The ChEMBL bioactivity database: an update

被引：1081

作者：

Bento, A. Patricia ^{[1
]}

Gaulton, Anna ^{[1
]}

Hersey, Anne ^{[1
]}

Bellis, Louisa J. ^{[1
]}

Chambers, Jon ^{[1
]}

Davies, Mark ^{[1
]}

Krueger, Felix A. ^{[1
]}

Light, Yvonne ^{[1
]}

Mak, Lora ^{[1
]}

McGlinchey, Shaun ^{[1
]}

Nowotka, Michal ^{[1
]}

Papadatos, George ^{[1
]}

Santos, Rita ^{[1
]}

Overington, John P. ^{[1
]}

机构：

[1] European Bioinformat Inst, European Mol Biol Lab, Hinxton CB10 1SD, Cambs, England

来源：

NUCLEIC ACIDS RESEARCH | 2014年 / 42卷 / D1期

基金：

英国惠康基金; 英国工程与自然科学研究理事会;

关键词：

DRUG DISCOVERY; LIGAND EFFICIENCY; IDENTIFICATION; AGONISTS;

D O I：

10.1093/nar/gkt1031

中图分类号：

Q5 [生物化学]; Q7 [分子生物学];

学科分类号：

071010 ; 081704 ;

摘要：

ChEMBL is an open large-scale bioactivity database (https://www.ebi.ac.uk/chembl), previously described in the 2012 Nucleic Acids Research Database Issue. Since then, a variety of new data sources and improvements in functionality have contributed to the growth and utility of the resource. In particular, more comprehensive tracking of compounds from research stages through clinical development to market is provided through the inclusion of data from United States Adopted Name applications; a new richer data model for representing drug targets has been developed; and a number of methods have been put in place to allow users to more easily identify reliable data. Finally, access to ChEMBL is now available via a new Resource Description Framework format, in addition to the web-based interface, data downloads and web services.

引用

页码：D1083 / D1090

页数：8

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