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Druggability Prediction

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PockDrug

Pocket Druggability Prediction

Please submit your files in order to predict pocket(s) druggability

Complete the form:

Druggability Prediction using pocket:

Upload both pocket file and the corresponding protein file

Uploading pocket file

Upload the corresponding protein file

Examples:

Example 1: Druggability prediction of the E20 binding pocket of 1EVE complex estimated using DoGSiteScorer
Example 2: Druggability prediction of one of 10GS pocket estimated using Surflex

> see Documentation section

Druggability Prediction using protein(s):

Protein(s) information*:

PDB ID(4 char)

or upload your PDB file

or PDB ID list

Pocket estimation method(s)*:

fpocket

prox

Ligand proximity threshold between 4 Å and 12 Å*:

*Based on the litterature, we recommand a ligand proximity threshold of 4 Å or 5.5 Å

Prox4: Optional ligand information:

All ligands in protein pdb file

Extract from PDB: Enter ligand HET code

or upload mol2/sdf/PDB file

All information will be displayed on the following site.
If you desire to receive your results by e-mail and to be notified once your job is finished, please enter your e-mail address: (optional field)

Last update : April 2015