Single-instance Prediction Datasets Menu

Task Dataset
ADME
  • Absorption: Caco2_Wang, HIA_Hou, Pgp_Broccatelli, Bioavailability_Ma, Lipophilicity_AstraZeneca, Solubility_AqSolDB, HydrationFreeEnergy_FreeSolv
  • Distribution: BBB_Martins, PPBR_AZ, VDss_Lombardo
  • Metabolism: CYP2C19_Veith, CYP2D6_Veith, CYP3A4_Veith, CYP_1A2_Veith, CYP2C9_Veith, CYP2C9_Substrate_CarbonMangels, CYP2D6_Substrate_CarbonMangels, CYP3A4_Substrate_CarbonMangels
  • Execretion: Half_Life_Obach, Clearance_Hepatocyte_AZ, Clearance_Microsome_AZ
Tox hERG, AMES, DILI, Skin Reaction, LD50_Zhu, Carcinogens_Lagunin, ToxCast, Tox21, ClinTox
HTS HIV, SARSCoV2_3CLPro_Diamond, SARSCoV2_Vitro_Touret
QM QM7b, QM8, QM9
Yields Buchwald-Hartwig, USPTO
Paratope SAbDab_Liberis
Epitope IEDB_Jespersen, PDB_Jespersen
Develop TAP, SAbDab_Chen
CRISPROutcome Leenay