TDC LD50_Zhu

Therapeutics Data Commons ADMET benchmark leaderboard for TDC.LD50_Zhu, reporting MAE on submitted molecular models.

22rows
maeprimary metric
2026-05-28sampled

Metadata

Metrics

MAE (lower is better), MAE Std (lower is better)

Latest Results

Rows are imported from the official TDC.LD50_Zhu TDC ADMET leaderboard and ranked by the source rank.

Rank Subject MAE Model Match Provenance Sampled
1 BaseBoosting KyQVZ6b2 0.552 MAE Imported 2026-05-28
2 ADMETrix 0.573 MAE Imported 2026-05-28
3 MiniMol 0.585 MAE Imported 2026-05-28
4 MACCS keys + autoML 0.588 MAE Imported 2026-05-28
5 Chemprop 0.606 MAE Imported 2026-05-28
6 DeepMol (AutoML) 0.614 MAE Imported 2026-05-28
7 MapLight 0.621 MAE Imported 2026-05-28
8 QuGIN 0.622 MAE Imported 2026-05-28
9 Chemprop-RDKit 0.625 MAE Imported 2026-05-28
10 CFA 0.63 MAE Imported 2026-05-28
11 CMPNN 0.631 MAE Imported 2026-05-28
12 MapLight + GNN 0.633 MAE Imported 2026-05-28
13 Basic ML 0.636 MAE Imported 2026-05-28
14 Euclia ML model 0.646 MAE Imported 2026-05-28
15 GCN 0.649 MAE Imported 2026-05-28
16 Morgan + MLP (DeepPurpose) 0.649 MAE Imported 2026-05-28
17 NeuralFP 0.667 MAE Imported 2026-05-28
18 ContextPred 0.669 MAE Imported 2026-05-28
19 CNN (DeepPurpose) 0.675 MAE Imported 2026-05-28
20 AttentiveFP 0.678 MAE Imported 2026-05-28
21 RDKit2D + MLP (DeepPurpose) 0.678 MAE Imported 2026-05-28
22 AttrMasking 0.685 MAE Imported 2026-05-28