Skip to main page content
U.S. flag

An official website of the United States government

Dot gov

The .gov means it’s official.
Federal government websites often end in .gov or .mil. Before sharing sensitive information, make sure you’re on a federal government site.

Https

The site is secure.
The https:// ensures that you are connecting to the official website and that any information you provide is encrypted and transmitted securely.

Access keys NCBI Homepage MyNCBI Homepage Main Content Main Navigation
. 2019 May;18(5):418-422.
doi: 10.1038/s41563-019-0332-5.

Opportunities and challenges using artificial intelligence in ADME/Tox

Barun Bhhatarai  1 , W Patrick Walters  2 , Cornelis E C A Hop  3 , Guido Lanza  4 , Sean Ekins  5
Affiliations

Opportunities and challenges using artificial intelligence in ADME/Tox

Barun Bhhatarai et al. Nat Mater. 2019 May.

Abstract

A recent conference organized a panel of scientists representing small and big pharma companies, who work at the interface of machine learning (ML) and absorption, distribution, metabolism, excretion, and toxicology (ADME/Tox). With the recent rebirth of AI related to pharma, it is timely to present this collaborative commentary to capture the diverging opinions on the past, present and future role of AI for ADME/Tox and how it can be applied in newer areas such as nanomaterials.

PubMed Disclaimer

References

    1. Gupta RR et al. Drug Metab Dispos 38, 2083–2090 (2010). - PubMed
    1. Ekins S, Honeycutt JD& Metz JT Drug Discov Today 15, 451–460 (2010). - PubMed
    1. Page KM Mol Pharm 13, 609–620 (2016). - PubMed
    1. Webborn PJ Future Med Chem 6, 1233–1235 (2014). - PubMed
    1. Zientek M et al. Chem Res Toxicol 23, 664–676 (2010). - PubMed

Publication types