• An integrated structure- and system-based framework to identify new targets of metabolites and known drugs.

    • A novel integrated structure- and system-based approach of drug-target prediction (iDTP) to enable the large-scale discovery of new targets for small molecules, such as pharmaceutical drugs, co-factors and metabolites (collectively called 'drugs').
    • In the cross-validation study, iDTP is used to predict the known targets of 11 drugs, with 63% sensitivity and 81% specificity.
    • This method is broadly applicable for the prediction of protein-small molecule interactions with several novel applications to biological research and drug development.
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Computational Biology Research Lab

Precision Medicine Lab, National Center in Big Data and Cloud Computing

Phone: +92 51 111 128 128 Ext. 394

Email: hammad.naveed@nu.edu.pk