Exploration of some medicinal plants for peptic ulcer disease: In-silico approach for wound management

Peptic ulcers are a common digestive disorder affecting millions of people worldwide and exhibiting high recurrence rates. Conventional treatments for peptic ulcers can have adverse effects and may not be suitable for everyone. Herbal remedies act as complementary therapy that focus on the use of active constituents of medicinal plants such as flavonoids, alkaloids, and essential oils in the treatment of peptic ulcers. These are rich in active metabolites in the barks, roots, leaves, fruits, and seeds, and have been utilized for medicinal purposes since ancient times. The use of herbal therapy is crucial, and regulations are necessary to ensure the quality of products, particularly in randomized studies, to assess their efficacy and safety in treating ulcer disorders. Through in-silico study we explored how these compounds interact with the active sites of histamine2, β-adrenergic coupled and cytokine receptors (IL-6, IL-17, IL-23). The docked scores ranging from -3.743Kcal/mol to -11.105 kcal/mol, prudent strong binding affinity. Computation of the drug-likeness, ADMET and pharmacokinetic properties of these compounds reveals potential as candidates for prototype for peptic ulcer. This study aims to explore the anti-ulcer activity of medicinal plants in treating peptic ulcer disease.

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Publication Details

Journal
In Silico Research in Biomedicine
Published
2025-01-01
DOI
https://doi.org/10.1016/j.insi.2025.100027
Primary Topic
Pharmacological Effects of Natural Compounds
Type
article
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article

Exploration of some medicinal plants for peptic ulcer disease: In-silico approach for wound management

Manju Rawat Singh, Deependra Singh, Divya Sahu, Lokendra Singh Rathor
In Silico Research in Biomedicine
Pharmacological Effects of Natural Compounds
article

Exploration of some medicinal plants for peptic ulcer disease: In-silico approach for wound management

Manju Rawat Singh, Deependra Singh, Divya Sahu, Lokendra Singh Rathor
article en

Abstract

Peptic ulcers are a common digestive disorder affecting millions of people worldwide and exhibiting high recurrence rates. Conventional treatments for peptic ulcers can have adverse effects and may not be suitable for everyone. Herbal remedies act as complementary therapy that focus on the use of active constituents of medicinal plants such as flavonoids, alkaloids, and essential oils in the treatment of peptic ulcers. These are rich in active metabolites in the barks, roots, leaves, fruits, and seeds, and have been utilized for medicinal purposes since ancient times. The use of herbal therapy is crucial, and regulations are necessary to ensure the quality of products, particularly in randomized studies, to assess their efficacy and safety in treating ulcer disorders. Through in-silico study we explored how these compounds interact with the active sites of histamine2, β-adrenergic coupled and cytokine receptors (IL-6, IL-17, IL-23). The docked scores ranging from -3.743Kcal/mol to -11.105 kcal/mol, prudent strong binding affinity. Computation of the drug-likeness, ADMET and pharmacokinetic properties of these compounds reveals potential as candidates for prototype for peptic ulcer. This study aims to explore the anti-ulcer activity of medicinal plants in treating peptic ulcer disease.

In Silico Research in BiomedicineVol. 1
Pandit Ravishankar Shukla University (IN)
Zero hunger
Openalex Percentile: Top 80%
Pharmacological Effects of Natural Compounds
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