摘要
恶性疟原虫是引起疟疾的那些原生动物寄生虫物种中最致命的一种。无节制地使用抗疟疾药物导致了进化选择的压力,从而有利于高水平的抗疟药的耐药性;目前,恶性疟原虫对所有种类的抗疟药均显示耐药性。因此,找出新颖的药物靶标及设计出能够战胜耐药性的选择性抗疟药物是势在必行的。虽然许多药物靶标在许多公共领域资源上是随手可以得到的,但是一种简单的具有易于搜索和可检索信息特征的综合性的数据源是当前所缺乏的。为了促进来自于不同药物联盟的新兴数据的整合和挖掘,也为了把基于结构设计的药物靶点区分优先次序,一个开放的,包含恶性疟原虫的综合数据库被建立了。这个数据库里面包含了药物靶标的已知的模型结构连同结合部位参数一起的元数据。此外,显示出积极的抑制恶性疟原虫活性的化合物或者已知的药物靶标也被提供了。这个数据库可以通过http://pfaldb.jnu.ac. in.进入。这个数据库提供了关于结构、序列、特殊阶段的基因表达、路径、作用机制,每一个药物靶标的重要性和成药性及评价个体药物靶标的验证状态的相关文献的不同信息。它还包括个体抗疟药物活性和生物测定的相关信息。
关键词: 抗疟,数据库,药物靶标,抑制剂,选择性
Current Drug Targets
Title:PfalDB: An Integrated Drug Target and Chemical Database for Plasmodium flaciparum
Volume: 15 Issue: 12
Author(s): Amit Kumar, Nidhi Agarwal, Lalit Pant, Jay Prakash Singh, Indira Ghosh and Naidu Subbarao
Affiliation:
关键词: 抗疟,数据库,药物靶标,抑制剂,选择性
摘要: Plasmodium falciparum is one of the deadliest protozoan parasite species among those that cause malaria. Uncontrolled use of antimalarial drugs has resulted in evolutionary selection pressure favoring high levels of resistance to antimalarials; currently P.falciparum shows resistance to all classes of antimalarials. Therefore it is essential to identify novel drug targets, and design selective anti-malarials which can overcome resistance. While many drug targets are freely available in various public domain resources, a single comprehensive source of data containing easily searchable and retrievable information is currently lacking. To facilitate the total integration and mining of data emerging from different drug consortia and also to prioritize drug targets for structure-based drug design, an open-access, inclusive comprehensive database for Plasmodium falciparum was established. Meta data of known/modeled structures along with binding site parameters of drug targets have been included in the database. Additionally, chemical compounds showing a positive inhibitory assay against Plasmodium falciparum or known drug targets have also been provided. The database is accessible at http://pfaldb.jnu.ac.in. The database provides diverse information regarding the structure, sequence, stage specific gene expression, pathway, action mechanism, essentiality and druggability for each drug target, and literature to assess the validation status of individual drug targets. It also includes information on individual anti-malarials with their activity and bioassay.
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Cite this article as:
Kumar Amit, Agarwal Nidhi, Pant Lalit, Singh Prakash Jay, Ghosh Indira and Subbarao Naidu, PfalDB: An Integrated Drug Target and Chemical Database for Plasmodium flaciparum, Current Drug Targets 2014; 15 (12) . https://dx.doi.org/10.2174/1389450115666140908114939
DOI https://dx.doi.org/10.2174/1389450115666140908114939 |
Print ISSN 1389-4501 |
Publisher Name Bentham Science Publisher |
Online ISSN 1873-5592 |
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