TTD_Target_ID Target_Name TTD_Drug_ID Drug_Name Drug_Highest_Status Drug_PubchemID Molecular_Formula Molecular_Weight Canonical_SMILES Activity Binder_Type T78127 Multidrug and toxin extrusion protein 2 D00KHM Pimozide Approved 16362 C28H29F2N3O 461.5 C1CN(CCC1N2C3=CC=CC=C3NC2=O)CCCC(C4=CC=C(C=C4)F)C5=CC=C(C=C5)F IC50 > 500000 nM Non binder T78127 Multidrug and toxin extrusion protein 2 D01AZG Risperidone Approved 5073 C23H27FN4O2 410.5 CC1=C(C(=O)N2CCCCC2=N1)CCN3CCC(CC3)C4=NOC5=C4C=CC(=C5)F IC50 = 291000 nM Non binder T78127 Multidrug and toxin extrusion protein 2 D0H3HM Aripiprazole Approved 60795 C23H27Cl2N3O2 448.4 C1CC(=O)NC2=C1C=CC(=C2)OCCCCN3CCN(CC3)C4=C(C(=CC=C4)Cl)Cl IC50 > 500000 nM Non binder T78127 Multidrug and toxin extrusion protein 2 D0NR6S Maraviroc Approved 3002977 C29H41F2N5O 513.7 CC1=NN=C(N1C2C[C@H]3CC[C@@H](C2)N3CC[C@@H](C4=CC=CC=C4)NC(=O)C5CCC(CC5)(F)F)C(C)C IC50 = 297000 nM Non binder T78127 Multidrug and toxin extrusion protein 2 D0T6XX Pantoprazole Approved 4679 C16H15F2N3O4S 383.4 COC1=C(C(=NC=C1)CS(=O)C2=NC3=C(N2)C=C(C=C3)OC(F)F)OC IC50 > 500000 nM Non binder T78127 Multidrug and toxin extrusion protein 2 D0TQ1G Rimantadine Approved 5071 C12H21N 179.3 CC(C12CC3CC(C1)CC(C3)C2)N IC50 = 288000 nM Non binder T78127 Multidrug and toxin extrusion protein 2 D0V7CF Indinavir Approved 5362440 C36H47N5O4 613.8 CC(C)(C)NC(=O)[C@@H]1CN(CCN1C[C@H](C[C@@H](CC2=CC=CC=C2)C(=O)N[C@@H]3[C@@H](CC4=CC=CC=C34)O)O)CC5=CN=CC=C5 IC50 > 500000 nM Non binder T78127 Multidrug and toxin extrusion protein 2 D0P2HR [3H]granisetron Investigative 3510 C18H24N4O 312.4 CN1C2CCCC1CC(C2)NC(=O)C3=NN(C4=CC=CC=C43)C IC50 = 311000 nM Non binder