6. Source Databases

6.1. Introduction

ComptoxAI does not involve the creation of new data. Instead, it integrates a number of existing datasets relevant to toxicology into a large graph database that aims to span the translational spectrum with regards to mechanisms of toxicity (and related concepts).

Database

Version

Domain(s)

URL

AOP-DB

2.0

Adverse Outcome Pathways

https://doi.org/10.23719/1522396

AOP-Wiki

2.2

Adverse Outcome Pathways

http://aopwiki.org

Drugbank

5.1.8

Drugs (chemicals)

https://go.drugbank.com/releases/latest#open-data

DSSTox

n/a

Chemicals, toxic effects, chemical lists

http://comptox.epa.gov/dashboard

Hetionet

1.0

Multiple (translational)

http://het.io

NCBI Gene

n/a

Genes

https://www.ncbi.nlm.nih.gov/gene

NCBI OMIM

n/a

Disease-Gene associations, phenotypes

https://www.ncbi.nlm.nih.gov/omim

PubChem

n/a

Chemicals

https://pubchem.ncbi.nlm.nih.gov/

Tox21

n/a

Toxicity assays

https://ntp.niehs.nih.gov/whatwestudy/tox21/index.html

In instances where only certain portions of a database are open access,

6.2. References