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以DrugBank数据库为中心分析药物信息 被引量:13

Analyze Drug Information Based on DrugBank Database
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摘要 DrugBank数据库整合了药物的化学结构,药理作用,作用蛋白靶点,作用的生理通路,药物间相互作用等信息。以该数据库为中心,与PDB蛋白三维结构数据库和KEGG生理通路数据库联合应用,可以分析药物的详细信息。文章以治疗儿童白血病药物甲氨蝶呤为例,系统地研究了药物的信息获取及数据库各字段在药学研究中的意义。DrugBank数据库为药学研究人员提供了一个很好的获取药物信息的专业平台。 The DrugBank database combines the information of drug chemical structure,pharmacological effects,target proteins,pathway and drug interactions.The DrugBank database was introduced to help the pharmaceutical researchers to obtain the drug information resources more efficiently.Using DrugBank Database together with PDB protein 3D structure Database and KEGG pathway database,we systematically studied the process of obtaining drug information.The Methotrexate's structure,drug interactions,drug targets and drug pathway information were obtained by searching databases.We conclude that DrugBank database provides a professional drug information platform to the pharmaceutical researchers.
出处 《药物生物技术》 CAS CSCD 2011年第1期70-72,共3页 Pharmaceutical Biotechnology
基金 科技部"重大新药创制"科技重大专项"十二五"计划 儿童白血病的国际化新药 临床评价研究技术平台建设(编号2011ZX09302-007-01)
关键词 药学 甲氨蝶呤 数据库 药物相互作用 生理通路 Pharmacy Methotrexate Database Drug interactions Pathway
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参考文献7

  • 1Wishart DS, Knox C, Guo AC, et al. DrugBank; a knowl edgebase for drugs, drug actions and drug targets[J]. Nucleic Acids Research, 2008,36:901.
  • 2Wishart DS, Knox C, Guo AC, et al. DrugBank: a comprehensive resource for in silico drug discovery and exploration [J]. Nucleic Acids Research, 2006,34: 668.
  • 3Kouranov A, Cruz J, Chen I., et al. The RCSB PDB infor mation portal for structural genomics[J].Nucleic Acids Research, 2006,34 ; 302.
  • 4Kanehisa M, Goto S, Furumichi M, et al. KEGG for representation and analysis of molecular networks involving diseases and drugs[J]. Nucleit Acids Research, 2010,38: 355.
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  • 6Yildirim MA, Goh K, Cusick ME, et al. Drug-target network[J]. Nature Biotechnology, 2007,25 : 1119.
  • 7Voisey J, Morris CP. SNP technologies for drug discovery:a current review[J].Current Drug Discozeery Technologies, 2008,5 : 230.

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