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Drug Repurposing Strategy (DRS): Emerging Approach to Identify Potential Therapeutics for Treatment of Novel Coronavirus Infection

机译:毒品重新训练策略(DRS):新兴的方法,以确定新型冠状病毒感染治疗潜在治疗方法

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Drug repurposing is also known as drug repositioning or therapeutic switching. It is a process of identifying the new therapeutic agents from the existing FDA approved clinically used drugs. It is an effective strategy for developing drug candidates with new pharmacological or therapeutic properties. As the drug discovery is a costly, time-consuming, laborious, and highly risk process, the novel approach of drug repositioning is employed to increases the success rate of drug development. This strategy is more advantageous over traditional drug discovery process in terms of reducing duration of drug development, low-cost, highly efficient and minimum risk of failure. In addition to this, Coronavirus disease (COVID-19) was declared as global pandemic by World health organization on 11th February 2020. Currently, there is an urgent need to develop suitable therapeutic agents for the prevention of the outbreak of COVID-19. So, various investigations were carried out to design novel drug molecules by employing drug repurposing approach to identify anti-COVID-19 drugs, which can act as promising inhibitors against coronavirus proteins. It has been reported that Covid-19 can infect human respiratory system by entering into the alveoli of lung via respiratory tract. So, the infection occurs due to specific interaction or binding of spike protein with angiotensin converting enzyme-2 (ACE-2) receptor. Hence, drug repurposing strategy is utilized to identify suitable drugs by virtual screening of drug libraries. This approach helps to determine the binding interaction of drug candidates with target protein of coronavirus by using computational tools such as molecular similarity and homology modeling etc. Molecular docking and binding free energy calculations are also performed to predict the drug-receptor interactions and binding affinity. The methodologies involved in drug repurposing can be categorized into three groups such as drug-oriented, target-oriented and disease or therapy-oriented depending on the information available related to quality and quantity of the physico-chemical, biological, pharmacological and toxicological property of drug molecules. This review focus on drug repurposing strategy applied for existing drugs including Remdesivir, Ribavirin, Baraticinib, Tocilizumab, Chloroquine, Hydroxychloroquine, Prulifloxacin, Carfilzomib, Bictegravir, Nelfinavir,Tegobuvir and Glucocorticoids etc to determine their effectiveness towards COVID-19.
机译:药物重估也称为药物重新定位或治疗切换。它是鉴定现有FDA批准的临床使用的药物的新治疗剂的过程。它是用新的药理学或治疗性质开发药物候选者的有效策略。由于药物发现是一种昂贵,耗时,艰苦,高度的风险过程,采用新的药物重新定位方法来增加药物发展的成功率。在减少药物开发的持续时间,低成本,高效和最小失败风险方面,这种策略对传统药物发现过程更有利。除此之外,冠状病毒疾病(Covid-19)于2020年2月11日被世界卫生组织宣布为全球大流行。目前,迫切需要为预防Covid-19的爆发而致力于制定合适的治疗药物。因此,通过使用药物重新施用方法来鉴定抗Covid-19药物来设计各种调查,以设计抗Covid-19药物,这可以作为针对冠状病毒蛋白的有前途的抑制剂。据报道,Covid-19可以通过呼吸道进入肺的肺泡来感染人类呼吸系统。因此,由于穗蛋白与血管紧张素转化酶-2(ACE-2)受体的特异性相互作用或结合而发生感染。因此,使用药物重新扫描策略来通过虚拟筛选药物文库来鉴定合适的药物。这种方法有助于通过使用诸如分子相似性和同源性建模等的计算工具,确定药物候选者对冠状病毒的目标蛋白的结合相互作用。分子对接和结合自由能量计算以预测药物受体相互作用和结合亲和力。涉及药物重估的方法可以分为三组,例如药物导向,目标导向和疾病或治疗导向,这取决于与物理化学,生物,药理学和毒理学性质的质量和数量有关的信息药物分子。本综述侧重于申请现有药物的药物重新施用策略,包括雷达维尔,利巴韦林,Baraticinib,对照,氯喹,羟基氯喹,普拉芬兰,Carfilzomib,Bictegravir,Nelfinavir,Tegobuvir和糖皮质激素等,以确定它们对Covid-19的有效性。

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