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Artificial neural network study on organ-targeting peptides.

Authors :
Jung E
Kim J
Choi SH
Kim M
Rhee H
Shin JM
Choi K
Kang SK
Lee NK
Choi YJ
Jung DH
Source :
Journal of computer-aided molecular design [J Comput Aided Mol Des] 2010 Jan; Vol. 24 (1), pp. 49-56. Date of Electronic Publication: 2009 Dec 18.
Publication Year :
2010

Abstract

We report a new approach to studying organ targeting of peptides on the basis of peptide sequence information. The positive control data sets consist of organ-targeting peptide sequences identified by the peroral phage-display technique for four organs, and the negative control data are prepared from random sequences. The capacity of our models to make appropriate predictions is validated by statistical indicators including sensitivity, specificity, enrichment curve, and the area under the receiver operating characteristic (ROC) curve (the ROC score). VHSE descriptor produces statistically significant training models and the models with simple neural network architectures show slightly greater predictive power than those with complex ones. The training and test set statistics indicate that our models could discriminate between organ-targeting and random sequences. We anticipate that our models will be applicable to the selection of organ-targeting peptides for generating peptide drugs or peptidomimetics.

Details

Language :
English
ISSN :
1573-4951
Volume :
24
Issue :
1
Database :
MEDLINE
Journal :
Journal of computer-aided molecular design
Publication Type :
Academic Journal
Accession number :
20020181
Full Text :
https://doi.org/10.1007/s10822-009-9313-0