Kanneganti Jithisree, Mina Usha, Singh Ankita, Gautam Anuradha, Somvanshi Pallavi
School of Environmental Sciences, Jawaharlal Nehru University, New Delhi, India.
School of Environmental Sciences, Jawaharlal Nehru University, New Delhi, India.
J Ayurveda Integr Med. 2023 Mar-Apr;14(2):100712. doi: 10.1016/j.jaim.2023.100712. Epub 2023 Apr 28.
The utilization of medicinal plants for their therapeutic properties has long been a key component of Indian culture. Unique medicinal characteristics can be found in the phytochemicals that are extracted from these plants. Globally, tuberculosis (TB) burden and management are challenged due to the emergence of new resistant strains of Mycobacterium tuberculosis (Mtb). This highlights the importance of new drug molecules from diverse sources as well as their innovative management options. In this context, the present study formulated an Anti Mtb medicinal plant database (AMMPDB Ver. 1.1), a manually curated database of native Indian medicinal plants that reported anti-tubercular (anti-TB) activities and their potential therapeutic phytochemicals. This is the first-ever freely accessible digital repository. The current version of the database provides users, with information regarding 118 native Indian anti-tubercular medicinal plants and their 3374 phytochemicals. The database provides the following information: Taxonomical ID, botanical description, vernacular names, conservation status, geographical distribution maps, IC-50 value, phytochemical details which include - name, Compound ID, Synonyms, location in plant part, 2D, 3D structures (as per the availability), and their medicinal uses reported in the literature. The tools section of the database is equipped with sequentially catalogued and hyperlinked open-access tools utilized for computational drug designing. A case study has been incorporated under the contributors section to validate the tools section and the phytochemicals of the database. AMMPDB Ver 1.1 will be serviceable to research in computational drug designing and discovery with effectiveness and ease. Database URL: https://www.ammpdb.com/.
利用药用植物的治疗特性长期以来一直是印度文化的一个关键组成部分。从这些植物中提取的植物化学物质具有独特的药用特性。在全球范围内,由于结核分枝杆菌(Mtb)新耐药菌株的出现,结核病(TB)负担和管理面临挑战。这凸显了来自不同来源的新药分子及其创新管理方案的重要性。在此背景下,本研究构建了一个抗结核药用植物数据库(AMMPDB版本1.1),这是一个人工整理的关于印度本土药用植物的数据库,这些植物具有抗结核活性及其潜在的治疗性植物化学物质。这是有史以来第一个可免费访问的数字资源库。该数据库的当前版本为用户提供了有关118种印度本土抗结核药用植物及其3374种植物化学物质的信息。该数据库提供以下信息:分类学ID、植物描述、 vernacular名称、保护状况、地理分布图、IC-50值、植物化学细节,包括名称、化合物ID、同义词、在植物部分中的位置、二维、三维结构(视可用性而定),以及文献中报道的它们的药用用途。数据库的工具部分配备了用于计算药物设计的按顺序编目和超链接的开放获取工具。在贡献者部分纳入了一个案例研究,以验证数据库的工具部分和植物化学物质。AMMPDB版本1.1将有效且轻松地服务于计算药物设计和发现的研究。数据库网址:https://www.ammpdb.com/ 。