Verlukast (BioDeep_00000180997)
human metabolite blood metabolite
代谢物信息卡片
化学式: C26H27ClN2O3S2 (514.1151542000001)
中文名称:
谱图信息:
最多检出来源 Homo sapiens(blood) 50%
分子结构信息
SMILES: CN(C)C(=O)CCSC(c1cccc(/C=C/c2ccc3ccc(cc3n2)Cl)c1)SCCC(=O)O
InChI: InChI=1S/C26H27ClN2O3S2/c1-29(2)24(30)12-14-33-26(34-15-13-25(31)32)20-5-3-4-18(16-20)6-10-22-11-8-19-7-9-21(27)17-23(19)28-22/h3-11,16-17,26H,12-15H2,1-2H3,(H,31,32)
数据库引用编号
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
- I S Haslam, J A Wright, D A O'Reilly, D J Sherlock, T Coleman, N L Simmons. Intestinal ciprofloxacin efflux: the role of breast cancer resistance protein (ABCG2).
Drug metabolism and disposition: the biological fate of chemicals.
2011 Dec; 39(12):2321-8. doi:
10.1124/dmd.111.038323. [PMID: 21930826] - Takeo Nakanishi, Yuta Shibue, Yoko Fukuyama, Kenji Yoshida, Hajime Fukuda, Yoshiyuki Shirasaka, Ikumi Tamai. Quantitative time-lapse imaging-based analysis of drug-drug interaction mediated by hepatobiliary transporter, multidrug resistance-associated protein 2, in sandwich-cultured rat hepatocytes.
Drug metabolism and disposition: the biological fate of chemicals.
2011 Jun; 39(6):984-91. doi:
10.1124/dmd.111.038059. [PMID: 21415249] - Marek Kucka, Karla Kretschmannova, Takayo Murano, Chung-Pu Wu, Hana Zemkova, Suresh V Ambudkar, Stanko S Stojilkovic. Dependence of multidrug resistance protein-mediated cyclic nucleotide efflux on the background sodium conductance.
Molecular pharmacology.
2010 Feb; 77(2):270-9. doi:
10.1124/mol.109.059386. [PMID: 19903828] - Katharine Howe, G Gordon Gibson, Tanya Coleman, Nick Plant. In silico and in vitro modeling of hepatocyte drug transport processes: importance of ABCC2 expression levels in the disposition of carboxydichlorofluroscein.
Drug metabolism and disposition: the biological fate of chemicals.
2009 Feb; 37(2):391-9. doi:
10.1124/dmd.108.022921. [PMID: 19022944] - Yurong Lai, Li Xing, Gennadiy I Poda, Yiding Hu. Structure-activity relationships for interaction with multidrug resistance protein 2 (ABCC2/MRP2): the role of torsion angle for a series of biphenyl-substituted heterocycles.
Drug metabolism and disposition: the biological fate of chemicals.
2007 Jun; 35(6):937-45. doi:
10.1124/dmd.106.013250. [PMID: 17371800] - Thomas Walle, U Kristina Walle. The beta-D-glucoside and sodium-dependent glucose transporter 1 (SGLT1)-inhibitor phloridzin is transported by both SGLT1 and multidrug resistance-associated proteins 1/2.
Drug metabolism and disposition: the biological fate of chemicals.
2003 Nov; 31(11):1288-91. doi:
10.1124/dmd.31.11.1288. [PMID: 14570756] - Jaya Bharathi Vaidyanathan, Thomas Walle. Cellular uptake and efflux of the tea flavonoid (-)epicatechin-3-gallate in the human intestinal cell line Caco-2.
The Journal of pharmacology and experimental therapeutics.
2003 Nov; 307(2):745-52. doi:
10.1124/jpet.103.054296. [PMID: 12970388]