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Applying Mechanisms of Chemical Toxicity to Predict Drug Safety
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Outgoing claims: the papers this work cites, builds on, or argues with.
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Acetaminophen‐induced acute liver failure
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Hydralazine and Other Hydrazine Derivatives and the Formation of DNA Adducts
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Clustering of Hepatotoxins Based on Mechanism of Toxicity Using Gene Expression Profiles
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Drug Metabolites in Safety Testing
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Substrate Oxidation by Cytochrome P450 Enzymes
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Metabonomics Techniques and Applications to Pharmaceutical Research & Development
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The role of lipid peroxidation in the toxicity of foreign compounds to liver cells
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Metabolic activation of the tricyclic antidepressant amineptine—I
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Correlation of metabolism, covalent binding and toxicity for a series of bromobenzene derivatives using rat liver slices in vitro
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Omeprazole is an aryl hydrocarbon-like inducer of human hepatic cytochrome P450
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Omeprazole treatment does not affect the metabolism of caffeine
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The effect of phenobarbital on the metabolism and excretion of thyroxine in rats
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In vitro metabolism of isaxonine phosphate: formation of two metabolites, 5-hydroxyisaxonine and 2-aminopyrimidine, and covalent binding to microsomal proteins
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Covalent Binding to Proteins
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A quantitative high-throughput trapping assay as a measurement of potential for bioactivation
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Principles of covalent binding of reactive metabolites and examples of activation of bis-electrophiles by conjugation
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Animal models of idiosyncratic drug reactions
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Adverse hepatic drug reactions: inflammatory episodes as consequence and contributor
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Drug-induced liver injury: Hy’s rule revisited
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Development of a large-scale chemogenomics database to improve drug candidate selection and to understand mechanisms of chemical toxicity and action
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A Study of spectral integration and normalization in NMR-based metabonomic analyses
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Statins induce apoptosis in rat and human myotube cultures by inhibiting protein geranylgeranylation but not ubiquinone
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Metabonomic evaluation of idiosyncrasy-like liver injury in rats cotreated with ranitidine and lipopolysaccharide
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Mechanisms of idiosyncratic drug reactions: the case of felbamate
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Hepatotoxicity: The adverse effects of drugs and other chemicals on the liver
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Mechanisms of cell injury in the killing of cultured hepatocytes by bromobenzene.
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ACETAMINOPHEN-INDUCED HEPATIC NECROSIS. II. ROLE OF COVALENT BINDING IN VIVO
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ACETAMINOPHEN-INDUCED HEPATIC NECROSIS. IV. PROTECTIVE ROLE OF GLUTATHIONE
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ROLE OF DETOXIFYING ENZYMES IN BROMOBENZENE-INDUCED LIVER NECROSIS
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Isoniazid hepatoxicity: the relationship between covalent binding and metabolism in vivo.
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Regulatory role of glutathione and soluble sulfhydryl groups in the toxicity of adriamycin.
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Hepatic glutathione and hepatotoxicity: changes induced by selected narcotics.
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Metabolic activation of the nitroaromatic antiandrogen flutamide by rat and human cytochromes P-450, including forms belonging to the 3A and 1A subfamilies.
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Nuclear uptake of the Ah (dioxin) receptor in response to omeprazole: transcriptional activation of the human CYP1A1 gene.
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Contemporary issues in toxicology the role of metabonomics in toxicology and its evaluation by the COMET project
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Disposition and reactivity of ibuprofen and ibufenac acyl glucuronides in vivo in the rhesus monkey and in vitro with human serum albumin.
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Oxidation of the antihistaminic drug terfenadine in human liver microsomes. Role of cytochrome P-450 3A(4) in N-dealkylation and C-hydroxylation.
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The microsomal metabolism and site of covalent binding to protein of 3'-hydroxyacetanilide, a nonhepatotoxic positional isomer of acetaminophen.
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N-Deacetyl ketoconazole-induced hepatotoxicity in a primary culture system of rat hepatocytes
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Peer Reviewed: So What’s the Deal with Metabonomics?
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Metabolic activation of valproic acid and drug-mediated hepatotoxicity. Role of the terminal olefin, 2-n-propyl-4-pentenoic acid
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The Chemistry, Toxicology, and Identification in Rat and Human Urine of 4-Hydroxy-5-phenyl-1,3-oxazaperhydroin-2-one: A Reactive Metabolite in Felbamate Bioactivation
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Studies on the Metabolism of Troglitazone to Reactive Intermediates in Vitro and in Vivo. Evidence for Novel Biotransformation Pathways Involving Quinone Methide Formation and Thiazolidinedione Ring Scission
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The role of calcium in cell killing
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Review of the current status of calcium and thiols in cellular injury
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Common and Uncommon Cytochrome P450 Reactions Related to Metabolism and Chemical Toxicity
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Risk assessment based on high-dose animal exposure experiments
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In Vitro Metabolism of Tolcapone to Reactive Intermediates: Relevance to Tolcapone Liver Toxicity
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Drug−Protein Adducts: An Industry Perspective on Minimizing the Potential for Drug Bioactivation in Drug Discovery and Development
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Dansyl Glutathione as a Trapping Agent for the Quantitative Estimation and Identification of Reactive Metabolites
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Negative Ion Tandem Mass Spectrometry for the Detection of Glutathione Conjugates
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Cyanide Trapping of Iminium Ion Reactive Intermediates Followed by Detection and Structure Identification Using Liquid Chromatography−Tandem Mass Spectrometry (LC-MS/MS)
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Cytosolic and Nuclear Protein Targets of Thiol-Reactive Electrophiles
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Study of the Sequence of Events Involved in Nevirapine-Induced Skin Rash in Brown Norway Rats
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Metabolites and Safety: What Are the Concerns, and How Should We Address Them?
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A Regulatory Perspective on Issues and Approaches in Characterizing Human Metabolites
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Safety Assessment of Drug Metabolites: Characterization of Chemically Stable Metabolites
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Mechanism of Acetaminophen-Induced Hepatotoxicity: Covalent Binding versus Oxidative Stress
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New Concepts in Immunology Relevant to Idiosyncratic Drug Reactions: The “Danger Hypothesis” and Innate Immune System
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Quantitative analysis of complex protein mixtures using isotope-coded affinity tags
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Drug discontinuations in the United Kingdom and the United States, 1964 to 1983: Issues of safety
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Understanding 'Global' Systems Biology: Metabonomics and the Continuum of Metabolism
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Cutting the cost of drug development?
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Can the pharmaceutical industry reduce attrition rates?
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Elucidating mechanisms of drug-induced toxicity
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The nature and identification of quantitative trait loci: a community's view
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Gemtuzumab ozogamicin (Mylotarg) monotherapy for relapsed AML after hematopoietic stem cell transplant: efficacy and incidence of hepatic veno-occlusive disease
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Pharmacokinetics and effect on caffeine metabolism of the proton pump inhibitors, omeprazole, lansoprazole, and pantoprazole
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Lack of drug interaction between omeprazole, lansoprazole, pantoprazole and theophylline
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Protection against electrophile and oxidant stress by induction of the phase 2 response: Fate of cysteines of the Keap1 sensor modified by inducers
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Identification of mouse SLC39A8 as the transporter responsible for cadmium-induced toxicity in the testis
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Portosystemic shunting and persistent fetal vascular structures in aryl hydrocarbon receptor-deficient mice
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Role of CYP2E1 in the Hepatotoxicity of Acetaminophen
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Adipsin, a Biomarker of Gastrointestinal Toxicity Mediated by a Functional γ-Secretase Inhibitor
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JNK- and p38 Kinase-mediated Phosphorylation of Bax Leads to Its Activation and Mitochondrial Translocation and to Apoptosis of Human Hepatoma HepG2 Cells
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A Gene Expression Signature that Predicts the Future Onset of Drug-Induced Renal Tubular Toxicity
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Role of Metabolism in Drug-Induced Idiosyncratic Hepatotoxicity
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Application of Emerging Technologies in Toxicology and Safety Assessment: Regulatory Perspectives
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Data-driven analysis approach for biomarker discovery using molecular-profiling technologies
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The Human Relevance of Information on Carcinogenic Modes of Action: Overview
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Tamoxifen and the induction of cancer
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Paracelsus: Herald of Modern Toxicology
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Characteristic Expression Profiles Induced by Genotoxic Carcinogens in Rat Liver
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A Toxicogenomic Approach to Drug-Induced Phospholipidosis: Analysis of Its Induction Mechanism and Establishment of a Novel in Vitro Screening System
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Metabonomics in Toxicology: A Review
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Metabonomic Identification of Two Distinct Phenotypes in Sprague-Dawley (Crl:CD(SD)) Rats
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Intracellular Signaling Mechanisms of Acetaminophen-Induced Liver Cell Death
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Biotransformation of Halothane, Enflurane, Isoflurane, and Desflurane to Trifluoroacetylated Liver Proteins
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Pharmaceutical innovation by the seven UK‐owned pharmaceutical companies (1964‐1985).
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METABOLIC ACTIVATION OF FLUOROPYRROLIDINE DIPEPTIDYL PEPTIDASE-IV INHIBITORS BY RAT LIVER MICROSOMES
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THE CYP2E1-HUMANIZED TRANSGENIC MOUSE: ROLE OF CYP2E1 IN ACETAMINOPHEN HEPATOTOXICITY
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SEEING THROUGH THE MIST: ABUNDANCE VERSUS PERCENTAGE. COMMENTARY ON METABOLITES IN SAFETY TESTING
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METABOLISM OF NOMIFENSINE TO A DIHYDROISOQUINOLINIUM ION METABOLITE BY HUMAN MYELOPEROXIDASE, HEMOGLOBIN, MONOAMINE OXIDASE A, AND CYTOCHROME P450 ENZYMES
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Coagulation-Dependent Gene Expression and Liver Injury in Rats Given Lipopolysaccharide with Ranitidine but Not with Famotidine
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Identification of toxicologically predictive gene sets using cDNA microarrays
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Exploring the Metabolic and Genetic Control of Gene Expression on a Genomic Scale
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Isoniazid and Iproniazid: Activation of Metabolites to Toxic Intermediates in Man and Rat
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The PAS Superfamily: Sensors of Environmental and Developmental Signals
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Regulatory Mechanisms Controlling Gene Expression Mediated by the Antioxidant Response Element
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Cell Survival Responses to Environmental Stresses Via the Keap1-Nrf2-ARE Pathway
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Idiosyncratic Drug Reactions: Current Understanding
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Anti-liver endoplasmic reticulum autoantibodies are directed against human cytochrome P-450IA2. A specific marker of dihydralazine-induced hepatitis.
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A comprehensive transcript index of the human genome generated using microarrays and computational approaches
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Role of animal models in the study of drug-induced hypersensitivity reactions
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Workgroup Report: Review of Genomics Data Based on Experience with Mock Submissions—View of the CDER Pharmacology Toxicology Nonclinical Pharmacogenomics Subcommittee
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Xenobiotic-Metabolizing Enzymes as Autoantigens in Human Autoimmune Disorders : An Update
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Minimising the potential for metabolic activation in drug discovery
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Inhibition of Terfenadine Metabolism
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A Comprehensive Listing of Bioactivation Pathways of Organic Functional Groups
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Translational Medicine: the Discovery of Bridging Biomarkers Using Pharmacogenomics
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The enhanced biliary secretion of a taurine conjugate in the rat after intraduodenal administration of high doses of fenclozic acid
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Comparative Pharmacokinetic Profile of Two Imidazopyridine Drugs: Zolpidem and Alpidem
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The Metabolism of Xenobiotics to Reactive Electrophiles in Chemical Carcinogenesis and Mutagenesis: A Collaboration with Elizabeth Cavert Miller and our Associates
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Enzymatic activation of chemicals to toxic metabolites
What points at this work
Incoming claims: where this work appears in other papers’ reference lists and arguments.
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Principles of Drug Metabolism
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Toxicogenomics: Applications in In Vitro Systems
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Allergic Reactions to Drugs
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Chemical Mechanisms in Toxicology
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The Role of Drug Metabolism in Drug Discovery
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Linkage Between Toxicology of Drugs and Metabolism
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Allergic Reactions to Drugs
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Chemical Mechanisms in Toxicology
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Safety Assessment in Drug Discovery
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Strategies for the Detection of Reactive Intermediates in Drug Discovery and Development
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Flavin‐Containing Monooxygenase: The Role of Flavin‐Containing Monooxgenase in Lead Design and Selection
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ADME Profiling in Drug Discovery and Development: An Overview
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Drug Metabolism in Drug Safety Evaluation
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Covalent Drug–Protein Adducts: An Exploration of Their Role in Drug‐Induced Liver and General Organ Toxicity
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Metabonomics in Understanding Drug Metabolism and Toxicology
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Role of Metabolism in Toxicity of Drugs in Humans
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ArylamineN‐Acetyltransferases
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Toxicology and Adverse Drug Reactions
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Pharmacological and Toxicological Activity of Drug Metabolites
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In Vitro–In VivoCorrelations in Drug Discovery and Development: Concepts and Applications in Toxicology
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High‐Throughput Toxicity Testing in Drug Development: Aims, Strategies, and Novel Trends
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In Vitro Experimental Models for Studying Drug Biotransformation
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In Vivo Experimental Models for Studying Drug Biotransformation
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Liquid Chromatography‐Mass Spectrometry (LC‐MS) Quantification of Reactive Metabolites
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Allergic Reactions to Drugs
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Chemical Mechanisms in Toxicology
inferred← citeshttps://doi.org/10.1002/9783527621460.ch11openalex-snapshot
Irreversible Cytochrome P450 Inhibition: Common Substructures and Implications for Drug Development
inferred← citeshttps://doi.org/10.1002/9783527628698.hgc125openalex-snapshot
Expanding Rational Molecular Design beyond Pharma: Metrics to Guide Safer Chemical Design
inferred← citeshttps://doi.org/10.1002/9783527651085.ch3openalex-snapshot
Metabolic Stability and Analogue‐Based Drug Discovery
inferred← citeshttps://doi.org/10.1002/9783527673261.ch01openalex-snapshot
Metabolism in Drug Development
inferred← citeshttps://doi.org/10.1002/9783527673643.ch16openalex-snapshot
Clinical and Nonclinical Adverse Effects of Kinase Inhibitors
inferred← citeshttps://doi.org/10.1002/ardp.201900099openalex-snapshot
Design and synthesis of leucine‐linked quinazoline‐4(3H)‐one‐sulphonamide molecules distorting malarial reductase activity in the folate pathway
inferred← citeshttps://doi.org/10.1002/cbdv.200900022openalex-snapshot
The Biochemistry of Drug Metabolism – An Introduction
inferred← citeshttps://doi.org/10.1002/cbdv.200900052openalex-snapshot
Drug Metabolism for the Perplexed Medicinal Chemist
inferred← citeshttps://doi.org/10.1002/chem.201502020openalex-snapshot
Drug Oxidation by Cytochrome P450BM3: Metabolite Synthesis and Discovering New P450 Reaction Types
inferred← citeshttps://doi.org/10.1002/ddr.70162openalex-snapshot
Phytol Enhances Anticonvulsant Effect of Carbamazepine and Diazepam Against PTZ‐Induced Convulsion in Chicks, Possibly Through Voltage‐Gated Sodium Channel and GABA A Interaction Pathways
inferred← citeshttps://doi.org/10.1002/jat.1312openalex-snapshot
Structure–activity relationships for thiol reactivity and rat or human hepatocyte toxicity induced by substituted p ‐benzoquinone compounds
inferred← citeshttps://doi.org/10.1002/jbt.20174openalex-snapshot
Mechanisms of cytochrome P450 substrate oxidation: MiniReview
inferred← citeshttps://doi.org/10.1002/mas.20226openalex-snapshot
The Sod2 mutant mouse as a model for oxidative stress: A functional proteomics perspective
inferred← citeshttps://doi.org/10.1002/med.21273openalex-snapshot
The Generation, Detection, and Effects of Reactive Drug Metabolites
inferred← citeshttps://doi.org/10.1002/minf.202000116openalex-snapshot
Drug‐target‐ADR Network and Possible Implications of Structural Variants in Adverse Events
inferred← citeshttps://doi.org/10.1002/pds.1377openalex-snapshot
Current awareness: Pharmacoepidemiology and drug safety
inferred← citeshttps://doi.org/10.1002/rcm.3117openalex-snapshot
Identification of bupropion urinary metabolites by liquid chromatography/mass spectrometry
inferred← citeshttps://doi.org/10.1002/rcm.3953openalex-snapshot
Rapid detection and characterization of reactive drug metabolites in vitro using several isotope‐labeled trapping agents and ultra‐performance liquid chromatography/time‐of‐flight mass spectrometry
inferred← citeshttps://doi.org/10.1002/rcm.5005openalex-snapshot
Characterization of cyanide‐trapped methylated metabonates formed during reactive drug metabolite screening in vitro
inferred← citeshttps://doi.org/10.1007/978-1-60327-362-6_4openalex-snapshot
Drug-Metabolizing Enzymes
inferred← citeshttps://doi.org/10.1007/978-3-319-50042-3_5openalex-snapshot
Discover Toxicology: An Early Safety Assessment Approach
inferred← citeshttps://doi.org/10.1007/s00204-014-1230-xopenalex-snapshot
Allyl isothiocyanate (AITC) inhibits pregnane X receptor (PXR) and constitutive androstane receptor (CAR) activation and protects against acetaminophen- and amiodarone-induced cytotoxicity
inferred← citeshttps://doi.org/10.1007/s00216-008-2586-7openalex-snapshot
Electrochemistry meets enzymes: instrumental on-line simulation of oxidative and conjugative metabolism reactions of toremifene
inferred← citeshttps://doi.org/10.1007/s00894-011-1105-5openalex-snapshot
CYP isoform specificity toward drug metabolism: analysis using common feature hypothesis
inferred← citeshttps://doi.org/10.1007/s10822-011-9468-3openalex-snapshot
Mixed learning algorithms and features ensemble in hepatotoxicity prediction
inferred← citeshttps://doi.org/10.1007/s10822-011-9479-0openalex-snapshot
In silico prediction of acyl glucuronide reactivity
inferred← citeshttps://doi.org/10.1007/s11030-012-9364-3openalex-snapshot
QSAR classification of metabolic activation of chemicals into covalently reactive species
inferred← citeshttps://doi.org/10.1007/s11356-018-3399-7openalex-snapshot
Zebrafish as an alternative method for determining the embryo toxicity of plant products: a systematic review
inferred← citeshttps://doi.org/10.1007/s12272-011-1108-xopenalex-snapshot
Assessment of reactive metabolites in drug-induced liver injury
inferred← citeshttps://doi.org/10.1007/s40495-018-0144-3openalex-snapshot
LC–MS-Based Metabolomics in the Study of Drug-Induced Liver Injury
inferred← citeshttps://doi.org/10.1016/b978-0-08-046884-6.01127-1openalex-snapshot
Ovarian Metabolism of Xenobiotics
inferred← citeshttps://doi.org/10.1016/b978-0-12-374028-1.00027-0openalex-snapshot
C. Elegans Genetic Strategies to Identify Novel Parkinson's Disease-associated Therapeutic Targets and Leads
inferred← citeshttps://doi.org/10.1016/b978-0-12-374194-3.00002-0openalex-snapshot
Medicinal Chemistry
inferred← citeshttps://doi.org/10.1016/b978-0-12-374194-3.00033-0openalex-snapshot
Biotransformations Leading to Toxic Metabolites
inferred← citeshttps://doi.org/10.1016/b978-0-12-387817-5.00002-9openalex-snapshot
Cytochrome P450 Activation of Toxins and Hepatotoxicity
inferred← citeshttps://doi.org/10.1016/b978-0-12-417205-0.00001-8openalex-snapshot
Medicinal Chemistry
inferred← citeshttps://doi.org/10.1016/b978-0-12-417205-0.00025-0openalex-snapshot
Biotransformations Leading to Toxic Metabolites
inferred← citeshttps://doi.org/10.1016/b978-0-12-801238-3.02155-3openalex-snapshot
Ovarian Metabolism of Xenobiotics
inferred← citeshttps://doi.org/10.1016/b978-0-12-817134-9.00010-6openalex-snapshot
How to reduce risk of drug induced liver toxicity from the beginning
inferred← citeshttps://doi.org/10.1016/b978-0-12-823966-7.00019-0openalex-snapshot
Toxicity testing of natural products using the zebrafish model system
inferred← citeshttps://doi.org/10.1016/b978-0-323-90560-2.00010-8openalex-snapshot
Profiling the reactive metabolites of xenobiotics in cancer
inferred← citeshttps://doi.org/10.1016/b978-0-323-90583-1.00021-0openalex-snapshot
Exploration on different animal models used in drug-induced adverse reactions research; current scenario and further prospectives
inferred← citeshttps://doi.org/10.1016/b978-0-323-95488-4.11008-3openalex-snapshot
Ovarian Metabolism of Xenobiotics
inferred← citeshttps://doi.org/10.1016/j.bcp.2015.07.010openalex-snapshot
Metabolomics reveals the formation of aldehydes and iminium in gefitinib metabolism
inferred← citeshttps://doi.org/10.1016/j.bcp.2018.03.002openalex-snapshot
Identification of enzymes responsible for dantrolene metabolism in the human liver: A clue to uncover the cause of liver injury
inferred← citeshttps://doi.org/10.1016/j.biomaterials.2012.11.029openalex-snapshot
3D spheroid culture of hESC/hiPSC-derived hepatocyte-like cells for drug toxicity testing
inferred← citeshttps://doi.org/10.1016/j.bmc.2010.01.067openalex-snapshot
Novel acyl coenzyme A (CoA): Diacylglycerol acyltransferase-1 inhibitors: Synthesis and biological activities of diacylethylenediamine derivatives
inferred← citeshttps://doi.org/10.1016/j.bmc.2019.06.038openalex-snapshot
Green synthesis, biological evaluation, molecular docking studies and 3D-QSAR analysis of novel phenylalanine linked quinazoline-4(3H)-one-sulphonamide hybrid entities distorting the malarial reductase activity in folate pathway
inferred← citeshttps://doi.org/10.1016/j.bmcl.2009.01.110openalex-snapshot
5-Aminopyrimidin-2-ylnitriles as Cathepsin K inhibitors
inferred← citeshttps://doi.org/10.1016/j.bmcl.2016.06.088openalex-snapshot
Development of a cell viability assay to assess drug metabolite structure–toxicity relationships
inferred← citeshttps://doi.org/10.1016/j.cbi.2008.09.014openalex-snapshot
Recent advances in applications of liquid chromatography–tandem mass spectrometry to the analysis of reactive drug metabolites
inferred← citeshttps://doi.org/10.1016/j.cbi.2010.09.003openalex-snapshot
Handling reactive metabolite positives in drug discovery: What has retrospective structure–toxicity analyses taught us?
inferred← citeshttps://doi.org/10.1016/j.cbi.2011.01.005openalex-snapshot
Overview of strategies for addressing BRIs in drug discovery: Impact on optimization and design
inferred← citeshttps://doi.org/10.1016/j.cbi.2011.05.011openalex-snapshot
Effects of CYP inhibitors on precocene I metabolism and toxicity in rat liver slices
inferred← citeshttps://doi.org/10.1016/j.cbi.2024.110903openalex-snapshot
Role of microsomal metabolism in bromfenac-induced cytotoxicity
inferred← citeshttps://doi.org/10.1016/j.chembiol.2009.12.002openalex-snapshot
Cataloging the Repertoire of Nature's Blowtorch, P450
inferred← citeshttps://doi.org/10.1016/j.chemosphere.2024.142238openalex-snapshot
Computational study on the endocrine-disrupting metabolic activation of Benzophenone-3 catalyzed by cytochrome P450 1A1: A QM/MM approach
inferred← citeshttps://doi.org/10.1016/j.cld.2016.08.002openalex-snapshot
Mechanisms of Drug-Induced Hepatotoxicity
inferred← citeshttps://doi.org/10.1016/j.cotox.2019.01.002openalex-snapshot
Complementing preclinical safety assessments through genomic analyses
inferred← citeshttps://doi.org/10.1016/j.dmpk.2021.100386openalex-snapshot
Development of fluorescent-labeled trapping reagents based on cysteine to detect soft and hard electrophilic reactive metabolites
inferred← citeshttps://doi.org/10.1016/j.drudis.2008.11.002openalex-snapshot
Liquid chromatography–mass spectrometry in in vitro drug metabolite screening
inferred← citeshttps://doi.org/10.1016/j.drudis.2008.11.009openalex-snapshot
The future of drug safety testing: expanding the view and narrowing the focus
inferred← citeshttps://doi.org/10.1016/j.drudis.2009.09.010openalex-snapshot
Computational toxicology—a tool for early safety evaluation
inferred← citeshttps://doi.org/10.1016/j.drudis.2012.01.017openalex-snapshot
Reactions and enzymes in the metabolism of drugs and other xenobiotics
inferred← citeshttps://doi.org/10.1016/j.ejmech.2017.07.051openalex-snapshot
Discovery of cycloalkyl-fused N-thiazol-2-yl-benzamides as tissue non-specific glucokinase activators: Design, synthesis, and biological evaluation
inferred← citeshttps://doi.org/10.1016/j.ejmech.2021.113890openalex-snapshot
Reactive metabolites of the anticonvulsant drugs and approaches to minimize the adverse drug reaction
inferred← citeshttps://doi.org/10.1016/j.electacta.2016.12.089openalex-snapshot
Mechanism of aromatic hydroxylation of lidocaine at a Pt electrode under acidic conditions
inferred← citeshttps://doi.org/10.1016/j.enceco.2026.04.015openalex-snapshot
Precision biotransformation and toxicity assessment of herbicide diquat using computational-experimental synergy
inferred← citeshttps://doi.org/10.1016/j.envpol.2026.129279openalex-snapshot
Mechanistic insight into metabolic activation mechanism of aniline disinfection byproducts catalyzed by P450 enzymes from distinct species: N-hydroxylation mechanism
inferred← citeshttps://doi.org/10.1016/j.ijpharm.2013.09.013openalex-snapshot
The STEP (Safety and Toxicity of Excipients for Paediatrics) database: Part 2 – The pilot version
inferred← citeshttps://doi.org/10.1016/j.jclepro.2025.145116openalex-snapshot
Mechanistic and predictive insights into biodegradation mechanism of Neonicotinoid insecticides by Cytochrome P450 enzymes: N-dealkylation mechanism
inferred← citeshttps://doi.org/10.1016/j.jddst.2025.107027openalex-snapshot
Cocrystal of berberine with its metabolite: a new strategy to improve the physicochemical properties of berberine
inferred← citeshttps://doi.org/10.1016/j.jep.2018.09.002openalex-snapshot
Sagittaria sagittifolia polysaccharide protects against isoniazid- and rifampicin-induced hepatic injury via activation of nuclear factor E2-related factor 2 signaling in mice
inferred← citeshttps://doi.org/10.1016/j.jhazmat.2022.129193openalex-snapshot
Mechanism-driven modeling of chemical hepatotoxicity using structural alerts and an in vitro screening assay
inferred← citeshttps://doi.org/10.1016/j.jpba.2015.07.020openalex-snapshot
Formation of GSH-trapped reactive metabolites in human liver microsomes, S9 fraction, HepaRG-cells, and human hepatocytes
inferred← citeshttps://doi.org/10.1016/j.jsps.2013.02.003openalex-snapshot
Factors affecting the development of adverse drug reactions (Review article)
inferred← citeshttps://doi.org/10.1016/j.lfs.2021.120125openalex-snapshot
Site-specific protein modification by 3-n-butylphthalide in primary hepatocytes: Covalent protein adducts diminished by glutathione and N-acetylcysteine
inferred← citeshttps://doi.org/10.1016/j.lfs.2025.123821openalex-snapshot
The role of machine learning in predictive toxicology: A review of current trends and future perspectives
inferred← citeshttps://doi.org/10.1016/j.pharmthera.2016.10.018openalex-snapshot
Therapeutic applications of dichloroacetate and the role of glutathione transferase zeta-1
inferred← citeshttps://doi.org/10.1016/j.reprotox.2010.05.012openalex-snapshot
The ReProTect Feasibility Study, a novel comprehensive in vitro approach to detect reproductive toxicants
inferred← citeshttps://doi.org/10.1016/j.reprotox.2024.108598openalex-snapshot
Synthetic human gonadal tissues for toxicology
inferred← citeshttps://doi.org/10.1016/j.tips.2013.03.005openalex-snapshot
Can ‘humanized’ mice improve drug development in the 21st century?
inferred← citeshttps://doi.org/10.1016/j.tiv.2008.11.010openalex-snapshot
A 96-well flow cytometric screening assay for detecting in vitro phospholipidosis-induction in the drug discovery phase
inferred← citeshttps://doi.org/10.1016/j.tiv.2014.05.014openalex-snapshot
CYP2E1 induction leads to oxidative stress and cytotoxicity in glutathione-depleted cerebellar granule neurons
inferred← citeshttps://doi.org/10.1016/j.tiv.2015.04.014openalex-snapshot
Drug biokinetic and toxicity assessments in rat and human primary hepatocytes and HepaRG cells within the EU-funded Predict-IV project
inferred← citeshttps://doi.org/10.1016/j.toxlet.2007.12.005openalex-snapshot
Classification structure–activity relationship (CSAR) studies for prediction of genotoxicity of thiophene derivatives
inferred← citeshttps://doi.org/10.1016/j.toxlet.2021.01.002openalex-snapshot
Predicting the reproductive toxicity of chemicals using ensemble learning methods and molecular fingerprints
inferred← citeshttps://doi.org/10.1016/s0065-7743(09)04422-4openalex-snapshot
Chapter 22 Safety Testing of Drug Metabolites
inferred← citeshttps://doi.org/10.1021/ac102317aopenalex-snapshot
High-Throughput Metabolic Toxicity Screening Using Magnetic Biocolloid Reactors and LC−MS/MS
inferred← citeshttps://doi.org/10.1021/ac202280fopenalex-snapshot
Enhanced Screening of Glutathione-Trapped Reactive Metabolites by In-Source Collision-Induced Dissociation and Extraction of Product Ion Using UHPLC-High Resolution Mass Spectrometry
inferred← citeshttps://doi.org/10.1021/acs.chemrestox.5b00364openalex-snapshot
Toxicity Originating from Thiophene Containing Drugs: Exploring the Mechanism using Quantum Chemical Methods
inferred← citeshttps://doi.org/10.1021/acs.chemrestox.5b00410openalex-snapshot
Reactive Metabolites: Current and Emerging Risk and Hazard Assessments
inferred← citeshttps://doi.org/10.1021/acs.chemrestox.6b00336openalex-snapshot
Computational Approach to Structural Alerts: Furans, Phenols, Nitroaromatics, and Thiophenes
inferred← citeshttps://doi.org/10.1021/acs.chemrestox.8b00150openalex-snapshot
Identification of the Novel Capecitabine Metabolites in Capecitabine-Treated Patients with Hand-Foot Syndrome
inferred← citeshttps://doi.org/10.1021/acs.chemrestox.9b00448openalex-snapshot
Synergy between Experiments and Computations: A Green Channel for Revealing Metabolic Mechanism of Xenobiotics in Chemical Toxicology
inferred← citeshttps://doi.org/10.1021/acs.est.1c03036openalex-snapshot
Precision Biotransformation of Emerging Pollutants by Human Cytochrome P450 Using Computational–Experimental Synergy: A Case Study of Tris(1,3-dichloro-2-propyl) Phosphate
inferred← citeshttps://doi.org/10.1021/acs.jcim.4c00159openalex-snapshot
Enhancing Multi-species Liver Microsomal Stability Prediction through Artificial Intelligence
inferred← citeshttps://doi.org/10.1021/acs.jcim.9b00836openalex-snapshot
The Metabolic Rainbow: Deep Learning Phase I Metabolism in Five Colors
inferred← citeshttps://doi.org/10.1021/acs.jmedchem.5b01082openalex-snapshot
Targeting Drug Resistance in EGFR with Covalent Inhibitors: A Structure-Based Design Approach
inferred← citeshttps://doi.org/10.1021/acsomega.8b00443openalex-snapshot
Chemo-Enzymatic Synthesis, Structural and Stereochemical Characterization, and Intrinsic Degradation Kinetics of Diastereomers of 1-β- O -Acyl Glucuronides Derived from Racemic 2-{4-[(2-Methylprop-2-en-1-yl)amino]phenyl}propanoic Acid
inferred← citeshttps://doi.org/10.1021/acsomega.9b02344openalex-snapshot
Lipophilic Metabolic Efficiency (LipMetE) and Drug Efficiency Indices to Explore the Metabolic Properties of the Substrates of Selected Cytochrome P450 Isoforms
inferred← citeshttps://doi.org/10.1021/ja505194wopenalex-snapshot
Design of Reversible, Cysteine-Targeted Michael Acceptors Guided by Kinetic and Computational Analysis
inferred← citeshttps://doi.org/10.1021/jm201346gopenalex-snapshot
Ligand-Based Design of a Potent and Selective Inhibitor of Cytochrome P450 2C19
inferred← citeshttps://doi.org/10.1021/jm3003203openalex-snapshot
Irreversible Protein Kinase Inhibitors: Balancing the Benefits and Risks
inferred← citeshttps://doi.org/10.1021/jm8003202openalex-snapshot
SAR, Pharmacokinetics, Safety, and Efficacy of Glucokinase Activating 2-(4-Sulfonylphenyl)-N-thiazol-2-ylacetamides: Discovery of PSN-GK1
inferred← citeshttps://doi.org/10.1021/jo701547bopenalex-snapshot
An Improved Chemo-Enzymatic Synthesis of 1-β-O-Acyl Glucuronides: Highly Chemoselective Enzymatic Removal of Protecting Groups from Corresponding Methyl Acetyl Derivatives
inferred← citeshttps://doi.org/10.1021/tx200033vopenalex-snapshot
Profiling the Reactive Metabolites of Xenobiotics Using Metabolomic Technologies
inferred← citeshttps://doi.org/10.1021/tx2004147openalex-snapshot
Metabolomic Screening and Identification of the Bioactivation Pathways of Ritonavir
inferred← citeshttps://doi.org/10.1021/tx3002466openalex-snapshot
In Vitro Bioactivation of a Selective Estrogen Receptor Modulator (2S,3R)-(+)-3-(3-Hydroxyphenyl)-2-[4-(2-pyrrolidin-1-ylethoxy)phenyl]-2,3-dihydro-1,4-benzoxathiin-6-ol (I) in Liver Microsomes: Formation of Adenine Adducts
inferred← citeshttps://doi.org/10.1021/tx500504nopenalex-snapshot
Prediction of Drug-Induced Liver Injury in HepG2 Cells Cultured with Human Liver Microsomes
inferred← citeshttps://doi.org/10.1021/tx700079zopenalex-snapshot
Cytochrome P450 and Chemical Toxicology
inferred← citeshttps://doi.org/10.1021/tx7002273openalex-snapshot
Metabolism and Toxicity of Drugs. Two Decades of Progress in Industrial Drug Metabolism
inferred← citeshttps://doi.org/10.1021/tx700319topenalex-snapshot
Toxicological Evaluation of Thiol-Reactive Compounds Identified Using a La Assay To Detect Reactive Molecules by Nuclear Magnetic Resonance
inferred← citeshttps://doi.org/10.1021/tx700430nopenalex-snapshot
Cytochrome P450 Oxidation of the Thiophene-Containing Anticancer Drug 3-[(Quinolin-4-ylmethyl)-amino]-thiophene-2-carboxylic Acid (4-Trifluoromethoxy-phenyl)-amide to an Electrophilic Intermediate
inferred← citeshttps://doi.org/10.1021/tx800008eopenalex-snapshot
Transcriptomic Analysis of Nephrotoxicity Induced by Cephaloridine, a Representative Cephalosporin Antibiotic
inferred← citeshttps://doi.org/10.1021/tx8001115openalex-snapshot
Rapid Screening of Glutathione-Trapped Reactive Metabolites by Linear Ion Trap Mass Spectrometry with Isotope Pattern-Dependent Scanning and Postacquisition Data Mining
inferred← citeshttps://doi.org/10.1021/tx800292mopenalex-snapshot
Structure−Activity Relationships for Degradation Reaction of 1-β- O -Acyl Glucuronides: Kinetic Description and Prediction of Intrinsic Electrophilic Reactivity under Physiological Conditions
inferred← citeshttps://doi.org/10.1021/tx800368nopenalex-snapshot
In Vitro Screening of 50 Highly Prescribed Drugs for Thiol Adduct Formation—Comparison of Potential for Drug-Induced Toxicity and Extent of Adduct Formation
inferred← citeshttps://doi.org/10.1021/tx800407wopenalex-snapshot
Can In Vitro Metabolism-Dependent Covalent Binding Data Distinguish Hepatotoxic from Nonhepatotoxic Drugs? An Analysis Using Human Hepatocytes and Liver S-9 Fraction
inferred← citeshttps://doi.org/10.1021/tx800432copenalex-snapshot
Which Human Metabolites Have We MIST? Retrospective Analysis, Practical Aspects, and Perspectives For Metabolite Identification and Quantification in Pharmaceutical Development
inferred← citeshttps://doi.org/10.1021/tx800439kopenalex-snapshot
Approaches to the Assessment of Stable and Chemically Reactive Drug Metabolites in Early Clinical Trials
inferred← citeshttps://doi.org/10.1021/tx900092zopenalex-snapshot
Structure−Activity Relationships for the Degradation Reaction of 1-β- O -Acyl Glucuronides. Part 2: Electronic and Steric Descriptors Predicting the Reactivity of 1-β- O -Acyl Glucuronides Derived from Benzoic Acids
inferred← citeshttps://doi.org/10.1021/tx900256yopenalex-snapshot
Bioactivation of the Epidermal Growth Factor Receptor Inhibitor Gefitinib: Implications for Pulmonary and Hepatic Toxicities
inferred← citeshttps://doi.org/10.1021/tx9002963openalex-snapshot
Structure−Activity Relationships for the Degradation Reaction of 1-β- O -Acyl Glucuronides. Part 3: Electronic and Steric Descriptors Predicting the Reactivity of Aralkyl Carboxylic Acid 1-β- O -Acyl Glucuronides
inferred← citeshttps://doi.org/10.1021/tx900326kopenalex-snapshot
Cheminformatics Analysis of Assertions Mined from Literature That Describe Drug-Induced Liver Injury in Different Species
inferred← citeshttps://doi.org/10.1038/clpt.2009.283openalex-snapshot
Metabolites in Safety Testing: “MIST” for the Clinical Pharmacologist
inferred← citeshttps://doi.org/10.1038/clpt.2011.55openalex-snapshot
Pharmacological Mechanism-Based Drug Safety Assessment and Prediction
inferred← citeshttps://doi.org/10.1038/nrd3408openalex-snapshot
Managing the challenge of chemically reactive metabolites in drug development
inferred← citeshttps://doi.org/10.1038/nrd4581openalex-snapshot
Predicting drug metabolism: experiment and/or computation?
inferred← citeshttps://doi.org/10.1038/s41467-017-00049-xopenalex-snapshot
A novel humanized mouse lacking murine P450 oxidoreductase for studying human drug metabolism
inferred← citeshttps://doi.org/10.1038/s41598-023-48107-3openalex-snapshot
Making sense of chemical space network shows signs of criticality
inferred← citeshttps://doi.org/10.1039/9781782624202-00257openalex-snapshot
Drug Discovery Approaches for Rare Neuromuscular Diseases
inferred← citeshttps://doi.org/10.1039/9781788018982-00533openalex-snapshot
Discovery Toxicology in Lead Optimization
inferred← citeshttps://doi.org/10.1039/c6ob01771aopenalex-snapshot
Reversibility of the thia-Michael reaction of cytotoxic C 5 -curcuminoid and structure–activity relationship of bis-thiol-adducts thereof
inferred← citeshttps://doi.org/10.1039/c8md00375kopenalex-snapshot
Molecular modelling studies of quinazolinone derivatives as MMP-13 inhibitors by QSAR, molecular docking and molecular dynamics simulations techniques
inferred← citeshttps://doi.org/10.1039/d4ay00577eopenalex-snapshot
Development of a fluorous trapping reagent for rapid detection of electrophilic reactive metabolites
inferred← citeshttps://doi.org/10.1055/s-0040-1710496openalex-snapshot
Dantrolene-Induced Hepatitis: A Rare Culprit in the PICU
inferred← citeshttps://doi.org/10.1080/00498254.2020.1859642openalex-snapshot
Comprehensive identification, fragmentation pattern, and metabolic pathways of gefitinib metabolites via UHPLC-Q-TOF-MS/MS:in vivostudy of rat plasma, urine, bile, and faeces
inferred← citeshttps://doi.org/10.1080/03602532.2026.2620682openalex-snapshot
Relevance of reactive metabolites and covalent binding to drug candidate selection
inferred← citeshttps://doi.org/10.1093/ilar/ilw026openalex-snapshot
Alternative Models of Developmental and Reproductive Toxicity in Pharmaceutical Risk Assessment and the 3Rs
inferred← citeshttps://doi.org/10.1093/toxsci/kfab097openalex-snapshot
Dictyostelium discoideum:An Alternative Nonanimal Model for Developmental Toxicity Testing
inferred← citeshttps://doi.org/10.1093/toxsci/kfp231openalex-snapshot
Weighted Feature Significance: A Simple, Interpretable Model of Compound Toxicity Based on the Statistical Enrichment of Structural Features
inferred← citeshttps://doi.org/10.1093/toxsci/kfv210openalex-snapshot
Identification of a Mitochondrial DNA Polymerase Affecting Cardiotoxicity of Sunitinib Using a Genome-Wide Screening onS. pombeDeletion Library
inferred← citeshttps://doi.org/10.1097/fpc.0b013e32835aa888openalex-snapshot
Identification of drug targets by chemogenomic and metabolomic profiling in yeast
inferred← citeshttps://doi.org/10.1101/315374openalex-snapshot
Synthesis of oxyfunctionalized NSAID metabolites by microbial biocatalysts
inferred← citeshttps://doi.org/10.1111/jam.14342openalex-snapshot
Oxyfunctionalization of nonsteroidal anti‐inflammatory drugs by filamentous‐fungi
inferred← citeshttps://doi.org/10.1124/dmd.107.019018openalex-snapshot
In Vitro Metabolic Activation of Lumiracoxib in Rat and Human Liver Preparations
inferred← citeshttps://doi.org/10.1124/dmd.108.024521openalex-snapshot
Metabolic Activation of Benzodiazepines by CYP3A4
inferred← citeshttps://doi.org/10.1124/dmd.108.025932openalex-snapshot
Characterization of Dasatinib and Its Structural Analogs as CYP3A4 Mechanism-Based Inactivators and the Proposed Bioactivation Pathways
inferred← citeshttps://doi.org/10.1124/dmd.109.030361openalex-snapshot
Cytochrome P450-Mediated Bioactivation of the Epidermal Growth Factor Receptor Inhibitor Erlotinib to a Reactive Electrophile
inferred← citeshttps://doi.org/10.1124/dmd.110.036327openalex-snapshot
CYP3A-Mediated Generation of Aldehyde and Hydrazine in Atazanavir Metabolism
inferred← citeshttps://doi.org/10.1124/dmd.110.037077openalex-snapshot
Development of a Highly Sensitive Cytotoxicity Assay System for CYP3A4-Mediated Metabolic Activation
inferred← citeshttps://doi.org/10.1124/dmd.111.039412openalex-snapshot
Bioactivation Pathways of the Cannabinoid Receptor 1 Antagonist Rimonabant
inferred← citeshttps://doi.org/10.1124/dmd.113.054874openalex-snapshot
CPY3A4-Mediated α-Hydroxyaldehyde Formation in Saquinavir Metabolism
inferred← citeshttps://doi.org/10.1124/dmd.123.001500openalex-snapshot
Construction of Humanized CYP1A2 Rats Using CRISPR/CRISPR-Associated Protein 9 to Promote Drug Metabolism and Pharmacokinetic Research
inferred← citeshttps://doi.org/10.1124/jpet.112.198697openalex-snapshot
Using Chimeric Mice with Humanized Livers to Predict Human Drug Metabolism and a Drug-Drug Interaction
inferred← citeshttps://doi.org/10.1146/annurev-pharmtox-010715-103644openalex-snapshot
Can Humanized Mice Predict Drug “Behavior” in Humans?
inferred← citeshttps://doi.org/10.1146/annurev-pharmtox-010814-124720openalex-snapshot
Predicting Toxicities of Reactive Metabolite–Positive Drug Candidates
inferred← citeshttps://doi.org/10.1177/026119291304100609openalex-snapshot
Adverse Outcome Pathway-based Screening Strategies for an Animal-free Safety Assessment of Chemicals
inferred← citeshttps://doi.org/10.1177/09603271261494653openalex-snapshot
Targeting p66Shc by natural-derived and synthetic compounds in organ toxicity
inferred← citeshttps://doi.org/10.1177/1535370214531872openalex-snapshot
In vitro platforms for evaluating liver toxicity
inferred← citeshttps://doi.org/10.1201/9781420092219-c5openalex-snapshot
Metabolite Identification Strategies and Procedures
inferred← citeshttps://doi.org/10.12692/ijb/4.12.108-116openalex-snapshot
Saccharomyces cerevisiae as a model for the evaluation of dihydropyridine calcium antagonist effects
inferred← citeshttps://doi.org/10.1371/journal.pmed.1001628openalex-snapshot
Fialuridine Induces Acute Liver Failure in Chimeric TK-NOG Mice: A Model for Detecting Hepatic Drug Toxicity Prior to Human Testing
inferred← citeshttps://doi.org/10.1371/journal.pone.0327368openalex-snapshot
Phytol nanoemulsions encapsulated alginate hydrogel beads for the protection and management of alcohol-induced gastric ulcer via nitric oxide synthase and NF-κB/IL-6/TGF-β modulation
inferred← citeshttps://doi.org/10.1515/pac-2016-1205openalex-snapshot
Integral estimation of xenobiotics’ toxicity with regard to their metabolism in human organism
inferred← citeshttps://doi.org/10.1517/17425250802665706openalex-snapshot
Analytical strategies for the screening and evaluation of chemically reactive drug metabolites
inferred← citeshttps://doi.org/10.1517/17425255.2010.530655openalex-snapshot
Challenges and solutions to metabolites in safety testing: impact of the International Conference on Harmonization M3(R2) guidance
inferred← citeshttps://doi.org/10.1517/17425255.2015.1032245openalex-snapshot
Transgenic mice and metabolomics for study of hepatic xenobiotic metabolism and toxicity
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