AiZynth impact on medicinal chemistry practice at AstraZeneca-Reference-Cited by-同舟云学术

AiZynth impact on medicinal chemistry practice at AstraZeneca

Published:2024 Issue:4 Volume:15 Page:1085-1095
ISSN:2632-8682
Container-title:RSC Medicinal Chemistry
language:en
Short-container-title:RSC Med. Chem.

Author:

Shields Jason D.¹^ORCID,Howells Rachel²^ORCID,Lamont Gillian²,Leilei Yin³,Madin Andrew⁴,Reimann Christopher E.¹,Rezaei Hadi¹,Reuillon Tristan⁵^ORCID,Smith Bryony²,Thomson Clare²^ORCID,Zheng Yuting³,Ziegler Robert E.¹^ORCID

Affiliation:

1. Early Oncology R&D, AstraZeneca, 35 Gatehouse Drive, Waltham, MA, 02451, USA

2. Early Oncology R&D, AstraZeneca, 1 Francis Crick Avenue, Cambridge CB2 0AA, UK

3. Pharmaron Beijing Co., Ltd., 6 Taihe Road BDA, Beijing, 100176, P.R. China

4. Discovery Sciences, AstraZeneca, 1 Francis Crick Avenue, Cambridge CB2 0AA, UK

5. Respiratory & Immunology, BioPharmaceuticals R&D, AstraZeneca, Pepparedsleden 1, 43183 Mölndal, Sweden

Abstract

The AI retrosynthesis tool AiZynth has made positive impacts on AstraZeneca drug discovery projects. This opinion provides some examples and discusses how AI retrosynthesis fits into pharmaceutical research.

Publisher

Royal Society of Chemistry (RSC)

Link

http://pubs.rsc.org/en/content/articlepdf/2024/MD/D3MD00651D

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4. AiZynthFinder 4.0: developments based on learnings from 3 years of industrial application;Journal of Cheminformatics;2024-05-23

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