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解析 Linn. 化合物对系统性红斑狼疮和炎症性肠病的多靶点治疗能力:一种网络药理学和分子建模方法。

Deciphering the multi-target therapeutic capabilities of Linn. Compounds against systemic lupus erythematosus and inflammatory bowel disease: a network pharmacology and molecular modelling approach.

作者信息

Kumar Satish, Sarkar Biswatrish

机构信息

Group Polyphenol-BIT, Department of Pharmaceutical Sciences and Technology, Birla Institute of Technology, Ranchi, India.

出版信息

Nat Prod Res. 2024 Aug 6:1-5. doi: 10.1080/14786419.2024.2388792.

Abstract

The coexistence of Systemic Lupus Erythematosus (SLE) and Inflammatory Bowel Disease (IBD) is a rare and hard-to-diagnose multisystem autoimmune disorder. Allopathic treatment approaches often fall short in managing both conditions simultaneously, as specific medications targeting this dual manifestation are lacking. In such instances, herbal medicine can offer a potential solution through its holistic approach. () a rich source of bioactive compounds belonging to family. This study employs network pharmacology and molecular modelling to unveil the multi-target and multi-pathway mechanisms of as a complementary therapy. A total of 423 common targets were obtained, among which AKT1, TNF, SRC, EGFR, HIF1A, HSP9AA, BCL2, and STAT3 were identified as the key targets. Lastly, molecular modelling validated the strong binding affinity between 's compounds and the identified targets. In conclusion, these investigations provide new insight for further study of towards the management of SLE and IBD.

摘要

系统性红斑狼疮(SLE)和炎症性肠病(IBD)并存是一种罕见且难以诊断的多系统自身免疫性疾病。对抗疗法的治疗方法往往难以同时控制这两种病症,因为缺乏针对这种双重表现的特定药物。在这种情况下,草药医学可以通过其整体方法提供一种潜在的解决方案。()是属于家族的生物活性化合物的丰富来源。本研究采用网络药理学和分子建模来揭示作为辅助疗法的多靶点和多途径机制。共获得423个共同靶点,其中AKT1、TNF、SRC、EGFR、HIF1A、HSP9AA、BCL2和STAT3被确定为关键靶点。最后,分子建模验证了的化合物与所确定靶点之间的强结合亲和力。总之,这些研究为进一步研究在SLE和IBD管理方面提供了新的见解。

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