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Big data and artificial intelligence discover novel drugs targeting proteins without 3D structure and overcome the undruggable targets

Huiqin He, Benquan Liu, Hongyi Luo, Tingting Zhang, Jingwei Jiang
DOI: 10.1136/svn-2019-000323 Published 29 December 2020
Huiqin He
1 Jiangsu Key Lab of Drug Screening, China Pharmaceutical University, Nanjing, China
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Benquan Liu
1 Jiangsu Key Lab of Drug Screening, China Pharmaceutical University, Nanjing, China
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Hongyi Luo
1 Jiangsu Key Lab of Drug Screening, China Pharmaceutical University, Nanjing, China
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Tingting Zhang
1 Jiangsu Key Lab of Drug Screening, China Pharmaceutical University, Nanjing, China
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Jingwei Jiang
2 Institute of Pharmacologic Science, China Pharmaceutical University, Nanjing, China
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Vol 5 Issue 4 Table of Contents
Stroke and Vascular Neurology: 5 (4)
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Big data and artificial intelligence discover novel drugs targeting proteins without 3D structure and overcome the undruggable targets
Huiqin He, Benquan Liu, Hongyi Luo, Tingting Zhang, Jingwei Jiang
Stroke and Vascular Neurology Dec 2020, 5 (4) 381-387; DOI: 10.1136/svn-2019-000323

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Big data and artificial intelligence discover novel drugs targeting proteins without 3D structure and overcome the undruggable targets
Huiqin He, Benquan Liu, Hongyi Luo, Tingting Zhang, Jingwei Jiang
Stroke and Vascular Neurology Dec 2020, 5 (4) 381-387; DOI: 10.1136/svn-2019-000323
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Big data and artificial intelligence discover novel drugs targeting proteins without 3D structure and overcome the undruggable targets
Huiqin He, Benquan Liu, Hongyi Luo, Tingting Zhang, Jingwei Jiang
Stroke and Vascular Neurology Dec 2020, 5 (4) 381-387; DOI: 10.1136/svn-2019-000323
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  • Article
    • Abstract
    • Introduction
    • Target protein database
    • Prediction of protein 3D structures
    • Prediction of ligand-binding sites on protein 3D models
    • Undruggable targets and overcoming undruggable targets
    • Hidden allosteric sites
    • Conclusion remark
    • Footnotes
    • References
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