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Papers Benchmarks Datasets Tasks

Toxicity Prediction research benchmarks · SOTA2 Research

Toxicity Prediction

Benchmarks

Dataset NameSOTA MethodSort

Dataset NameSOTA methodMetricTrendResultsLast Updated

Tox21 (scaffold)

0.807AUC

46

Feb 26, 2026

TransLipid (test)

Qwen 3-8B w/ LipoAgent

100Toxic Accuracy

22

May 26, 2026

TOXCAST (scaffold)

0.693AUC

11

Feb 26, 2026

TOXCAST (random)

76.3AUC

11

Feb 26, 2026

TOXCAST (index)

0.753AUC

11

Feb 26, 2026

86.2AUC

11

Feb 26, 2026

0.866AUC

11

Feb 26, 2026

Popular datasets

Tox21 ToxCast TransLipid

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