Citations (34)
Keep up to date with the latest research on this topic with citation updates for this article.
Read on this site (8)
Toby J. Athersuch, Ian D. Wilson, Hector C. Keun & John C. Lindon. (2013) Development of quantitative structure-metabolism (QSMR) relationships for substituted anilines based on computational chemistry. Xenobiotica 43:9, pages 792-802.
Read now
Read now
Bente Gammelgaard, Helle Rüsz Hansen, Stefan Stürup & Charlotte Møller. (2008) The use of inductively coupled plasma mass spectrometry as a detector in drug metabolism studies. Expert Opinion on Drug Metabolism & Toxicology 4:9, pages 1187-1207.
Read now
Read now
S. J. Vanderhoeven, J. Troke, G. E. Tranter, I. D. Wilson, J. K. Nicholson & J. C. Lindon. (2004) Nuclear magnetic resonance (NMR) and quantitative structure–activity relationship (QSAR) studies on the transacylation reactivity of model 1β--acyl glucuronides. II: QSAR modelling of the reaction using both computational and experimental NMR parameters. Xenobiotica 34:10, pages 889-900.
Read now
Read now
James B. Knaak, Curt C. Dary, Fred Power, Carol B. Thompson & Jerry N. Blancato. (2004) Physicochemical and Biological Data for the Development of Predictive Organophosphorus Pesticide QSARs and PBPK/PD Models for Human Risk Assessment. Critical Reviews in Toxicology 34:2, pages 143-207.
Read now
Read now
H. Major, J. Castro-Perez, J. K. Nicholson & I. D. Wilson. (2003) Detection of mono- and di-hexoses as metabolites of 4-bromoaniline using HPLC-TOF-MS/MS. Xenobiotica 33:8, pages 855-869.
Read now
Read now
C. A. Blackledge, J. K. Nicholson, J. A. Evans, C. Rodgers & I. D. Wilson. (2002) Application of 1 H- and 19 F-NMR spectroscopy in the investigation of the urinary and biliary excretion of 3,5-, 2,4-ditrifluoromethylbenzoic and pentafluorobenzoic acids in rat. Xenobiotica 32:7, pages 605-613.
Read now
Read now
G. B. Scarfe, I. D. Wilson, M. A. Warne, E. Holmes, J. K. Nicholson & J. C. Lindon. (2002) Structure-metabolism relationships of substituted anilines: prediction of N-acetylation and N-oxanilic acid formation using computational chemistry. Xenobiotica 32:4, pages 267-277.
Read now
Read now
G. B. Scarfe, J. K. Nicholson, J. C. Lindon, I. D. Wilson, S. Taylor, E. Clayton & B. Wright. (2002) Identification of the urinary metabolites of 4-bromoaniline and 4-bromo- [carbonyl - 13 C]-acetanilide in rat. Xenobiotica 32:4, pages 325-337.
Read now
Read now
Articles from other publishers (26)
Syeda Saba Kareem & Yashwant Pathak. 2016. Artificial Neural Network for Drug Design, Delivery and Disposition. Artificial Neural Network for Drug Design, Delivery and Disposition
393
405
.
G. Vistoli & A. Pedretti. 2016. Reference Module in Chemistry, Molecular Sciences and Chemical Engineering. Reference Module in Chemistry, Molecular Sciences and Chemical Engineering.
Daisuke Ando, Takuo Fujisawa & Toshiyuki Katagi. (2015)
Uptake, Translocation, and Metabolism of Phenols by Submerged Rooted Macrophyte, Water Milfoil (
Myriophyllum elatinoides
)
. Journal of Agricultural and Food Chemistry 63:21, pages 5189-5195.
Crossref
Crossref
Jianlong Peng, Jing Lu, Qiancheng Shen, Mingyue Zheng, Xiaomin Luo, Weiliang Zhu, Hualiang Jiang & Kaixian Chen. (2014)
In silico
site of metabolism prediction for human UGT-catalyzed reactions
. Bioinformatics 30:3, pages 398-405.
Crossref
Crossref
. 2012. Pharmacokinetics and Metabolism in Drug Design. Pharmacokinetics and Metabolism in Drug Design
229
250
.
Bernard Testa & Stefanie D. Krämer. (2008) The Biochemistry of Drug Metabolism – An Introduction. Chemistry & Biodiversity 5:11, pages 2171-2336.
Crossref
Crossref
P. L. Piotrowski, B. G. Sumpter, H. V. Malling, J. S. Wassom, P. Y. Lu, R. A. Brothers, G. A. Sega, S. A. Martin & M. Parang. (2007) A Toxicity Evaluation and Predictive System Based on Neural Networks and Wavelets. Journal of Chemical Information and Modeling 47:2, pages 676-685.
Crossref
Crossref
Bente Gammelgaard & Berit Packert Jensen. (2007) Application of inductively coupled plasma mass spectrometry in drug metabolism studies. Journal of Analytical Atomic Spectrometry 22:3, pages 235.
Crossref
Crossref
G. Vistoli & A. Pedretti. 2007. Comprehensive Medicinal Chemistry II. Comprehensive Medicinal Chemistry II
577
602
.
Michael J. Sorich, Ross A. McKinnon, John O. Miners & Paul A. Smith. (2006) The Importance of Local Chemical Structure for Chemical Metabolism by Human Uridine 5‘-Diphosphate−Glucuronosyltransferase. Journal of Chemical Information and Modeling 46:6, pages 2692-2697.
Crossref
Crossref
Graham Lappin. 2006. Radiotracers in Drug Development. Radiotracers in Drug Development
41
118
.
Berit Packert Jensen, Christopher J. Smith, Christopher J. Bailey, Colin Rodgers, Ian D. Wilson & Jeremy K. Nicholson. (2005) Investigation of the metabolic fate of 2-, 3- and 4-bromobenzoic acids in bile-duct-cannulated rats by inductively coupled plasma mass spectrometry and high-performance liquid chromatography/inductively coupled plasma mass spectrometry/electrospray mass spectrometry. Rapid Communications in Mass Spectrometry 19:4, pages 519-524.
Crossref
Crossref
Michael J. Sorich, Ross A. McKinnon, John O. Miners, David A. Winkler & Paul A. Smith. (2004) Rapid Prediction of Chemical Metabolism by Human UDP-glucuronosyltransferase Isoforms Using Quantum Chemical Descriptors Derived with the Electronegativity Equalization Method. Journal of Medicinal Chemistry 47:21, pages 5311-5317.
Crossref
Crossref
P.A Smith, M.J Sorich, L.S.C Low, R.A McKinnon & J.O Miners. (2004) Towards integrated ADME prediction: past, present and future directions for modelling metabolism by UDP-glucuronosyltransferases. Journal of Molecular Graphics and Modelling 22:6, pages 507-517.
Crossref
Crossref
Martin Payne. 2004. Predicting Chemical Toxicity and Fate. Predicting Chemical Toxicity and Fate.
John O. MinersPaul A. SmithMichael J. SorichRoss A. McKinnonPeter I. Mackenzie. (2004) Predicting Human Drug Glucuronidation Parameters: Application of In Vitro and In Silico Modeling Approaches. Annual Review of Pharmacology and Toxicology 44:1, pages 1-25.
Crossref
Crossref
PA Smith, MJ Sorich, RA McKinnon & JO Miners. (2003) In silico insights: Chemical and structural characteristics associated with uridine diphosphate-glucuronosyltransferase substrate selectivity. Clinical and Experimental Pharmacology and Physiology 30:11, pages 836-840.
Crossref
Crossref
Anthony Long & John D. Walker. (2009) Quantitative structure‐activity relationships for predicting metabolism and modeling cytochrome P450 enzyme activities. Environmental Toxicology and Chemistry 22:8, pages 1894-1899.
Crossref
Crossref
Paul A. Smith, Michael J. Sorich, Ross A. McKinnon & John O. Miners. (2003) Pharmacophore and Quantitative Structure−Activity Relationship Modeling: Complementary Approaches for the Rationalization and Prediction of UDP-Glucuronosyltransferase 1A4 Substrate Selectivity. Journal of Medicinal Chemistry 46:9, pages 1617-1626.
Crossref
Crossref
C.A Blackledge, J.K Nicholson & I.D Wilson. (2003) An NMR study of the metabolic fate of 2-, 3- and 4-fluorobenzyl alcohols in the rat. Journal of Pharmaceutical and Biomedical Analysis 32:1, pages 133-140.
Crossref
Crossref
Hilary Major, Jose Castro-Perez, Jeremy K. Nicholson & Ian D. Wilson. (2003) Characterisation of putative pentose-containing conjugates as minor metabolites of 4-bromoaniline present in the urine of rats following intraperitoneal administration. Rapid Communications in Mass Spectrometry 17:1, pages 76-80.
Crossref
Crossref
M Tugnait, E.M Lenz, M Hofmann, M Spraul, I.D Wilson, J.C Lindon & J.K Nicholson. (2003) The metabolism of 2-trifluormethylaniline and its acetanilide in the rat by 19F NMR monitored enzyme hydrolysis and 1H/19F HPLC-NMR spectroscopy. Journal of Pharmaceutical and Biomedical Analysis 30:5, pages 1561-1574.
Crossref
Crossref
Michael J Sorich, Paul A Smith, Ross A McKinnon & John O Miners. (2002) Pharmacophore and quantitative structure activity relationship modelling of UDP-glucuronosyltransferase 1A1 (UGT1A1) substrates. Pharmacogenetics 12:8, pages 635-645.
Crossref
Crossref
Matthew D. Wessel & Scot Mente. 2001.
257
266
.
Graeme B. Scarfe, Edward Clayton, Ian D. Wilson & Jeremy K. Nicholson. (2000) Identification and quantification of metabolites of 2,3,5,6-tetrafluoro-4-trifluoromethylaniline in rat urine using 19F nuclear magnetic resonance spectroscopy, high-performance liquid chromatography–nuclear magnetic resonance spectroscopy and high-performance liquid chromatography–mass spectrometry. Journal of Chromatography B: Biomedical Sciences and Applications 748:1, pages 311-319.
Crossref
Crossref
C.A Blackledge, E.A Partridge, I.D Wilson & J.K Nicholson. (2000) The metabolism and excretion of [14C] 2- and 4-chlorobenzoic acids in the rat. Journal of Pharmaceutical and Biomedical Analysis 22:6, pages 1023-1028.
Crossref
Crossref