A review of the use ofin silicomethods to predict the chemistry of molecular initiating events related to drug toxicity

Comparison of QSARs and Characterization of Structural Basis of Bioactivity Using Partial Order Theory and Formal Concept Analysis: A Case Study with Mutagenicity

(2012) Guillermo Restrepo et al.   Current Computer-Aided Drug Design

Bioactivation of Drugs: Risk and Drug Design

(2011) John S. Walsh et al.   Annual Review of Pharmacology and Toxicology

A review of the electrophilic reaction chemistry involved in covalent protein binding relevant to toxicity

(2011) S. J. Enoch et al.   CRITICAL REVIEWS IN TOXICOLOGY

Managing the challenge of chemically reactive metabolites in drug development

(2011) B. Kevin Park et al.   NATURE REVIEWS DRUG DISCOVERY

The resurgence of covalent drugs

(2011) Juswinder Singh et al.   NATURE REVIEWS DRUG DISCOVERY

Acyl glucuronides: the good, the bad and the ugly

(2010) Sophie L. Regan et al.   BIOPHARMACEUTICS & DRUG DISPOSITION

Role of Human GlutathioneS-Transferases in the Inactivation of Reactive Metabolites of Clozapine

(2010) Sanja Dragovic et al.   CHEMICAL RESEARCH IN TOXICOLOGY

Developing Structure−Activity Relationships for the Prediction of Hepatotoxicity

(2010) Nigel Greene et al.   CHEMICAL RESEARCH IN TOXICOLOGY

Mechanistic Category Formation for the Prediction of Respiratory Sensitization

(2010) S. J. Enoch et al.   CHEMICAL RESEARCH IN TOXICOLOGY

Prediction of Michael-Type Acceptor Reactivity toward Glutathione

(2010) Johannes A. H. Schwöbel et al.   CHEMICAL RESEARCH IN TOXICOLOGY

A review of the electrophilic reaction chemistry involved in covalent DNA binding

(2010) S. J. Enoch et al.   CRITICAL REVIEWS IN TOXICOLOGY

In Vitro Evaluation of Potential Hepatotoxicity Induced by Drugs

(2010) M.J. Gomez-Lechon et al.   CURRENT PHARMACEUTICAL DESIGN

Vision & strategy: Predictive ecotoxicology in the 21st century

(2010) Daniel L. Villeneuve et al.   ENVIRONMENTAL TOXICOLOGY AND CHEMISTRY

Adverse outcome pathways: A conceptual framework to support ecotoxicology research and risk assessment

(2010) Gerald T. Ankley et al.   ENVIRONMENTAL TOXICOLOGY AND CHEMISTRY

Hepatotoxicity and hepatic metabolism of available drugs: current problems and possible solutions in preclinical stages

(2010) Shibashish Giri et al.   Expert Opinion on Drug Metabolism & Toxicology

Computational toxicology at the European Commission's Joint Research Centre

(2010) Aleksandra Mostrag-Szlichtyng et al.   Expert Opinion on Drug Metabolism & Toxicology

Improved in silico prediction of carcinogenic potency (TD50) and the risk specific dose (RSD) adjusted Threshold of Toxicological Concern (TTC) for genotoxic chemicals and pharmaceutical impurities

(2010) Joseph F. Contrera   REGULATORY TOXICOLOGY AND PHARMACOLOGY

Can In Vitro Metabolism-Dependent Covalent Binding Data Distinguish Hepatotoxic from Nonhepatotoxic Drugs? An Analysis Using Human Hepatocytes and Liver S-9 Fraction

(2009) Jonathon N. Bauman et al.   CHEMICAL RESEARCH IN TOXICOLOGY

Electrophilic Reaction Chemistry of Low Molecular Weight Respiratory Sensitizers

(2009) Steven J. Enoch et al.   CHEMICAL RESEARCH IN TOXICOLOGY

In Vitro Screening of 50 Highly Prescribed Drugs for Thiol Adduct FormationComparison of Potential for Drug-Induced Toxicity and Extent of Adduct Formation

(2009) Jinping Gan et al.   CHEMICAL RESEARCH IN TOXICOLOGY

Structural Alerts, Reactive Metabolites, and Protein Covalent Binding: How Reliable Are These Attributes as Predictors of Drug Toxicity?

(2009) Amit S. Kalgutkar et al.   CHEMISTRY & BIODIVERSITY

Read-across to rank skin sensitization potential: subcategories for the Michael acceptor domain

(2009) Terry Wayne Schultz et al.   CONTACT DERMATITIS

A Zone Classification System for Risk Assessment of Idiosyncratic Drug Toxicity Using Daily Dose and Covalent Binding

(2009) S. Nakayama et al.   DRUG METABOLISM AND DISPOSITION

Metabolic bioactivation and drug-related adverse effects: current status and future directions from a pharmaceutical research perspective

(2009) Wei Tang et al.   DRUG METABOLISM REVIEWS

Advances in quantitative structure–activity relationship models of antioxidants

(2009) Kunal Roy et al.   Expert Opinion on Drug Discovery

Analytical strategies for the screening and evaluation of chemically reactive drug metabolites

(2009) Bo Wen et al.   Expert Opinion on Drug Metabolism & Toxicology

Identification of structure–activity relationships for adverse effects of pharmaceuticals in humans: Part C: Use of QSAR and an expert system for the estimation of the mechanism of action of drug-induced hepatobiliary and urinary tract toxicities

(2009) Edwin J. Matthews et al.   REGULATORY TOXICOLOGY AND PHARMACOLOGY

Can In Vitro Metabolism-Dependent Covalent Binding Data in Liver Microsomes Distinguish Hepatotoxic from Nonhepatotoxic Drugs? An Analysis of 18 Drugs with Consideration of Intrinsic Clearance and Daily Dose

(2008) R. Scott Obach et al.   CHEMICAL RESEARCH IN TOXICOLOGY

Quantitative and Mechanistic Read Across for Predicting the Skin Sensitization Potential of Alkenes Acting via Michael Addition

(2008) Steven James Enoch et al.   CHEMICAL RESEARCH IN TOXICOLOGY

Structure alerts for carcinogenicity, and the Salmonella assay system: A novel insight through the chemical relational databases technology

(2008) R BENIGNI et al.   MUTATION RESEARCH-REVIEWS IN MUTATION RESEARCH

Identification of mechanisms of toxic action for skin sensitisation using a SMARTS pattern based approach

(2008) S.J. Enoch et al.   SAR AND QSAR IN ENVIRONMENTAL RESEARCH

MultiCASE Expert Systems and the REACH Initiative

(2008) Roustem D. Saiakhov et al.   TOXICOLOGY MECHANISMS AND METHODS

Metabolism and Toxicity of Drugs. Two Decades of Progress in Industrial Drug Metabolism

(2007) Thomas A. Baillie   CHEMICAL RESEARCH IN TOXICOLOGY