Publications by authors named "Anna Gaulton"

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The ChEMBL Database in 2023: a drug discovery platform spanning multiple bioactivity data types and time periods.
Barbara Zdrazil, Eloy Felix, Fiona Hunter, Emma J Manners, James Blackshaw, Anna Gaulton

Nucleic Acids Res· January 2024

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Illuminating the druggable genome through patent bioactivity data.
Maria P Magariños, Anna Gaulton, Eloy Félix, Tevfik Kiziloren, Ricardo Arcila

PeerJ· May 2023

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Biomedical data analyses facilitated by open cheminformatics workflows.
Eva Nittinger, Alex Clark, Anna Gaulton, Barbara Zdrazil

J Cheminform· April 2023

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Validation of lipid-related therapeutic targets for coronary heart disease prevention using human genetics.
María Gordillo-Marañón, Magdalena Zwierzyna, Pimphen Charoen, Fotios Drenos, Sandesh Chopade, Anna Gaulton

Nat Commun· October 2021

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Target-Based Evaluation of "Drug-Like" Properties and Ligand Efficiencies.
Paul D Leeson, A Patricia Bento, Anna Gaulton, Anne Hersey, Emma J Manners

J Med Chem· June 2021

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Actionable druggable genome-wide Mendelian randomization identifies repurposing opportunities for COVID-19.
Liam Gaziano, Claudia Giambartolomei, Alexandre C Pereira, Anna Gaulton, Daniel C Posner

Nat Med· April 2021

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Drug Safety Data Curation and Modeling in ChEMBL: Boxed Warnings and Withdrawn Drugs.
Fiona M I Hunter, A Patrícia Bento, Nicolas Bosc, Anna Gaulton, Anne Hersey

Chem Res Toxicol· February 2021

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An open source chemical structure curation pipeline using RDKit.
A Patrícia Bento, Anne Hersey, Eloy Félix, Greg Landrum, Anna Gaulton

J Cheminform· September 2020

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The Global Phosphorylation Landscape of SARS-CoV-2 Infection.
Mehdi Bouhaddou, Danish Memon, Bjoern Meyer, Kris M White, Veronica V Rezelj, Anna Gaulton

Cell· August 2020

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Improving the odds of drug development success through human genomics: modelling study.
Aroon D Hingorani, Valerie Kuan, Chris Finan, Felix A Kruger, Anna Gaulton

Sci Rep· December 2019

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Reply to "Missed opportunities in large scale comparison of QSAR and conformal prediction methods and their applications in drug discovery".
Nicolas Bosc, Francis Atkinson, Eloy Félix, Anna Gaulton, Anne Hersey

J Cheminform· November 2019

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ChEMBL: towards direct deposition of bioassay data.
David Mendez, Anna Gaulton, A Patrícia Bento, Jon Chambers, Marleen De Veij

Nucleic Acids Res· January 2019

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Large scale comparison of QSAR and conformal prediction methods and their applications in drug discovery.
Nicolas Bosc, Francis Atkinson, Eloy Felix, Anna Gaulton, Anne Hersey

J Cheminform· January 2019

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A large-scale dataset of in vivo pharmacology assay results.
Fiona M I Hunter, Francis L Atkinson, A Patrícia Bento, Nicolas Bosc, Anna Gaulton

Sci Data· October 2018

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Unexplored therapeutic opportunities in the human genome.
Tudor I Oprea, Cristian G Bologa, Søren Brunak, Allen Campbell, Gregory N Gan, Anna Gaulton

Nat Rev Drug Discov· May 2018

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Unexplored therapeutic opportunities in the human genome.
Tudor I Oprea, Cristian G Bologa, Søren Brunak, Allen Campbell, Gregory N Gan, Anna Gaulton

Nat Rev Drug Discov· May 2018

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Using ChEMBL web services for building applications and data processing workflows relevant to drug discovery.
Michał M Nowotka, Anna Gaulton, David Mendez, A Patricia Bento, Anne Hersey

Expert Opin Drug Discov· August 2017

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The druggable genome and support for target identification and validation in drug development.
Chris Finan, Anna Gaulton, Felix A Kruger, R Thomas Lumbers, Tina Shah

Sci Transl Med· March 2017

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The ChEMBL database in 2017.
Anna Gaulton, Anne Hersey, Michał Nowotka, A Patrícia Bento, Jon Chambers

Nucleic Acids Res· January 2017

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Open Targets: a platform for therapeutic target identification and validation.
Gautier Koscielny, Peter An, Denise Carvalho-Silva, Jennifer A Cham, Luca Fumis, Anna Gaulton

Nucleic Acids Res· January 2017

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Pharos: Collating protein information to shed light on the druggable genome.
Dac-Trung Nguyen, Stephen Mathias, Cristian Bologa, Soren Brunak, Nicolas Fernandez, Anna Gaulton

Nucleic Acids Res· January 2017

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A comprehensive map of molecular drug targets.
Rita Santos, Oleg Ursu, Anna Gaulton, A Patrícia Bento, Ramesh S Donadi

Nat Rev Drug Discov· January 2017

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A drug target slim: using gene ontology and gene ontology annotations to navigate protein-ligand target space in ChEMBL.
Prudence Mutowo, A Patrícia Bento, Nathan Dedman, Anna Gaulton, Anne Hersey

J Biomed Semantics· September 2016

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SureChEMBL: a large-scale, chemically annotated patent document database.
George Papadatos, Mark Davies, Nathan Dedman, Jon Chambers, Anna Gaulton

Nucleic Acids Res· January 2016

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Managing expectations: assessment of chemistry databases generated by automated extraction of chemical structures from patents.
Stefan Senger, Luca Bartek, George Papadatos, Anna Gaulton

J Cheminform· December 2015

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