Cargando…

A New Structure-Activity Relationship (SAR) Model for Predicting Drug-Induced Liver Injury, Based on Statistical and Expert-Based Structural Alerts

The prompt identification of chemical molecules with potential effects on liver may help in drug discovery and in raising the levels of protection for human health. Besides in vitro approaches, computational methods in toxicology are drawing attention. We built a structure-activity relationship (SAR...

Descripción completa

Detalles Bibliográficos
Autores principales:	Pizzo, Fabiola, Lombardo, Anna, Manganaro, Alberto, Benfenati, Emilio
Formato:	Online Artículo Texto
Lenguaje:	English
Publicado:	Frontiers Media S.A. 2016
Materias:	Pharmacology
Acceso en línea:	https://www.ncbi.nlm.nih.gov/pmc/articles/PMC5118449/ https://www.ncbi.nlm.nih.gov/pubmed/27920722 http://dx.doi.org/10.3389/fphar.2016.00442

Ejemplares similares

Identification of structural alerts for liver and kidney toxicity using repeated dose toxicity data
por: Pizzo, Fabiola, et al.
Publicado: (2015)

Quantitative Structure-Activity Relationship Modeling of the Amplex Ultrared Assay to Predict Thyroperoxidase Inhibitory Activity
por: Gadaleta, Domenico, et al.
Publicado: (2021)

SApredictor: An Expert System for Screening Chemicals Against Structural Alerts
por: Hua, Yuqing, et al.
Publicado: (2022)

New Models to Predict the Acute and Chronic Toxicities of Representative Species of the Main Trophic Levels of Aquatic Environments
por: Toma, Cosimo, et al.
Publicado: (2021)

CORAL: model for no observed adverse effect level (NOAEL)
por: Toropov, Andrey A., et al.
Publicado: (2015)

Ligand-based prediction of hERG-mediated cardiotoxicity based on the integration of different machine learning techniques
por: Delre, Pietro, et al.
Publicado: (2022)

LeadOp+R: Structure-Based Lead Optimization With Synthetic Accessibility
por: Lin, Fang-Yu, et al.
Publicado: (2018)

The Early Awareness and Alert System in Sweden: History and Current Status
por: Eriksson, Irene, et al.
Publicado: (2017)

Characteristics of drug safety alerts issued by the Spanish Medicines Agency
por: Montané, Eva, et al.
Publicado: (2023)

The expert system for toxicity prediction of chemicals based on structure-activity relationship.
por: Nakadate, M, et al.
Publicado: (1991)

Identification of hepatoprotective traditional Chinese medicines based on the structure–activity relationship, molecular network, and machine learning techniques
por: He, Shuaibing, et al.
Publicado: (2022)

What Makes a Potent Nitrosamine? Statistical Validation of Expert-Derived Structure–Activity Relationships
por: Thomas, Robert, et al.
Publicado: (2022)

Structure-Activity Relationship (SAR) Model for Predicting Teratogenic Risk of Antiseizure Medications in Pregnancy by Using Support Vector Machine
por: Kang, Liyuan, et al.
Publicado: (2022)

QSAR Models for Human Carcinogenicity: An Assessment Based on Oral and Inhalation Slope Factors
por: Toma, Cosimo, et al.
Publicado: (2020)

Towards an Understanding of the Mode of Action of Human Aromatase Activity for Azoles through Quantum Chemical Descriptors-Based Regression and Structure Activity Relationship Modeling Analysis
por: Chayawan, Chayawan, et al.
Publicado: (2020)

Transport of Aflatoxin M(1) in Human Intestinal Caco-2/TC7 Cells
por: Caloni, Francesca, et al.
Publicado: (2012)

An open source multistep model to predict mutagenicity from statistical analysis and relevant structural alerts
por: Ferrari, Thomas, et al.
Publicado: (2010)

Data-driven identification of structural alerts for mitigating the risk of drug-induced human liver injuries
por: Liu, Ruifeng, et al.
Publicado: (2015)

Exploring Pakistani Physicians' Knowledge and Practices Regarding High Alert Medications: Findings and Implications
por: Mustafa, Zia Ul, et al.
Publicado: (2022)

Structure–Effect Relationships of Novel Semi-Synthetic Cannabinoid Derivatives
por: Götz, Marcus R., et al.
Publicado: (2019)

Bioactivities and Structure–Activity Relationships of Natural Tetrahydroanthraquinone Compounds: A Review
por: Feng, Shixiu, et al.
Publicado: (2020)

Bioactivities and Structure–Activity Relationships of Fusidic Acid Derivatives: A Review
por: Long, Junjun, et al.
Publicado: (2021)

Editorial: Chemoinformatics Approaches to Structure- and Ligand-Based Drug Design
por: Ferreira, Leonardo L. G., et al.
Publicado: (2018)

Feature Selection Using Information Gain for Improved Structural-Based Alert Correlation
por: Alhaj, Taqwa Ahmed, et al.
Publicado: (2016)

Utility of a Laboratory Alert System for Detecting Adverse Drug Reactions in Hospitalised Patients: Hyponatremia and Rhabdomyolysis
por: Valdés-Garicano, Mónica, et al.
Publicado: (2022)

SARS Alert Applicability
Publicado: (2004)

The VEGA Tool to Check the Applicability Domain Gives Greater Confidence in the Prediction of In Silico Models
por: Danieli, Alberto, et al.
Publicado: (2023)

Analysis of the network pharmacology and the structure-activity relationship of glycyrrhizic acid and glycyrrhetinic acid
por: Ni, Qingqiang, et al.
Publicado: (2022)

Editorial: Structure-Based Drug Design for Diagnosis and Treatment of Neurological Diseases
por: Ramsay, Rona R., et al.
Publicado: (2017)

Acetaminophen-Induced Liver Injury Alters the Acyl Ethanolamine-Based Anti-Inflammatory Signaling System in Liver
por: Rivera, Patricia, et al.
Publicado: (2017)

A generalizable definition of chemical similarity for read-across
por: Floris, Matteo, et al.
Publicado: (2014)

The Immunological Mechanisms and Immune-Based Biomarkers of Drug-Induced Liver Injury
por: Liu, Wenhui, et al.
Publicado: (2021)

Mechanism of hydroxysafflor yellow A on acute liver injury based on transcriptomics
por: Hou, Xiangmei, et al.
Publicado: (2022)

The use of structural alerts to avoid the toxicity of pharmaceuticals
por: Limban, Carmen, et al.
Publicado: (2018)

Structure–Activity Relationship of Novel Second-Generation Synthetic Cathinones: Mechanism of Action, Locomotion, Reward, and Immediate-Early Genes
por: Nadal-Gratacós, Nuria, et al.
Publicado: (2021)

Immunostimulatory activity and structure-activity relationship of epimedin B from Epimedium brevicornu Maxim.
por: Gao, Yuan, et al.
Publicado: (2022)

Predicting Structural Details of the Sodium Channel Pore Basing on Animal Toxin Studies
por: Tikhonov, Denis B., et al.
Publicado: (2018)

Structural Based Screening of Antiandrogen Targeting Activation Function-2 Binding Site
por: Liu, Yangguang, et al.
Publicado: (2018)

Discovery of Novel HPK1 Inhibitors Through Structure-Based Virtual Screening
por: Ge, Huizhen, et al.
Publicado: (2022)

Editorial: Chemoinformatics Approaches to Structure- and Ligand-Based Drug Design, Volume II
por: Ferreira, Leonardo L. G., et al.
Publicado: (2022)

Cannot write session to /tmp/vufind_sessions/sess_1lp3vll00eao4r6gv39ug0tlhm