|ChEMBLdb ||22_1 ||November 2016 ||ChEMBL Database downloads, which includes Oracle, MySQL and PostgreSQL versions of the ChEMBL database, as well as SDF, FASTA and release note files. Main website link here.|
|SureChEMBL ||Q2 2016 ||July 2016 ||SureChEMBL quarterly compound exports and map files (see also here). Main website link here.|
|UniChem ||UDRI(loading...) ||(loading...) ||Data dumps from UniChem. Includes source maps, Oracle exports and KNIME protocols. Main website link here. Number of structures: (loading...)|
|myChEMBL ||20.0 ||July 2015 ||myChEMBL is a version of ChEMBL built using Open Source software (Ubuntu, PostgreSQL, RDKit) and is distributed as a Virtual Machine, more details here.|
|ChEMBL-RDF ||20.0 ||February 2016 ||RDF Version of ChEMBL database. The file download format is turtle and the minor version number corresponds to changes in RDF format and not the underlying ChEMBL data.|
|ChEMBLNTD ||NA ||February 2016 ||Datasets made available via the ChEMBL-NTD website. Current dataset contribuotors include GSK, Novartis, St. Jude Children's Research Hospital, DNDi, Harvard Medical School and TropIQ Health Sciences. Main website link here.|
|MalariaData ||2.0 ||January 2013 ||Release notes for Malaria Data website, a searchable database which contains compounds, targets and assays related to malaria. Main website link here.|
|DrugEBIlity ||3.0 ||September 2012 ||Flatfile downloads for DrugEBIlity system. Main website link here.|
|GPCRSARfari ||3.00 ||June 2012 ||Flatfile downloads for GPCR SARfari system. Main website link here.|
|KinaseSARfari ||5.01 ||December 2011 ||Flatfile downloads for Kinase SARfari system. Main website link here.|
|VEHICLe ||1.0 ||April 2010 ||Dataset described in 'Heteroaromatic Rings of the Future', by Pitt et al., more details here.|
ChEMBL Database Release DOIs
To reference a specific release of the ChEMBL Database, please use DOI in table below.
ChEMBL-RDF Release DOIs
To reference a specific release of the ChEMBL-RDF, please use DOI in table below.
myChEMBL Release DOIs
To reference a specific release of myChEMBL, please use DOI in table below.