Screening Chemicals for Receptor-Mediated Toxicological and Pharmacological Endpoints: Using Public Data to Build Screening Tools within a KNIME Workflow

Defining Molecular Initiating Events in the Adverse Outcome Pathway Framework for Risk Assessment

(2014) Timothy E. H. Allen et al.   CHEMICAL RESEARCH IN TOXICOLOGY

Big Data in Chemical Toxicity Research: The Use of High-Throughput Screening Assays To Identify Potential Toxicants

(2014) Hao Zhu et al.   CHEMICAL RESEARCH IN TOXICOLOGY

Endocrine Disruptome—An Open Source Prediction Tool for Assessing Endocrine Disruption Potential through Nuclear Receptor Binding

(2014) Katra Kolšek et al.   Journal of Chemical Information and Modeling

Applying Adverse Outcome Pathways (AOPs) to support Integrated Approaches to Testing and Assessment (IATA)

(2014) Knut Erik Tollefsen et al.   REGULATORY TOXICOLOGY AND PHARMACOLOGY

A framework to facilitate consistent characterization of read across uncertainty

(2014) Karen Blackburn et al.   REGULATORY TOXICOLOGY AND PHARMACOLOGY

Retinoids and their biological effects against cancer

(2013) Fatemeh Alizadeh et al.   INTERNATIONAL IMMUNOPHARMACOLOGY

hERG Me Out

(2013) Paul Czodrowski   Journal of Chemical Information and Modeling

Use of category approaches, read-across and (Q)SAR: General considerations

(2013) Grace Patlewicz et al.   REGULATORY TOXICOLOGY AND PHARMACOLOGY

Development of an Adverse Outcome Pathway From Drug-Mediated Bile Salt Export Pump Inhibition to Cholestatic Liver Injury

(2013) Mathieu Vinken et al.   TOXICOLOGICAL SCIENCES

Applying read-across for quantitative chronic toxicity prediction

(2013) Mark T.D. Cronin et al.   TOXICOLOGY LETTERS

The role of chemistry in developing understanding of adverse outcome pathways and their application in risk assessment

(2013) Steve Gutsell et al.   Toxicology Research

Advances in drug design with RXR modulators

(2012) Belén Vaz et al.   Expert Opinion on Drug Discovery

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

KNIME Workflow to Assess PAINS Filters in SMARTS Format. Comparison of RDKit and Indigo Cheminformatics Libraries

(2011) Simon Saubern et al.   Molecular Informatics

Enhanced steatosis by nuclear receptor ligands: A study in cultured human hepatocytes and hepatoma cells with a characterized nuclear receptor expression profile

(2010) Marta Moya et al.   CHEMICO-BIOLOGICAL INTERACTIONS

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

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

Design and synthesis of novel derivatives of all-transretinoic acid demonstrate the combined importance of acid moiety and conjugated double bonds in its binding to PML–RAR-α oncogene in acute promyelocytic leukemia

(2010) Carolina Schinke et al.   LEUKEMIA & LYMPHOMA

Cheminformatics Analysis of Assertions Mined from Literature That Describe Drug-Induced Liver Injury in Different Species

(2009) Denis Fourches et al.   CHEMICAL RESEARCH IN TOXICOLOGY