4.8 Article

PubChem 2023 update

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NUCLEIC ACIDS RESEARCH
卷 51, 期 D1, 页码 D1373-D1380

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OXFORD UNIV PRESS
DOI: 10.1093/nar/gkac956

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PubChem, a popular chemical information resource, has undergone several changes and improvements. It has added data from over 120 sources and introduced new functionalities, including the integration of Google Patents data, creation of Cell Line and Taxonomy data collections, and updates to the bioassay data model.
PubChem (https://pubchem.ncbi.nlm.nih.gov) is a popular chemical information resource that serves a wide range of use cases. In the past two years, a number of changes were made to PubChem. Data from more than 120 data sources was added to PubChem. Some major highlights include: the integration of Google Patents data into PubChem, which greatly expanded the coverage of the PubChem Patent data collection; the creation of the Cell Line and Taxonomy data collections, which provide quick and easy access to chemical information for a given cell line and taxon, respectively; and the update of the bioassay data model. In addition, new functionalities were added to the PubChem programmatic access protocols, PUG-REST and PUG-View, including support for target-centric data download for a given protein, gene, pathway, cell line, and taxon and the addition of the 'standardize' option to PUG-REST, which returns the standardized form of an input chemical structure. A significant update was also made to Pub-ChemRDF. The present paper provides an overview of these changes.

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