Exploring the mechanisms of Cornus officinalis in the treatment of non-alcoholic steatohepatitis using network pharmacology, molecular docking and molecular dynamics simulations DOI Creative Commons

Jiashi Guo,

Jingyuan Wan, Ting Wang

et al.

Deleted Journal, Journal Year: 2024, Volume and Issue: 6(10)

Published: Oct. 9, 2024

Abstract Non-alcoholic steatohepatitis (NASH) is a predominant metabolic liver disease, typically characterized by hepatic steatosis, oxidative stress, and inflammation. The traditional Chinese medicine Cornus officinalis possesses anti-inflammatory hepatoprotective pharmacological properties has shown ameliorative effects on NASH. however, its mechanism of action remains unclear. This study aims to elucidate the mechanisms which C. ameliorates active components were analyzed using Traditional Medicine Systems Pharmacology Database (TCMSP), corresponding targets predicted. Subsequently, DisGeNET, GeneCards, GEO databases employed identify NASH-related targets. Venn diagrams used intersect with NASH Protein–protein interaction (PPI) networks constructed STRING database, PPI network analysis was performed Cytoscape. Gene Ontology (GO) Kyoto Encyclopedia Genes Genomes (KEGG) pathway enrichment analyses conducted for Annotation, Visualization, Integrated Discovery (DAVID) , followed molecular docking validation. found contain 20 major ingredients 672 potential targets, 61 overlapped network, GO, KEGG identified four highest correlation, results indicated that exhibited strong binding affinities treatment multiple underscoring advantage in treating

Language: Английский

Exploring the mechanisms of Cornus officinalis in the treatment of non-alcoholic steatohepatitis using network pharmacology, molecular docking and molecular dynamics simulations DOI Creative Commons

Jiashi Guo,

Jingyuan Wan, Ting Wang

et al.

Deleted Journal, Journal Year: 2024, Volume and Issue: 6(10)

Published: Oct. 9, 2024

Abstract Non-alcoholic steatohepatitis (NASH) is a predominant metabolic liver disease, typically characterized by hepatic steatosis, oxidative stress, and inflammation. The traditional Chinese medicine Cornus officinalis possesses anti-inflammatory hepatoprotective pharmacological properties has shown ameliorative effects on NASH. however, its mechanism of action remains unclear. This study aims to elucidate the mechanisms which C. ameliorates active components were analyzed using Traditional Medicine Systems Pharmacology Database (TCMSP), corresponding targets predicted. Subsequently, DisGeNET, GeneCards, GEO databases employed identify NASH-related targets. Venn diagrams used intersect with NASH Protein–protein interaction (PPI) networks constructed STRING database, PPI network analysis was performed Cytoscape. Gene Ontology (GO) Kyoto Encyclopedia Genes Genomes (KEGG) pathway enrichment analyses conducted for Annotation, Visualization, Integrated Discovery (DAVID) , followed molecular docking validation. found contain 20 major ingredients 672 potential targets, 61 overlapped network, GO, KEGG identified four highest correlation, results indicated that exhibited strong binding affinities treatment multiple underscoring advantage in treating

Language: Английский

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