The full dataset and the supporting files were uploaded in CSV format to . The dataset and its subsets are available for all ChEMBL versions from 26 to 33. For each ChEMBL version, the dataset is available based exclusively on literature sources ('literature_only') and based on all available sources ('all_sources'). All datasets and subsets include the RDKit-based compound properties. Semicolons are used as delimiters in all CSV files. The available files relevant for this work are described below.