GraphIsoFun: a graph neural network based approach for splice isoform function prediction

Author(s):  
Shuo Zhang ◽  
Changhuo Yang ◽  
Hong-Dong Li ◽  
Jianxin Wang
Molecules ◽  
2017 ◽  
Vol 22 (10) ◽  
pp. 1732 ◽  
Author(s):  
Renzhi Cao ◽  
Colton Freitas ◽  
Leong Chan ◽  
Miao Sun ◽  
Haiqing Jiang ◽  
...  

2017 ◽  
Author(s):  
Evangelia I Zacharaki

Background. The availability of large databases containing high resolution three-dimensional (3D) models of proteins in conjunction with functional annotation allows the exploitation of advanced supervised machine learning techniques for automatic protein function prediction. Methods. In this work, novel shape features are extracted representing protein structure in the form of local (per amino acid) distribution of angles and amino acid distances, respectively. Each of the multi-channel feature maps is introduced into a deep convolutional neural network (CNN) for function prediction and the outputs are fused through Support Vector Machines (SVM) or a correlation-based k-nearest neighbor classifier. Two different architectures are investigated employing either one CNN per multi-channel feature set, or one CNN per image channel. Results. Cross validation experiments on enzymes (n = 44,661) from the PDB database achieved 90.1% correct classification demonstrating the effectiveness of the proposed method for automatic function annotation of protein structures. Discussion. The automatic prediction of protein function can provide quick annotations on extensive datasets opening the path for relevant applications, such as pharmacological target identification.


2019 ◽  
Vol 9 (1) ◽  
Author(s):  
Aashish Jain ◽  
Daisuke Kihara

AbstractWith advancements in synthetic biology, the cost and the time needed for designing and synthesizing customized gene products have been steadily decreasing. Many research laboratories in academia as well as industry routinely create genetically engineered proteins as a part of their research activities. However, manipulation of protein sequences could result in unintentional production of toxic proteins. Therefore, being able to identify the toxicity of a protein before the synthesis would reduce the risk of potential hazards. Existing methods are too specific, which limits their application. Here, we extended general function prediction methods for predicting the toxicity of proteins. Protein function prediction methods have been actively studied in the bioinformatics community and have shown significant improvement over the last decade. We have previously developed successful function prediction methods, which were shown to be among top-performing methods in the community-wide functional annotation experiment, CAFA. Based on our function prediction method, we developed a neural network model, named NNTox, which uses predicted GO terms for a target protein to further predict the possibility of the protein being toxic. We have also developed a multi-label model, which can predict the specific toxicity type of the query sequence. Together, this work analyses the relationship between GO terms and protein toxicity and builds predictor models of protein toxicity.


2019 ◽  
Author(s):  
Hansheng Xue ◽  
Jiajie Peng ◽  
Xuequn Shang

AbstractMotivationThe emerging of abundant biological networks, which benefit from the development of advanced high-throughput techniques, contribute to describing and modeling complex internal interactions among biological entities such as genes and proteins. Multiple networks provide rich information for inferring the function of genes or proteins. To extract functional patterns of genes based on multiple heterogeneous networks, network embedding-based methods, aiming to capture non-linear and low-dimensional feature representation based on network biology, have recently achieved remarkable performance in gene function prediction. However, existing methods mainly do not consider the shared information among different networks during the feature learning process. Thus, we propose a novel multi-networks embedding-based function prediction method based on semi-supervised autoencoder and feature convolution neural network, named DeepMNE-CNN, which captures complex topological structures of multi-networks and takes the correlation among multi-networks into account.ResultsWe design a novel semi-supervised autoencoder method to integrate multiple networks and generate a low-dimensional feature representation. Then we utilize a convolutional neural network based on the integrated feature embedding to annotate unlabeled gene functions. We test our method on both yeast and human dataset and compare with four state-of-the-art methods. The results demonstrate the superior performance of our method over four state-of-the-art algorithms. From the future explorations, we find that semi-supervised autoencoder based multi-networks integration method and CNN-based feature learning methods both contribute to the task of function prediction.AvailabilityDeepMNE-CNN is freely available at https://github.com/xuehansheng/DeepMNE-CNN


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