and seeds) of Datura stramonium. The plant …
activities of different aerial parts (flowers, leaves and seeds) of Datura stramonium. The plant …
Identification of two key UDP-glycosyltransferases responsible for the ocotillol-type ginsenoside majonside-R2 biosynthesis in Panax vietnamensis var. fuscidiscus
S Peng, X Li, W Jiang, Y Wang, G Xiang, M Li, Y Wang… - Planta, 2023 - Springer
Main conclusion Two UDP-glycosyltransferases from Panax vienamensis var. fuscidiscus
involved in ocotillol-type ginsenoside MR2 (majonside-R2) biosynthesis were identified …
involved in ocotillol-type ginsenoside MR2 (majonside-R2) biosynthesis were identified …
Ethnopharmacology, genetic diversity, phytochemistry and pharmacological effects of Panax vietnamensis Ha et Grushv.: A review
TH Ngau, CPK Dieu, CPK Hue… - Journal of …, 2025 - dl.begellhouse.com
Ginseng is considered as a beneficial herbal remedy and over recent years its efficacy and
safety have been verified in clinical therapy. There are two typical species of ginseng …
safety have been verified in clinical therapy. There are two typical species of ginseng …
Dual function antioxidant and anti-inflammatory fish maw peptides: Isolation and structure-activity analysis via tandem molecular docking and quantum chemical …
E Mubango, Z Fu, P Dou, Y Tan, Y Luo, L Chen, K Wu… - Food Chemistry, 2025 - Elsevier
The structure–function relationship of gastrointestinal tract digestion-derived fish maw
peptides remains largely unknown. This study aims to elucidate the active sites and cellular …
peptides remains largely unknown. This study aims to elucidate the active sites and cellular …
Elucidation of the binding mechanism of astragaloside IV derivative with human serum albumin and its cardiotoxicity in zebrafish embryos
YJ Wu, ZH Li, JY Li, Y Zhou, RY Wang… - Frontiers in …, 2022 - frontiersin.org
LS-102 is a new derivative of astragaloside IV (AGS IV) that has been shown to possess
potentially significant cardioprotective effects. However, there are no reports concerning its …
potentially significant cardioprotective effects. However, there are no reports concerning its …
Majonoside-R2 extracted from Vietnamese ginseng protects H9C2 cells against hypoxia/reoxygenation injury via modulating mitochondrial function and biogenesis
Vietnamese ginseng has a therapeutic effect on various diseases; however its bioactivity
against cardiac hypoxia/reoxygenation (HR) injury remains unclear. In this study, we …
against cardiac hypoxia/reoxygenation (HR) injury remains unclear. In this study, we …
Charge Density Study, DFT Calculations, Hirshfield Surface Analysis and Molecular Docking of (Z)-3-N-(Ethyl)-2-N '-(3-methoxyphenyl imino) thiazolidine-4-one
In this work, the electron density distribution of (Z)-3-N-(ethyl)-2-N'-(3-methoxyphenyl imino)
thiazolidine-4-one is determined by single-crystal X-ray refinements using a spherical …
thiazolidine-4-one is determined by single-crystal X-ray refinements using a spherical …