This program is based on the IPE model developed in the laboratory (a convolutional model that integrates molecules with multi-target relationship networks to predict drug efficacy). It supports input of molecular files in formats such as sdf, mol2, and allows users to manually draw unknown molecules as inputs to explore the relationship between molecular structure and drug efficacy.
note:
(1) All results are derived from model predictions and are for reference only
(2) Due to the use of commercial software with copyright restrictions during the model building process, if you have a molecule of interest that has not yet been included in this database and wish to use it for research purposes, you may submit your molecule below. Once the calculation is complete, we will share the results with you via email.
(3) Incorrect file formats may not return results, please read the instructions carefully.