Table 2

Off-targets candidates for torcetrapib identified by reverse docking procedure
Rank Target details (PDB Code) Ligand Binding score (kcal/mol)
1 PDGFR (1GQ5) crenolanib 28.7711
torcetrapib 42.0439
2 HGFR (3U6H) compound 03X 40.8298
torcetrapib 40.2422
3 IL-2 receptor (4HCV) compound 13 J 46.049
torcetrapib 38.126
4 ErbB1 (3BEL) compound POX 35.5674
torcetrapib 34.7466

Fan et al.

Fan et al. BMC Systems Biology 2012 6:152   doi:10.1186/1752-0509-6-152

Open Data