Want to know how we did it?

 

Steps

 

  1. Search on UniProt for IRAK4 Mus musculus;
  2. Copy the FASTA sequence and paste into the 'Target Search' box on the ChEMBL web page;
  3. Run the search for similar protein targets and select the closest homologue (Homo sapiens);
  4. Filter on its bioactivities where IC50 is less than 10000nM to get a list of potent compounds for this target;
  5. Go to the Target report card for this protein target, scroll to the bottom and click on the PDBe link;
  6. In PDBe, choose one of the 3D structures for IRAK4 for further investigation.