Published in
Oxford University Press, Nucleic Acids Research, D1(40), p. D1100-D1107, 2011
DOI: 10.1093/nar/gkr777
Links
- ORCID
- ORCID
- Oxford University Press
- [www.ncbi.nlm.nih.gov] | PDF
- [europepmc.org] | PDF
- [www.researchgate.net] | PDF
- [www.ncbi.nlm.nih.gov] | PDF
- [www.ncbi.nlm.nih.gov] | PDF
Tools
ChEMBL: a large-scale bioactivity database for drug discovery
,
A. Patricia Bento,
Jon Chambers,
Mark Davies,
Anne Hersey ,
Yvonne Light,
Shaun McGlinchey,
David Michalovich,
Bissan Al-Lazikani,
John P. Overington
Full text: Download
Abstract
ChEMBL is an Open Data database containing binding, functional and ADMET information for a large number of drug-like bioactive compounds. These data are manually abstracted from the primary published literature on a regular basis, then further curated and standardized to maximize their quality and utility across a wide range of chemical biology and drug-discovery research problems. Currently, the database contains 5.4 million bioactivity measurements for more than 1 million compounds and 5200 protein targets. Access is available through a web-based interface, data downloads and web services at: https://www.ebi.ac.uk/chembldb.