• 文献检索
  • 文档翻译
  • 深度研究
  • 学术资讯
  • Suppr Zotero 插件Zotero 插件
  • 邀请有礼
  • 套餐&价格
  • 历史记录
应用&插件
Suppr Zotero 插件Zotero 插件浏览器插件Mac 客户端Windows 客户端微信小程序
定价
高级版会员购买积分包购买API积分包
服务
文献检索文档翻译深度研究API 文档MCP 服务
关于我们
关于 Suppr公司介绍联系我们用户协议隐私条款
关注我们

Suppr 超能文献

核心技术专利:CN118964589B侵权必究
粤ICP备2023148730 号-1Suppr @ 2026

文献检索

告别复杂PubMed语法,用中文像聊天一样搜索,搜遍4000万医学文献。AI智能推荐,让科研检索更轻松。

立即免费搜索

文件翻译

保留排版,准确专业,支持PDF/Word/PPT等文件格式,支持 12+语言互译。

免费翻译文档

深度研究

AI帮你快速写综述,25分钟生成高质量综述,智能提取关键信息,辅助科研写作。

立即免费体验

利用计算分析确定社区获得性耐甲氧西林金黄色葡萄球菌(CA-MRSA)潜在的治疗药物靶点

Potential therapeutic drug target identification in Community Acquired-Methicillin Resistant Staphylococcus aureus (CA-MRSA) using computational analysis.

作者信息

Yadav Pramod Kumar, Singh Gurmit, Singh Satendra, Gautam Budhayash, Saad Esmaiel If

机构信息

Department of Computational Biology & Bioinformatics, JSBB, SHIATS (DU), Allahabad-211007, India.

出版信息

Bioinformation. 2012;8(14):664-72. doi: 10.6026/97320630008664. Epub 2012 Jul 21.

DOI:10.6026/97320630008664
PMID:23055607
原文链接:https://pmc.ncbi.nlm.nih.gov/articles/PMC3449366/
Abstract

The emergence of multidrug-resistant strain of community-acquired methicillin resistant Staphylococcus aureus (CA-MRSA) strain has highlighted the urgent need for the alternative and effective therapeutic approach to combat the menace of this nosocomial pathogen. In the present work novel potential therapeutic drug targets have been identified through the metabolic pathways analysis. All the gene products involved in different metabolic pathways of CA-MRSA in KEGG database were searched against the proteome of Homo sapiens using the BLASTp program and the threshold of E-value was set to as 0.001. After database searching, 152 putative targets were identified. Among all 152 putative targets, 39 genes encoding for putative targets were identified as the essential genes from the DEG database which are indispensable for the survival of CA-MRSA. After extensive literature review, 7 targets were identified as potential therapeutic drug target. These targets are Fructose-bisphosphate aldolase, Phosphoglyceromutase, Purine nucleoside phosphorylase, Uridylate kinase, Tryptophan synthase subunit beta, Acetate kinase and UDP-N-acetylglucosamine 1-carboxyvinyltransferase. Except Uridylate kinase all the identified targets were involved in more than one metabolic pathways of CA-MRSA which underlines the importance of drug targets. These potential therapeutic drug targets can be exploited for the discovery of novel inhibitors for CA-MRSA using the structure based drug design (SBDD) strategy.

摘要

社区获得性耐甲氧西林金黄色葡萄球菌(CA-MRSA)多药耐药菌株的出现凸显了对抗这种医院病原体威胁的替代有效治疗方法的迫切需求。在本研究中,通过代谢途径分析确定了新的潜在治疗药物靶点。使用BLASTp程序在KEGG数据库中搜索参与CA-MRSA不同代谢途径的所有基因产物,并将E值阈值设置为0.001,以人类蛋白质组进行比对。数据库搜索后,确定了152个推定靶点。在所有152个推定靶点中,从DEG数据库中鉴定出39个编码推定靶点的基因是CA-MRSA生存所必需的必需基因。经过广泛的文献综述,确定了7个潜在治疗药物靶点。这些靶点是果糖-1,6-二磷酸醛缩酶、磷酸甘油变位酶、嘌呤核苷磷酸化酶、尿苷酸激酶、色氨酸合酶β亚基、乙酸激酶和UDP-N-乙酰葡糖胺1-羧乙烯基转移酶。除尿苷酸激酶外,所有鉴定出的靶点都参与了CA-MRSA的多个代谢途径,这突出了药物靶点的重要性。这些潜在治疗药物靶点可利用基于结构的药物设计(SBDD)策略来发现针对CA-MRSA的新型抑制剂。

相似文献

1
Potential therapeutic drug target identification in Community Acquired-Methicillin Resistant Staphylococcus aureus (CA-MRSA) using computational analysis.利用计算分析确定社区获得性耐甲氧西林金黄色葡萄球菌(CA-MRSA)潜在的治疗药物靶点
Bioinformation. 2012;8(14):664-72. doi: 10.6026/97320630008664. Epub 2012 Jul 21.
2
Metabolic pathway analysis approach: identification of novel therapeutic target against methicillin resistant Staphylococcus aureus.代谢途径分析方法:针对耐甲氧西林金黄色葡萄球菌新型治疗靶点的鉴定
Gene. 2015 Feb 10;556(2):213-26. doi: 10.1016/j.gene.2014.11.056. Epub 2014 Nov 28.
3
Identification of putative drug targets in Vancomycin-resistant Staphylococcus aureus (VRSA) using computer aided protein data analysis.利用计算机辅助蛋白质数据分析鉴定耐万古霉素金黄色葡萄球菌(VRSA)中的潜在药物靶点。
Gene. 2016 Jan 1;575(1):132-43. doi: 10.1016/j.gene.2015.08.044. Epub 2015 Aug 28.
4
Molecular modeling, dynamics studies and virtual screening of Fructose 1, 6 biphosphate aldolase-II in community acquired- methicillin resistant Staphylococcus aureus (CA-MRSA).社区获得性耐甲氧西林金黄色葡萄球菌(CA-MRSA)中果糖1,6-二磷酸醛缩酶-II的分子建模、动力学研究及虚拟筛选
Bioinformation. 2013;9(3):158-64. doi: 10.6026/97320630009158. Epub 2013 Feb 6.
5
Identification and characterization of potential drug targets by subtractive genome analyses of methicillin resistant Staphylococcus aureus.利用耐甲氧西林金黄色葡萄球菌的消减基因组分析鉴定和表征潜在的药物靶标。
Comput Biol Chem. 2014 Feb;48:55-63. doi: 10.1016/j.compbiolchem.2013.11.005. Epub 2013 Dec 5.
6
Integrated Multi-omics, Virtual Screening and Molecular Docking Analysis of Methicillin-Resistant USA300 for the Identification of Potential Therapeutic Targets: An In-Silico Approach.耐甲氧西林USA300的综合多组学、虚拟筛选和分子对接分析以鉴定潜在治疗靶点:一种计算机模拟方法
Int J Pept Res Ther. 2021;27(4):2735-2755. doi: 10.1007/s10989-021-10287-9. Epub 2021 Sep 17.
7
Molecular characteristics of community-acquired methicillin-resistant Staphylococcus aureus in Hokkaido, northern main island of Japan: identification of sequence types 6 and 59 Panton-Valentine leucocidin-positive community-acquired methicillin-resistant Staphylococcus aureus.日本北海道地区社区获得性耐甲氧西林金黄色葡萄球菌的分子特征: 6 型和 59 型 Panton-Valentine 白细胞毒素阳性社区获得性耐甲氧西林金黄色葡萄球菌的鉴定。
Microb Drug Resist. 2011 Jun;17(2):241-50. doi: 10.1089/mdr.2010.0136. Epub 2011 Mar 13.
8
Identification of Putative Vaccine and Drug Targets against the Methicillin-Resistant by Reverse Vaccinology and Subtractive Genomics Approaches.通过反向疫苗学和消减基因组学方法鉴定耐甲氧西林的潜在疫苗和药物靶标。
Molecules. 2022 Mar 24;27(7):2083. doi: 10.3390/molecules27072083.
9
Origin and evolution of European community-acquired methicillin-resistant Staphylococcus aureus.欧洲社区获得性耐甲氧西林金黄色葡萄球菌的起源与演变
mBio. 2014 Aug 26;5(5):e01044-14. doi: 10.1128/mBio.01044-14.
10
Understanding the Fight Against Resistance: Hospital-Acquired Methicillin-Resistant Staphylococcus Aureus vs. Community-Acquired Methicillin-Resistant Staphylococcus Aureus.了解对抗耐药性的斗争:医院获得性耐甲氧西林金黄色葡萄球菌与社区获得性耐甲氧西林金黄色葡萄球菌
Cureus. 2020 Jun 27;12(6):e8867. doi: 10.7759/cureus.8867.

引用本文的文献

1
Molecular modeling, dynamics studies and virtual screening of Fructose 1, 6 biphosphate aldolase-II in community acquired- methicillin resistant Staphylococcus aureus (CA-MRSA).社区获得性耐甲氧西林金黄色葡萄球菌(CA-MRSA)中果糖1,6-二磷酸醛缩酶-II的分子建模、动力学研究及虚拟筛选
Bioinformation. 2013;9(3):158-64. doi: 10.6026/97320630009158. Epub 2013 Feb 6.
2
Immucillin-H, a purine nucleoside phosphorylase transition state analog, causes non-lethal attenuation of growth in Staphylococcus aureus.免疫菌素-H,一种嘌呤核苷磷酸化酶过渡态类似物,可导致金黄色葡萄球菌生长的非致死性减弱。
Bioinformation. 2013;9(1):9-17. doi: 10.6026/97320630009009. Epub 2013 Jan 9.

本文引用的文献

1
Alternative therapies in Staphylococcus aureus diseases.金黄色葡萄球菌疾病的替代疗法。
Acta Biochim Pol. 2012;59(2):171-84. Epub 2012 May 11.
2
Community-associated methicillin-resistant Staphylococcus aureus: epidemiology and clinical consequences of an emerging epidemic.社区相关性耐甲氧西林金黄色葡萄球菌:一种新兴流行疾病的流行病学和临床后果。
Clin Microbiol Rev. 2010 Jul;23(3):616-87. doi: 10.1128/CMR.00081-09.
3
Crystallographic and docking studies of purine nucleoside phosphorylase from Mycobacterium tuberculosis.结核分枝杆菌嘌呤核苷磷酸化酶的晶体学和对接研究。
Bioorg Med Chem. 2010 Jul 1;18(13):4769-74. doi: 10.1016/j.bmc.2010.05.009. Epub 2010 May 10.
4
Acetate formation in the energy metabolism of parasitic helminths and protists.寄生虫和原生动物的能量代谢中的乙酸盐形成。
Int J Parasitol. 2010 Mar 15;40(4):387-97. doi: 10.1016/j.ijpara.2009.12.006. Epub 2010 Jan 18.
5
Inhibitory mechanism of novel inhibitors of UDP-N-acetylglucosamine enolpyruvyl transferase from Haemophilus influenzae.新型流感嗜血杆菌 UDP-N-乙酰氨基葡萄糖烯醇丙酮酸基转移酶抑制剂的抑制机制。
J Microbiol Biotechnol. 2009 Dec;19(12):1582-9.
6
Waves of resistance: Staphylococcus aureus in the antibiotic era.耐药浪潮:抗生素时代的金黄色葡萄球菌
Nat Rev Microbiol. 2009 Sep;7(9):629-41. doi: 10.1038/nrmicro2200.
7
Characterization of the putative tryptophan synthase beta-subunit from Mycobacterium tuberculosis.结核分枝杆菌假定色氨酸合酶β亚基的表征
Acta Biochim Biophys Sin (Shanghai). 2009 May;41(5):379-88. doi: 10.1093/abbs/gmp017.
8
Structural basis for catalysis of a tetrameric class IIa fructose 1,6-bisphosphate aldolase from Mycobacterium tuberculosis.结核分枝杆菌IIa类四聚体1,6-二磷酸果糖醛缩酶催化作用的结构基础
J Mol Biol. 2009 Mar 6;386(4):1038-53. doi: 10.1016/j.jmb.2009.01.003. Epub 2009 Jan 10.
9
The Wolbachia endosymbiont of Brugia malayi has an active phosphoglycerate mutase: a candidate target for anti-filarial therapies.马来布鲁线虫的沃尔巴克氏体共生菌具有一种活性磷酸甘油酸变位酶:抗丝虫病治疗的候选靶点。
Parasitol Res. 2009 Apr;104(5):1047-52. doi: 10.1007/s00436-008-1287-7. Epub 2008 Nov 29.
10
DEG 5.0, a database of essential genes in both prokaryotes and eukaryotes.DEG 5.0,一个包含原核生物和真核生物必需基因的数据库。
Nucleic Acids Res. 2009 Jan;37(Database issue):D455-8. doi: 10.1093/nar/gkn858. Epub 2008 Oct 30.