From: Synergy conformal prediction applied to large-scale bioactivity datasets and in federated learning
AID | PubChem assay description | Inactive | Active |
---|---|---|---|
Set 1 | |||
411 | qHTS Assay for Inhibitors of Firefly Luciferase | 68,948 | 1555 |
868 | Screen for Chemicals that Inhibit the RAM Network | 190,834 | 3545 |
1030 | qHTS Assay for Inhibitors of Aldehyde Dehydrogenase 1 (ALDH1A1) | 145,732 | 15,914 |
1460 | qHTS for Inhibitors of Tau Fibril Formation, Thioflavin T Binding | 45,834 | 1189 |
1721 | qHTS Assay for Inhibitors of Leishmania Mexicana Pyruvate Kinase (LmPK) | 289,529 | 1087 |
2314 | Cycloheximide Counterscreen for Small Molecule Inhibitors of Shiga Toxin | 258,344 | 36,955 |
2326 | qHTS Assay for Inhibitors of Influenza NS1 Protein Function | 259,823 | 1067 |
2451 | qHTS Assay for Inhibitors of Fructose-1,6-bisphosphate Aldolase from Giardia Lamblia | 272,893 | 2016 |
2551 | qHTS for inhibitors of ROR gamma transcriptional activity | 253,192 | 16,632 |
485290 | qHTS Assay for Inhibitors of Tyrosyl-DNA Phosphodiesterase (TDP1) | 337,970 | 953 |
485314 | qHTS Assay for Inhibitors of DNA Polymerase Beta | 312,599 | 4491 |
504444 | Nrf2 qHTS screen for inhibitors | 283,351 | 7406 |
Set 2 | |||
1814 | MLPCN Alpha-Synuclein 5'UTR—5'-UTR binding—activators | 40,780 | 16,112 |
2314 | Cycloheximide Counterscreen for Small Molecule Inhibitors of Shiga Toxin | 30,586 | 26,306 |
2796 | Luminescence-based primary cell-based high throughput screening assay to identify activators of the Aryl Hydrocarbon Receptor (AHR) | 51,322 | 5570 |
463190 | uHTS identification of small molecule inhibitors of tim10-1 yeast via a luminescent assay | 52,443 | 4449 |
485346 | uHTS for identification of Inhibitors of Mdm2/MdmX interaction in luminescent format | 51,461 | 5431 |
504652 | Antagonist of Human D 1 Dopamine Receptor: qHTS | 50,420 | 6472 |
588726 | Fluorescence-based biochemical primary high throughput screening assay to identify inhibitors of the fructose-bisphosphate aldolase (FBA) of M. tuberculosis | 51,858 | 5034 |
652054 | qHTS of D3 Dopamine Receptor Antagonist: qHTS | 51,857 | 5035 |
687014 | Luminescence-based cell-based primary high throughput screening assay to identify agonists of the DAF-12 from the parasite H. glycines (hgDAF-12) | 52,572 | 4320 |
743279 | qHTS for Inhibitors of Inflammasome Signaling: IL-1-beta AlphaLISA Primary Screen | 47,459 | 9433 |