Dataset: MET
Key Value Description Download
Target MET gene id ###
Name Hepatocyte growth factor receptor protein name ###
Super-family Kinase protein class ###
PDB ID 3lq8 the protein structure in TocoDDB click here
Pocket (x, y, z) -0.84, 3.87, 29.02 the center coordinate of the protein pocket click here
Actives 166 the number of active ligands ###
Topology decoys 8387 the number pf topology decoys click here
Conformation decoys 6028 the number of decoy conformations click here
Decoys 14415 the number of total decoys ###
Total 14581 the size of TocoDDB click here
Source DUDE the source of active ligands ###
Benchmark
Scoring Function TN FP FN TP F1 Score EF0.5% EF1% EF5% ROAUC PRAUC BedROC
InteractionGraphNet 1422 2 5 12 0.774 72.655 72.655 20.014 0.997 0.724 0.926