紫花苜蓿生物活性对急性肺损伤/急性呼吸窘迫综合征分子靶点的计算机研究

Y. Tripathi
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摘要

这项当代工作的目的是展示从合欢(Bronco T)中获得的天然植物成分,作为对抗急性肺损伤/急性呼吸窘迫综合征(ARDS)的治疗选择。由被称为细胞因子风暴的严重炎症过程引起的非心源性水肿和随后的气体交换障碍的早期发作是急性呼吸窘迫综合征(ARDS)。现有的策略包括机械通气和糖皮质激素。然而,它们带来了一些问题,如膈肌萎缩和急性呼吸窘迫综合征(ARDS)患者肺部宿主免疫反应下调,核调节因子NF-κB和TLR-4被激活,这可能有助于免疫调节细胞因子和其他促炎介质(包括IL-6和TNF-α)的表达增加。天然产品发挥着关键作用,因为它的毒性很小,在某些情况下没有毒性。合欢是一种民间语言,以其抗炎特性而闻名。用合欢生物活性物质靶向上述受体将下调ARDS中的信号通路及其相关介质。通过分子对接、ADMET和Lipinski分析等计算机研究,我们试图缩小合欢抗ARDS的活性植物成分。
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Bio Actives from Albizia Lebbeck on Acute Lung Injury/ Acute Respiratory Distress Syndrome Molecular Targets: In-Silico Study
This contemporary work is prepared with the aim of presenting natural phytoconstituents obtained from Albizia lebbeck (Bronco T) as a remedial option against Acute Lung Injury / Acute Respiratory Distress Syndrome (ARDS). The early onset of non-cardiogenic edema and subsequent gas-exchange impairment caused by a severe inflammatory process known as cytokine storm is acute respiratory distress syndrome (ARDS). The existing strategy includes mechanical ventilation and glucocorticosteroid. However, they pose problems like diaphragm atrophy and down regulated immune response of the host in the lungs of patients with acute respiratory distress syndrome (ARDS), the nuclear regulatory factor NF-kappaB and TLR-4 is activated, which may contribute to increased expression of immune regulatory cytokines and other pro inflammatory mediators including IL-6 and TNF-alpha. Natural products play a pivotal role as it offers minimal and in some cases no toxicity. Albizia lebbeck is the folk language and is known for its anti-inflammatory properties. Targeting the above-mentioned receptors with bioactives from Albizia lebbeck would down regulate the signaling pathway and its associated mediators in ARDS. Through in- silico study including molecular docking, ADMET and Lipinski analysis, we are trying to narrow down the active phytoconstituent from Albizia lebbeck against ARDS.
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