Protective effect of fermented vegetable compounds against nonalcoholic fatty liver disease using metabolite profiling, integrated network pharmacology, and molecular docking approach

Vegetable fermentation extract (VFE) shows potential as a preventive agent to inhibit nonalcoholic fatty liver disease (NAFLD). This study identified bioactive compounds of VFE and explored the mechanism of VFE against NAFLD. Metabolite profiling was analysed using Liquid chromatography-tandem mass...

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Main Authors: Ermin Rachmawati, Larasati Sekar Kinasih, Nabila Rahmadani, Tias Pramesti Griana, Roihatul Muti’ah, Suharti Suharti, Dwiki Pramudika Abdul Azis, Endah Eni
Format: Article
Language:English
Published: Wolters Kluwer Medknow Publications 2025-04-01
Series:Journal of Advanced Pharmaceutical Technology & Research
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Online Access:https://journals.lww.com/10.4103/JAPTR.JAPTR_331_24
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author Ermin Rachmawati
Larasati Sekar Kinasih
Nabila Rahmadani
Tias Pramesti Griana
Roihatul Muti’ah
Suharti Suharti
Dwiki Pramudika Abdul Azis
Endah Eni
author_facet Ermin Rachmawati
Larasati Sekar Kinasih
Nabila Rahmadani
Tias Pramesti Griana
Roihatul Muti’ah
Suharti Suharti
Dwiki Pramudika Abdul Azis
Endah Eni
author_sort Ermin Rachmawati
collection DOAJ
description Vegetable fermentation extract (VFE) shows potential as a preventive agent to inhibit nonalcoholic fatty liver disease (NAFLD). This study identified bioactive compounds of VFE and explored the mechanism of VFE against NAFLD. Metabolite profiling was analysed using Liquid chromatography-tandem mass spectrometry (LC-MS/MS). The bioactive compounds were screened using the Lipinski Rule of 5, toxicity, and biological activity prediction, followed by network pharmacology and molecular docking. Of the 24 bioactive compounds identified, 8 compounds passed the screening process. Twenty-four genes from network pharmacology were involved in the NAFLD mechanism, including those related to insulin signaling, inflammation, and lipid metabolism. Kaempferol, apigenin, and N-(p-coumaroyl) serotonin showed a good binding affinity with CCR2, AKT, IL-6, and PPAR-γ compared to simvastatin and metformin. Bioactive compounds from VFE were predicted to ameliorate NAFLD.
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issn 2231-4040
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publishDate 2025-04-01
publisher Wolters Kluwer Medknow Publications
record_format Article
series Journal of Advanced Pharmaceutical Technology & Research
spelling doaj-art-4b248753139a4d14b3600a73d697854c2025-08-20T02:03:04ZengWolters Kluwer Medknow PublicationsJournal of Advanced Pharmaceutical Technology & Research2231-40400976-20942025-04-01162929810.4103/JAPTR.JAPTR_331_24Protective effect of fermented vegetable compounds against nonalcoholic fatty liver disease using metabolite profiling, integrated network pharmacology, and molecular docking approachErmin RachmawatiLarasati Sekar KinasihNabila RahmadaniTias Pramesti GrianaRoihatul Muti’ahSuharti SuhartiDwiki Pramudika Abdul AzisEndah EniVegetable fermentation extract (VFE) shows potential as a preventive agent to inhibit nonalcoholic fatty liver disease (NAFLD). This study identified bioactive compounds of VFE and explored the mechanism of VFE against NAFLD. Metabolite profiling was analysed using Liquid chromatography-tandem mass spectrometry (LC-MS/MS). The bioactive compounds were screened using the Lipinski Rule of 5, toxicity, and biological activity prediction, followed by network pharmacology and molecular docking. Of the 24 bioactive compounds identified, 8 compounds passed the screening process. Twenty-four genes from network pharmacology were involved in the NAFLD mechanism, including those related to insulin signaling, inflammation, and lipid metabolism. Kaempferol, apigenin, and N-(p-coumaroyl) serotonin showed a good binding affinity with CCR2, AKT, IL-6, and PPAR-γ compared to simvastatin and metformin. Bioactive compounds from VFE were predicted to ameliorate NAFLD.https://journals.lww.com/10.4103/JAPTR.JAPTR_331_24metabolite profilingmolecular dockingnetwork pharmacologynonalcoholic fatty liver diseasevegetable fermentation
spellingShingle Ermin Rachmawati
Larasati Sekar Kinasih
Nabila Rahmadani
Tias Pramesti Griana
Roihatul Muti’ah
Suharti Suharti
Dwiki Pramudika Abdul Azis
Endah Eni
Protective effect of fermented vegetable compounds against nonalcoholic fatty liver disease using metabolite profiling, integrated network pharmacology, and molecular docking approach
Journal of Advanced Pharmaceutical Technology & Research
metabolite profiling
molecular docking
network pharmacology
nonalcoholic fatty liver disease
vegetable fermentation
title Protective effect of fermented vegetable compounds against nonalcoholic fatty liver disease using metabolite profiling, integrated network pharmacology, and molecular docking approach
title_full Protective effect of fermented vegetable compounds against nonalcoholic fatty liver disease using metabolite profiling, integrated network pharmacology, and molecular docking approach
title_fullStr Protective effect of fermented vegetable compounds against nonalcoholic fatty liver disease using metabolite profiling, integrated network pharmacology, and molecular docking approach
title_full_unstemmed Protective effect of fermented vegetable compounds against nonalcoholic fatty liver disease using metabolite profiling, integrated network pharmacology, and molecular docking approach
title_short Protective effect of fermented vegetable compounds against nonalcoholic fatty liver disease using metabolite profiling, integrated network pharmacology, and molecular docking approach
title_sort protective effect of fermented vegetable compounds against nonalcoholic fatty liver disease using metabolite profiling integrated network pharmacology and molecular docking approach
topic metabolite profiling
molecular docking
network pharmacology
nonalcoholic fatty liver disease
vegetable fermentation
url https://journals.lww.com/10.4103/JAPTR.JAPTR_331_24
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