The cooked meat-derived mammary carcinogen 2-amino-1-methyl-6-phenylimidazo[4,5-b]pyridine (PhIP) elicits estrogenic-like microRNA responses in breast cancer cells. [PDF]
, 2014 The cooking of meat results in the generation of heterocyclic amines (HCA), the most abundant of which is 2-amino-1-methyl-6-phenylimidazo[4,5-b]pyridine (PhIP).
Gooderham, NJ +2 more
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OPERA models for predicting physicochemical properties and environmental fate endpoints
Journal of Cheminformatics, 2018 The collection of chemical structure information and associated experimental data for quantitative structure–activity/property relationship (QSAR/QSPR) modeling is facilitated by an increasing number of public databases containing large amounts of useful
Kamel Mansouri +3 more
doaj +1 more source
Data Quality in Predictive Toxicology: Identification of Chemical Structures and Calculation of Chemical Descriptors [PDF]
, 2000 Every technique for toxicity prediction and for the detection of structure–activity relationships relies on the accurate estimation and representation of chemical and toxicologic properties.
Gottmann, Eva +3 more
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High-throughput AR dimerization assay identifies androgen disrupting chemicals and metabolites
Frontiers in Toxicology, 2023 Introduction: Analysis of streamlined computational models used to predict androgen disrupting chemicals revealed that assays measuring androgen receptor (AR) cofactor recruitment/dimerization were particularly indispensable to high predictivity ...
Evan C. Brown +3 more
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An Ensemble Model of QSAR Tools for Regulatory Risk Assessment [PDF]
, 2016 Quantitative structure activity relationships (QSARs) are theoretical models that relate a quantitative measure of chemical structure to a physical property or a biological effect.
Merrill, Stephen +3 more
core +4 more sources
Progress in computational toxicology
Journal of Pharmacological and Toxicological Methods, 2014 A poster in the ToxI division at the ACS held in SF ...
openaire +4 more sources
A brief overview to systems biology in toxicology: The journey from in to vivo, in-vitro and –omics
Journal of King Saud University: Science, 2021 Toxicology aims to comprehend and envisage the adverse outcomes of chemicals and xenobiotics on the biological system. Predicting toxicity on the biological system is a complex and immense process.
Farizatul Akmawati Yahya +4 more
doaj
Genotoxicity assessment of piperitenone oxide: an in vitro and in silico evaluation [PDF]
, 2017 Piperitenone oxide, a natural flavouring agent also known as rotundifolone, has been studied for the genotoxicity assessment by an integrated in vitro and in silico experimental approach, including the bacterial reverse mutation assay, the micronucleus ...
Abete, Lorena +9 more
core +1 more source
XML in Motion from Genome to Drug [PDF]
, 2007 Information technology (IT) has emerged as a central to the solution of contemporary genomics and drug discovery problems. Researchers involved in genomics, proteomics, transcriptional profiling, high throughput structure determination, and in other sub ...
C. Gopi Mohan
core +2 more sources
Male fathead minnow transcriptomes and associated chemical analytes in the Milwaukee estuary system
Scientific Data, 2022 Measurement(s) transcripts • water chemistry Technology Type(s) RNAseq • GC/MS Factor Type(s) exposure Sample Characteristic - Organism Pimephales promelas Sample Characteristic - Environment estuary system Sample Characteristic - Location Milwaukee, WI,
Natàlia Garcia-Reyero +14 more
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