In silico study of the structural disruption of 14α-demethylase induced by the binding of Terminalia chebula constituents

IF 0.6 Q4 INTEGRATIVE & COMPLEMENTARY MEDICINE

Current Traditional Medicine Pub Date : 2023-07-10 DOI:10.2174/2215083810666230710122114

N. Rani, Randhir Dahiya, Praveen Kumar, Nandini Verma

引用次数: 0

Abstract

Since ancient times, medicinal plants have been in use in medicine and daily life. To develop new antifungal compounds with low toxicity and high efficacy followed by high bioavailability, the constituents of Terminalia chebula were studied. The chemical constituents of the plant were evaluated for antifungal potential via Molergo Virtual Docker against the enzyme 14α-demethylase. The study depicted that tannins exhibited very good potential against the enzyme and could be used further for lead development. The study revealed that the plant possessed various constituents with potential antifungal properties and low toxicity.

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天竺葵成分结合诱导14α-去甲基化酶结构破坏的硅片研究

自古以来，药用植物就被用于医学和日常生活中。为开发低毒、高效、高生物利用度的抗真菌新药，对慈母的成分进行了研究。通过Molergo Virtual Docker对该植物的14α-去甲基酶进行抑菌活性评价。研究表明，单宁具有很好的抗酶潜力，可进一步用于铅的开发。研究表明，该植物含有多种具有潜在抗真菌活性和低毒性的成分。

本文章由计算机程序翻译，如有差异，请以英文原文为准。

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来源期刊

Current Traditional Medicine INTEGRATIVE & COMPLEMENTARY MEDICINE-

CiteScore

1.40

自引率

0.00%

发文量

期刊介绍： Current Traditional Medicine covers all the aspects of the modernization and standardization research on traditional medicine of the world, e.g. chemistry, pharmacology, molecular mechanism, systems biology, proteomics, genomics, metabolomics, safety, quality control, clinical studies of traditional Chinese, Ayurvedic, Unani, Arabic and other ethnomedicine. Each issue contains updated comprehensive in-depth/mini reviews along with high quality original experimental research articles. Current Traditional Medicine is a leading and important international peer-reviewed journal reflecting the current outstanding scientific research progresses of the global traditional, indigenous, folk and ethnologic medicine. It provides a bridge connected the tradition medicine system to the modern life science with the efforts of top scientists, as well as a resource to pursuit the solutions for the existing common issues in the traditional medicine.