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Nucleic Acids Research
Article . 2016 . Peer-reviewed
License: CC BY
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Nucleic Acids Research
Article
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PubMed Central
Other literature type . 2017
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The ChEMBL database in 2017

Authors: Gaulton; Anna; Hersey; Anne; Nowotka; Michal; Bento; A. Patricia; Chambers; Jon; Mendez; David; Mutowo; +12 Authors
Abstract

ChEMBL is an open large-scale bioactivity database (https://www.ebi.ac.uk/chembl), previously described in the 2012 and 2014 Nucleic Acids Research Database Issues. Since then, alongside the continued extraction of data from the medicinal chemistry literature, new sources of bioactivity data have also been added to the database. These include: deposited data sets from neglected disease screening; crop protection data; drug metabolism and disposition data and bioactivity data from patents. A number of improvements and new features have also been incorporated. These include the annotation of assays and targets using ontologies, the inclusion of targets and indications for clinical candidates, addition of metabolic pathways for drugs and calculation of structural alerts. The ChEMBL data can be accessed via a web-interface, RDF distribution, data downloads and RESTful web-services.

Keywords

Pharmacology, Crop Protection, Computational Biology, Molecular Sequence Annotation, Web Browser, Search Engine, User-Computer Interface, Gene Ontology, Drug Discovery, Database Issue, Humans, Databases, Nucleic Acid, Databases, Chemical

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    This indicator reflects the "current" impact/attention (the "hype") of an article in the research community at large, based on the underlying citation network.
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    influence
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    This indicator reflects the initial momentum of an article directly after its publication, based on the underlying citation network.
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citations
This is an alternative to the "Influence" indicator, which also reflects the overall/total impact of an article in the research community at large, based on the underlying citation network (diachronically).
BIP!Citations provided by BIP!
popularity
This indicator reflects the "current" impact/attention (the "hype") of an article in the research community at large, based on the underlying citation network.
BIP!Popularity provided by BIP!
influence
This indicator reflects the overall/total impact of an article in the research community at large, based on the underlying citation network (diachronically).
BIP!Influence provided by BIP!
impulse
This indicator reflects the initial momentum of an article directly after its publication, based on the underlying citation network.
BIP!Impulse provided by BIP!
2K
Top 0.01%
Top 0.1%
Top 0.01%
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gold