Kinase Validation Set Download

Eidogen-Sertanty continues to support the scientific research community in many ways, and would like to foster algorithms development and validation worldwide. To this end, we are pleased to make freely available three datasets exported from our popular Kinase Knowledgebase.

Update: High quality, small molecule-activity datasets for kinase research F1000Research. June 14, 2016 (DOI: 10.12688/f1000research.8950.2)

Whether you are developing or improving algorithms for Docking, QSAR, or another technique, we hope you will find this data useful to refine, improve, and compare your methods with others that are available.

This data contains over 3880 molecule structures and corresponding pIC50 data across three Kinase targets: ABL1, SRC, and AURKA - carefully curated from the literature in SDFile format. If you have any questions or comments about the data or the full Kinase Knowledgebase, please e-mail

After you sign-into the guest register, you will be e-mailed a link to download the dataset archive. All we ask in return when you use the data is to please reference the Eidogen-Sertanty Kinase Knowledgebase in your papers, posters, discussion groups, etc. Good luck and happy computing!

By clicking "I Agree", you agree to only use the provided data for research purposes.