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Combining biomedical knowledge graphs and text to improve predictions for drug-target interactions and drug-indications

Biomedical knowledge is represented in structured databases and published in biomedical literature, and different computational approaches have been developed to exploit each type of information in predictive models. However, the information in structured databases and literature is often complement...

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Autores principales: Alshahrani, Mona, Almansour, Abdullah, Alkhaldi, Asma, Thafar, Maha A., Uludag, Mahmut, Essack, Magbubah, Hoehndorf, Robert
Formato: Online Artículo Texto
Lenguaje:English
Publicado: PeerJ Inc. 2022
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8988936/
https://www.ncbi.nlm.nih.gov/pubmed/35402106
http://dx.doi.org/10.7717/peerj.13061
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author Alshahrani, Mona
Almansour, Abdullah
Alkhaldi, Asma
Thafar, Maha A.
Uludag, Mahmut
Essack, Magbubah
Hoehndorf, Robert
author_facet Alshahrani, Mona
Almansour, Abdullah
Alkhaldi, Asma
Thafar, Maha A.
Uludag, Mahmut
Essack, Magbubah
Hoehndorf, Robert
author_sort Alshahrani, Mona
collection PubMed
description Biomedical knowledge is represented in structured databases and published in biomedical literature, and different computational approaches have been developed to exploit each type of information in predictive models. However, the information in structured databases and literature is often complementary. We developed a machine learning method that combines information from literature and databases to predict drug targets and indications. To effectively utilize information in published literature, we integrate knowledge graphs and published literature using named entity recognition and normalization before applying a machine learning model that utilizes the combination of graph and literature. We then use supervised machine learning to show the effects of combining features from biomedical knowledge and published literature on the prediction of drug targets and drug indications. We demonstrate that our approach using datasets for drug-target interactions and drug indications is scalable to large graphs and can be used to improve the ranking of targets and indications by exploiting features from either structure or unstructured information alone.
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spelling pubmed-89889362022-04-08 Combining biomedical knowledge graphs and text to improve predictions for drug-target interactions and drug-indications Alshahrani, Mona Almansour, Abdullah Alkhaldi, Asma Thafar, Maha A. Uludag, Mahmut Essack, Magbubah Hoehndorf, Robert PeerJ Computational Biology Biomedical knowledge is represented in structured databases and published in biomedical literature, and different computational approaches have been developed to exploit each type of information in predictive models. However, the information in structured databases and literature is often complementary. We developed a machine learning method that combines information from literature and databases to predict drug targets and indications. To effectively utilize information in published literature, we integrate knowledge graphs and published literature using named entity recognition and normalization before applying a machine learning model that utilizes the combination of graph and literature. We then use supervised machine learning to show the effects of combining features from biomedical knowledge and published literature on the prediction of drug targets and drug indications. We demonstrate that our approach using datasets for drug-target interactions and drug indications is scalable to large graphs and can be used to improve the ranking of targets and indications by exploiting features from either structure or unstructured information alone. PeerJ Inc. 2022-04-04 /pmc/articles/PMC8988936/ /pubmed/35402106 http://dx.doi.org/10.7717/peerj.13061 Text en ©2022 Alshahrani et al. https://creativecommons.org/licenses/by/4.0/This is an open access article distributed under the terms of the Creative Commons Attribution License (https://creativecommons.org/licenses/by/4.0/) , which permits unrestricted use, distribution, reproduction and adaptation in any medium and for any purpose provided that it is properly attributed. For attribution, the original author(s), title, publication source (PeerJ) and either DOI or URL of the article must be cited.
spellingShingle Computational Biology
Alshahrani, Mona
Almansour, Abdullah
Alkhaldi, Asma
Thafar, Maha A.
Uludag, Mahmut
Essack, Magbubah
Hoehndorf, Robert
Combining biomedical knowledge graphs and text to improve predictions for drug-target interactions and drug-indications
title Combining biomedical knowledge graphs and text to improve predictions for drug-target interactions and drug-indications
title_full Combining biomedical knowledge graphs and text to improve predictions for drug-target interactions and drug-indications
title_fullStr Combining biomedical knowledge graphs and text to improve predictions for drug-target interactions and drug-indications
title_full_unstemmed Combining biomedical knowledge graphs and text to improve predictions for drug-target interactions and drug-indications
title_short Combining biomedical knowledge graphs and text to improve predictions for drug-target interactions and drug-indications
title_sort combining biomedical knowledge graphs and text to improve predictions for drug-target interactions and drug-indications
topic Computational Biology
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8988936/
https://www.ncbi.nlm.nih.gov/pubmed/35402106
http://dx.doi.org/10.7717/peerj.13061
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