ChEMBL RDF

ChEMBL is a database of bioactive drug-like small molecules, it contains 2-D structures, calculated properties (e.g. logP, Molecular Weight, Lipinski Parameters, etc.) and abstracted bioactivities (e.g. binding constants, pharmacology and ADMET data). The data is abstracted and curated from the primary scientific literature, and cover a significant fraction of the SAR and discovery of modern drugs.

It is available in RDF form through EMBL-EBI's RDF Platform.

Data and Resources

Additional Info

Field Value
Author EMBL-EBI Chemogenomics Team
Last Updated July 30, 2016, 07:32 (UTC)
Created July 25, 2014, 09:16 (UTC)
example/rdf+xml http://rdf.ebi.ac.uk/resource/chembl/molecule/CHEMBL941
links:identifiers.org 93186
links:uniprotkb 6795
namespace http://rdf.ebi.ac.uk/resource/chembl/
shortname ChEMBL
triples 425304329
comments powered by Disqus
comments powered by Disqus