Description of this data
1-Files that resulted from application of PHARMIP insilico method to explore adverse drug reactions on 2 examples of domperidone related cardio-toxicity and ranitidine related thrombocytopenia .
2-Files that are used to apply the step of molecular docking on the previous examples.
Experiment data files
Steps to reproduce
1- Use drug SMILES code to predict targets via SwissTargetPrediction, SEA server, Poly Pharmacology browser.
2- Use drug SDF file to predict targets using PharMapper.
3- Get and refine the whole off-label targets list (OLT).
4- Use the OLT list to retrieve the diseases associated (DA) to the list via DisGeNet.
5- Filter the DA list with the disease of interest.
Cite this dataset
Zidan, Ahmad; Saad, Eman; Ibrahim, Nasser; Mahmoud, Amal ; Hashim, Medhat; Hemeida, Alaa (2019), “PHARMIP ”, Mendeley Data, v1 http://dx.doi.org/10.17632/t26pp5y6ym.1
The files associated with this dataset are licensed under a Creative Commons Attribution 4.0 International licence.