N'-Methoxy-4-[5-[4-(N'-methoxycarbamimidoyl)phenyl]furan-2-yl]benzenecarboximidamide (BioDeep_00000173010)

   

human metabolite blood metabolite


代谢物信息卡片


N-methoxy-4-{5-[4-(N-methoxycarbamimidoyl)phenyl]furan-2-yl}benzene-1-carboximidamide

化学式: C20H20N4O3 (364.15353300000004)
中文名称: 4,4-(2,5-呋喃基)双[N-甲氧基苯甲脒]
谱图信息: 最多检出来源 Homo sapiens(blood) 96%

分子结构信息

SMILES: CON=C(C1=CC=C(C=C1)C2=CC=C(O2)C3=CC=C(C=C3)C(=NOC)N)N
InChI: InChI=1S/C20H20N4O3/c1-25-23-19(21)15-7-3-13(4-8-15)17-11-12-18(27-17)14-5-9-16(10-6-14)20(22)24-26-2/h3-12H,1-2H3,(H2,21,23)(H2,22,24)

描述信息

D000890 - Anti-Infective Agents > D000977 - Antiparasitic Agents > D000981 - Antiprotozoal Agents
C254 - Anti-Infective Agent > C276 - Antiparasitic Agent > C277 - Antiprotozoal Agent

同义名列表

6 个代谢物同义名

N-methoxy-4-{5-[4-(N-methoxycarbamimidoyl)phenyl]furan-2-yl}benzene-1-carboximidamide; N-methoxy-4-{5-[4-(N-methoxycarbamimidoyl)phenyl]furan-2-yl}benzenecarboximidamide; N-Methoxy-4-[5-[4-(N-methoxycarbamimidoyl)phenyl]furan-2-yl]benzenecarboximidamide; 2,5-Bis(4-amidinophenyl)furan-bis-O-methylamidoxime; Pafuramidine; DB289 CPD



数据库引用编号

8 个数据库交叉引用编号

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)

1 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。

点击图上的相关代谢物的名称，可以跳转到相关代谢物的信息页面。



文献列表

  • Yedong Wang, Yuan Li, Jia Lu, Huixin Qi, Isabel Cheng, Hongjian Zhang. Involvement of CYP4F2 in the Metabolism of a Novel Monophosphate Ester Prodrug of Gemcitabine and Its Interaction Potential In Vitro. Molecules (Basel, Switzerland). 2018 May; 23(5):. doi: 10.3390/molecules23051195. [PMID: 29772747]
  • Gabriele Pohlig, Sonja C Bernhard, Johannes Blum, Christian Burri, Alain Mpanya, Jean-Pierre Fina Lubaki, Alfred Mpoo Mpoto, Blaise Fungula Munungu, Patrick Mangoni N'tombe, Gratias Kambau Manesa Deo, Pierre Nsele Mutantu, Florent Mbo Kuikumbi, Alain Fukinsia Mintwo, Augustin Kayeye Munungi, Amadeu Dala, Stephen Macharia, Constantin Miaka Mia Bilenge, Victor Kande Betu Ku Mesu, Jose Ramon Franco, Ndinga Dieyi Dituvanga, Richard R Tidwell, Carol A Olson. Efficacy and Safety of Pafuramidine versus Pentamidine Maleate for Treatment of First Stage Sleeping Sickness in a Randomized, Comparator-Controlled, International Phase 3 Clinical Trial. PLoS neglected tropical diseases. 2016 Feb; 10(2):e0004363. doi: 10.1371/journal.pntd.0004363. [PMID: 26882015]
  • Alison H Harrill, Kristina D Desmet, Kristina K Wolf, Arlene S Bridges, J Scott Eaddy, C Lisa Kurtz, J Ed Hall, Mary F Paine, Richard R Tidwell, Paul B Watkins. A mouse diversity panel approach reveals the potential for clinical kidney injury due to DB289 not predicted by classical rodent models. Toxicological sciences : an official journal of the Society of Toxicology. 2012 Dec; 130(2):416-26. doi: 10.1093/toxsci/kfs238. [PMID: 22940726]
  • John K Thuita, Michael Z Wang, John M Kagira, Cathrine L Denton, Mary F Paine, Raymond E Mdachi, Grace A Murilla, Shelley Ching, David W Boykin, Richard R Tidwell, James E Hall, Reto Brun. Pharmacology of DB844, an orally active aza analogue of pafuramidine, in a monkey model of second stage human African trypanosomiasis. PLoS neglected tropical diseases. 2012; 6(7):e1734. doi: 10.1371/journal.pntd.0001734. [PMID: 22848769]
  • Grace Zhixia Yan, Claudia N Generaux, Miyoung Yoon, Rachel B Goldsmith, Richard R Tidwell, James E Hall, Carol A Olson, Harvey J Clewell, Kim L R Brouwer, Mary F Paine. A semiphysiologically based pharmacokinetic modeling approach to predict the dose-exposure relationship of an antiparasitic prodrug/active metabolite pair. Drug metabolism and disposition: the biological fate of chemicals. 2012 Jan; 40(1):6-17. doi: 10.1124/dmd.111.040063. [PMID: 21953913]
  • Paul F Seke Etet, M Fawzi Mahomoodally. New insights in staging and chemotherapy of African trypanosomiasis and possible contribution of medicinal plants. TheScientificWorldJournal. 2012; 2012(?):343652. doi: 10.1100/2012/343652. [PMID: 22593674]
  • Denise da Gama Jaén Batista, Marcos Meuser Batista, Gabriel Melo de Oliveira, Constança Carvalho Britto, Ana Carolina Mondaine Rodrigues, Chad E Stephens, David W Boykin, Maria de Nazaré Correia Soeiro. Combined treatment of heterocyclic analogues and benznidazole upon Trypanosoma cruzi in vivo. PloS one. 2011; 6(7):e22155. doi: 10.1371/journal.pone.0022155. [PMID: 21814568]
  • Myaing M Nyunt, Craig W Hendrix, Rahul P Bakshi, Nirbhay Kumar, Theresa A Shapiro. Phase I/II evaluation of the prophylactic antimalarial activity of pafuramidine in healthy volunteers challenged with Plasmodium falciparum sporozoites. The American journal of tropical medicine and hygiene. 2009 Apr; 80(4):528-35. doi: 10.4269/ajtmh.2009.80.528. [PMID: 19346370]
  • Ian Midgley, Karen Fitzpatrick, Lynne M Taylor, Tara L Houchen, Simon J Henderson, Sarah J Wright, Zbigniew R Cybulski, Brian A John, Alan McBurney, David W Boykin, Kerri L Trendler. Pharmacokinetics and metabolism of the prodrug DB289 (2,5-bis[4-(N-methoxyamidino)phenyl]furan monomaleate) in rat and monkey and its conversion to the antiprotozoal/antifungal drug DB75 (2,5-bis(4-guanylphenyl)furan dihydrochloride). Drug metabolism and disposition: the biological fate of chemicals. 2007 Jun; 35(6):955-67. doi: 10.1124/dmd.106.013391. [PMID: 17360833]
  • Lisa M Sturk, Jacqueline L Brock, C Robert Bagnell, James E Hall, Richard R Tidwell. Distribution and quantitation of the anti-trypanosomal diamidine 2,5-bis(4-amidinophenyl)furan (DB75) and its N-methoxy prodrug DB289 in murine brain tissue. Acta tropica. 2004 Jul; 91(2):131-43. doi: 10.1016/j.actatropica.2004.03.010. [PMID: 15234662]