Bedaquiline fumarate (BioDeep_00000701894)
代谢物信息卡片
Bedaquiline fumarate
化学式: C36H35BrN2O6 (670.167835)
中文名称: 贝达喹啉富马酸盐
谱图信息:
最多检出来源 () 0%
分子结构信息
SMILES: CN(C)CCC(C1=CC=CC2=CC=CC=C21)(C(C3=CC=CC=C3)C4=C(N=C5C=CC(=CC5=C4)Br)OC)O.C(=CC(=O)O)C(=O)O
InChI: /m1./s1
描述信息
D000890 - Anti-Infective Agents > D000900 - Anti-Bacterial Agents > D000995 - Antitubercular Agents
C254 - Anti-Infective Agent > C52588 - Antibacterial Agent > C280 - Antitubercular Agent
同义名列表
1 个代谢物同义名
数据库引用编号
5 个数据库交叉引用编号
- ChEBI: CHEBI:72295
- KEGGdrug: D09873
- PubChem: 24812732
- ChEMBL: CHEMBL2105700
- CAS: 845533-86-0
分类词条
相关代谢途径
Reactome(0)
BioCyc(0)
PlantCyc(0)
代谢反应
0 个相关的代谢反应过程信息。
Reactome(0)
BioCyc(0)
WikiPathways(0)
Plant Reactome(0)
INOH(0)
PlantCyc(0)
COVID-19 Disease Map(0)
PathBank(0)
PharmGKB(0)
0 个相关的物种来源信息
在这里通过桑基图来展示出与当前的这个代谢物在我们的BioDeep知识库中具有相关联信息的其他代谢物。在这里进行关联的信息来源主要有：
- PubMed: 来源于PubMed文献库中的文献信息，我们通过自然语言数据挖掘得到的在同一篇文献中被同时提及的相关代谢物列表，这个列表按照代谢物同时出现的文献数量降序排序，取前10个代谢物作为相关研究中关联性很高的代谢物集合展示在桑基图中。
- NCBI Taxonomy: 通过文献数据挖掘，得到的代谢物物种来源信息关联。这个关联信息同样按照出现的次数降序排序，取前10个代谢物作为高关联度的代谢物集合展示在桑吉图上。
- Chemical Taxonomy: 在物质分类上处于同一个分类集合中的其他代谢物
- Chemical Reaction: 在化学反应过程中，存在为当前代谢物相关联的生化反应过程中的反应底物或者反应产物的关联代谢物信息。
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文献列表
- Jin Zou, Shuyan Chen, Weiqiao Rao, Liang Fu, Jiancong Zhang, Yunli Liao, Ying Zhang, Ning Lv, Guofang Deng, Shijin Yang, Liang Lin, Lujin Li, Siqi Liu, Jiuxin Qu. Population Pharmacokinetic Modeling of Bedaquiline among Multidrug-Resistant Pulmonary Tuberculosis Patients from China.
Antimicrobial agents and chemotherapy.
2022 10; 66(10):e0081122. doi:
10.1128/aac.00811-22. [PMID: 36106884] - Richard Court, Kamunkhwala Gausi, Buyisile Mkhize, Lubbe Wiesner, Catriona Waitt, Helen McIlleron, Gary Maartens, Paolo Denti, Marian Loveday. Bedaquiline exposure in pregnancy and breastfeeding in women with rifampicin-resistant tuberculosis.
British journal of clinical pharmacology.
2022 Aug; 88(8):3548-3558. doi:
10.1111/bcp.15380. [PMID: 35526837] - Catherine Berry, Philipp du Cros, Katherine Fielding, Suzanne Gajewski, Emil Kazounis, Timothy D McHugh, Corinne Merle, Ilaria Motta, David A J Moore, Bern-Thomas Nyang'wa. TB-PRACTECAL: study protocol for a randomised, controlled, open-label, phase II-III trial to evaluate the safety and efficacy of regimens containing bedaquiline and pretomanid for the treatment of adult patients with pulmonary multidrug-resistant tuberculosis.
Trials.
2022 Jun; 23(1):484. doi:
10.1186/s13063-022-06331-8. [PMID: 35698158] - Caryn M Upton, Chanel I Steele, Gary Maartens, Andreas H Diacon, Lubbe Wiesner, Kelly E Dooley. Pharmacokinetics of bedaquiline in cerebrospinal fluid (CSF) in patients with pulmonary tuberculosis (TB).
The Journal of antimicrobial chemotherapy.
2022 05; 77(6):1720-1724. doi:
10.1093/jac/dkac067. [PMID: 35257182] - Michael A Lyons. Pharmacodynamics and Bactericidal Activity of Bedaquiline in Pulmonary Tuberculosis.
Antimicrobial agents and chemotherapy.
2022 02; 66(2):e0163621. doi:
10.1128/aac.01636-21. [PMID: 34871099] - Hamish S Sutherland, Guo-Liang Lu, Amy S T Tong, Daniel Conole, Scott G Franzblau, Anna M Upton, Manisha U Lotlikar, Christopher B Cooper, Brian D Palmer, Peter J Choi, William A Denny. Synthesis and structure-activity relationships for a new class of tetrahydronaphthalene amide inhibitors of Mycobacterium tuberculosis.
European journal of medicinal chemistry.
2022 Feb; 229(?):114059. doi:
10.1016/j.ejmech.2021.114059. [PMID: 34963068] - Qinglong Guo, Jing Bi, Qiao Lin, Taosheng Ye, Zhongyuan Wang, Zhaoqin Wang, Lei Liu, Guoliang Zhang. Whole Genome Sequencing Identifies Novel Mutations Associated With Bedaquiline Resistance in Mycobacterium tuberculosis.
Frontiers in cellular and infection microbiology.
2022; 12(?):807095. doi:
10.3389/fcimb.2022.807095. [PMID: 35694543] - Precious Ngwalero, James C M Brust, Stijn W van Beek, Sean Wasserman, Gary Maartens, Graeme Meintjes, Anton Joubert, Jennifer Norman, Sandra Castel, Neel R Gandhi, Paolo Denti, Helen McIlleron, Elin M Svensson, Lubbe Wiesner. Relationship between Plasma and Intracellular Concentrations of Bedaquiline and Its M2 Metabolite in South African Patients with Rifampin-Resistant Tuberculosis.
Antimicrobial agents and chemotherapy.
2021 10; 65(11):e0239920. doi:
10.1128/aac.02399-20. [PMID: 34370588] - Ken Kurosawa, Stefaan Rossenu, Jeike Biewenga, Sivi Ouwerkerk-Mahadevan, Wouter Willems, Etienne Ernault, Chrispin Kambili. Population Pharmacokinetic Analysis of Bedaquiline-Clarithromycin for Dose Selection Against Pulmonary Nontuberculous Mycobacteria Based on a Phase 1, Randomized, Pharmacokinetic Study.
Journal of clinical pharmacology.
2021 10; 61(10):1344-1355. doi:
10.1002/jcph.1887. [PMID: 33991350] - Maroussia Roelens, Giovanni Battista Migliori, Liudmila Rozanova, Janne Estill, Jonathon R Campbell, J Peter Cegielski, Simon Tiberi, Domingo Palmero, Greg J Fox, Lorenzo Guglielmetti, Giovanni Sotgiu, James C M Brust, Didi Bang, Christian Lienhardt, Christoph Lange, Dick Menzies, Olivia Keiser, Mario Raviglione. Evidence-based Definition for Extensively Drug-Resistant Tuberculosis.
American journal of respiratory and critical care medicine.
2021 09; 204(6):713-722. doi:
10.1164/rccm.202009-3527oc. [PMID: 34107231] - Jinmeng Li, Gaoyi Yang, Qingshan Cai, Yu Wang, Yingying Xu, Ruoying Zhang, Yazhen Lang, Xinjun Cai. Safety, efficacy, and serum concentration monitoring of bedaquiline in Chinese patients with multidrug-resistant tuberculosis.
International journal of infectious diseases : IJID : official publication of the International Society for Infectious Diseases.
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Molecules (Basel, Switzerland).
2021 Mar; 26(6):. doi:
10.3390/molecules26061678. [PMID: 33802860] - Wael A Alghamdi, Mohammad H Al-Shaer, Maia Kipiani, Ketevan Barbakadze, Lali Mikiashvili, Russell R Kempker, Charles A Peloquin. Pharmacokinetics of bedaquiline, delamanid and clofazimine in patients with multidrug-resistant tuberculosis.
The Journal of antimicrobial chemotherapy.
2021 03; 76(4):1019-1024. doi:
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Future medicinal chemistry.
2020 10; 12(20):1815-1828. doi:
10.4155/fmc-2020-0165. [PMID: 32787684] - Pankul Kotwal, Ashish Dogra, Ankita Sharma, Shipra Bhatt, Abhishek Gour, Sumit Sharma, Priya Wazir, Parvinder Pal Singh, Ajay Kumar, Utpal Nandi. Effect of Natural Phenolics on Pharmacokinetic Modulation of Bedaquiline in Rat to Assess the Likelihood of Potential Food-Drug Interaction.
Journal of agricultural and food chemistry.
2020 Feb; 68(5):1257-1265. doi:
10.1021/acs.jafc.9b06529. [PMID: 31927919] - Jickky Palmae Sarathy, Priya Ragunathan, Christopher B Cooper, Anna M Upton, Gerhard Grüber, Thomas Dick. TBAJ-876 Displays Bedaquiline-Like Mycobactericidal Potency without Retaining the Parental Drug's Uncoupler Activity.
Antimicrobial agents and chemotherapy.
2020 01; 64(2):. doi:
10.1128/aac.01540-19. [PMID: 31712198] - Gregory R Tintinger, Annette J Theron, Helen C Steel, Moloko C Cholo, Jan G Nel, Charles Feldman, Ronald Anderson. Submission for Special Issue: The Role of Platelet Activation in the Pathophysiology of HIV, Tuberculosis, and Pneumococcal Disease. Bedaquiline Suppresses ADP-Mediated Activation of Human Platelets In Vitro via Interference With Phosphatidylinositol 3-Kinase.
Frontiers in immunology.
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10.1016/j.jchromb.2019.02.022. [PMID: 30851617] - Yi-Chen Chen, Jane R Kenny, Matthew Wright, Cornelis E C A Hop, Zhengyin Yan. Improving Confidence in the Determination of Free Fraction for Highly Bound Drugs Using Bidirectional Equilibrium Dialysis.
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PloS one.
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