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Collaborative anti-tumor multi-drug combination effect prediction method based on deep learning

A technology of deep learning and prediction methods, applied in neural learning methods, genomics, drugs or prescriptions, etc., can solve the problem that machine learning methods cannot automatically learn feature information, lack of modeling data, and poor prediction accuracy of new synergistic drug combinations, etc. question

Pending Publication Date: 2020-06-02
JIANGSU UNIV
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Problems solved by technology

[0003] With the development of information technology, domestic and foreign scholars have begun to try to establish a machine learning calculation model based on compound structure information, and predict the combination of synergistic anti-tumor drugs by calculating the similarity between compound structures, but they often face the following problems: 1 ) This method is only suitable for the prediction of synergy between two drugs, and cannot predict the synergy between three or more drugs; 2) lack of sufficient modeling data, the prediction accuracy of new synergistic drug combinations Poor; 3) It is impossible to screen out specific synergistic drug combinations for a given tumor cell; 4) Traditional machine learning methods cannot automatically learn feature information from big data, requiring a lot of manual feature selection

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  • Collaborative anti-tumor multi-drug combination effect prediction method based on deep learning
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  • Collaborative anti-tumor multi-drug combination effect prediction method based on deep learning

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Embodiment Construction

[0064] In order to make the purpose, technical solution and advantages of the present invention clearer, the technical solution of the present invention will be further described below in conjunction with the accompanying drawings.

[0065] A specific technical solution of a method for predicting the effect of synergistic anti-tumor multi-drug combinations based on deep learning is:

[0066] 1. The gene expression data of 1000 tumor cells after the action of 265 compounds determined by Affymetrix Human Genome U219 chip were collected from the ArrayExpress database. Among them, 1000 kinds of tumor cells came from 11289 kinds of tumors in 29 different tissues. Based on the R language and the Bioconductor R package, a series of statistical data cleaning was performed on the original gene expression data of 1000 tumor cells, and the final gene expression profile was constructed for modeling. First, the missing and invalid values ​​of gene expression were filled by the Impute pack...

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Abstract

The invention provides a collaborative anti-tumor multi-drug combination effect prediction method based on a deep learning algorithm and pharmacogenomics. The collaborative anti-tumor multi-drug combination effect prediction method comprises the following steps: (1) mining and preprocessing large-scale pharmacogenomics data; (2) effectively integrating different feature information and constructing a modeling sample; (3) constructing a collaborative anti-tumor multi-drug combination prediction model based on large-scale sample data and a deep learning algorithm; and (4) performing parameter optimization and performance improvement of the model. According to the method, an artificial intelligence deep learning algorithm and pharmacogenomics are effectively combined, the limitation that a traditional collaborative drug combination prediction method can only be used for predicting the synergistic effect between every two drugs is overcome, and the specific collaborative anti-tumor multi-drug combination can be screened out for different tumor cells through the gene level; therefore, theoretical basis and technical support are provided for solving the problem of tumor drug resistance,and more effective treatment schemes are further provided for clinical tumor treatment.

Description

technical field [0001] The present invention relates to the field of computer-aided drug screening, in particular to a method for predicting the effect of synergistic anti-tumor multi-drug combinations based on deep learning and pharmacogenomics, which is suitable for different drugs based on tumor cell gene expression data and drug target information. Tumor cells screen out specific drug combinations with synergistic anti-tumor effects. Background technique [0002] Cancer is a major disease that seriously threatens human life and health, and its mortality rate ranks second only to cardiovascular diseases. The main treatment methods for tumors are surgical treatment, radiotherapy and drug therapy. At present, drug therapy is still an important means of tumor treatment. Due to the variety of tumor pathogenic factors, its development process is complex and regulated by many factors, the treatment of a single drug can easily cause the human body to develop a drug-resistant ph...

Claims

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Application Information

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IPC IPC(8): G16H70/40G16H20/10G16B20/00G16B25/00G06N3/04G06N3/08
CPCG16H70/40G16H20/10G16B20/00G16B25/00G06N3/08G06N3/045
Inventor 冯春来陈恒巍季薇芮蒙杰
Owner JIANGSU UNIV
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