ToxiVerse Database
Explore over 50,000 chemicals across 16 datasets covering 50+ endpoints mainly related to toxicity. View relevant PubChem bioassays (ranked by active rate) and download any dataset below. Details on collection procedures, sources, and endpoint definitions are under Database → Resources.
Chemical space based on structural principal component analysis
● Compounds with endpoint data in this dataset
● Compounds without endpoint data in this dataset
● Compounds from other datasets
Endpoint data distribution
Relevant Bioassays
Bioassays are ranked by active rate (Active / (Active + Inactive)) for the selected endpoint.
Assays with Active + Inactive ≥500 are included. To stabilize small-sample assays, we used Bayesian-adjusted scores and
retaind up to the top 500 assays per endpoint. Inconclusive results are shown but excluded from calculations.
PubChem Bioassays
| AID | Bioassay Name | Inactive | Inconclusive | Active | Active Rate |
|---|