TTD_Target_ID Target_Name TTD_Drug_ID Drug_Name Drug_Highest_Status Drug_PubchemID Molecular_Formula Molecular_Weight Canonical_SMILES Activity Binder_Type T99989 Casein kinase I epsilon B0PV8T 2-[4-[[5-[3-(Methoxymethyl)-2,3-dihydro-1,4-benzodioxin-6-yl]-1,3,4-oxadiazol-2-yl]sulfanylmethyl]phenyl]benzonitrile Investigative 57523093 C26H21N3O4S 471.5 COCC1COC2=C(O1)C=C(C=C2)C3=NN=C(O3)SCC4=CC=C(C=C4)C5=CC=CC=C5C#N IC50 ~ 100000 nM Poor binder T99989 Casein kinase I epsilon B1XKE7 CID 71578744 Investigative 71578744 C17H13N5O2S 351.4 CC(=O)NC1=NC=CC(=C1)C2=NN=C(O2)SCC3=CC(=CC=C3)C#N IC50 ~ 100000 nM Poor binder T99989 Casein kinase I epsilon B2TDR1 2-(1,3-Benzodioxol-5-yl)-5-[[4-(3,5-difluorophenyl)phenyl]methylsulfanyl]-1,3,4-oxadiazole Investigative 71578446 C22H14F2N2O3S 424.4 C1OC2=C(O1)C=C(C=C2)C3=NN=C(O3)SCC4=CC=C(C=C4)C5=CC(=CC(=C5)F)F IC50 = 80000 nM Poor binder T99989 Casein kinase I epsilon B3V9PA 2-[[4-(4-Methoxyphenyl)phenyl]methylsulfanyl]-5-pyridin-4-yl-1,3,4-oxadiazole Investigative 71212403 C21H17N3O2S 375.4 COC1=CC=C(C=C1)C2=CC=C(C=C2)CSC3=NN=C(O3)C4=CC=NC=C4 IC50 ~ 100000 nM Poor binder T99989 Casein kinase I epsilon B4FHT8 2-[[4-(3,5-Difluorophenyl)phenyl]methylsulfanyl]-5-(2,3-dihydro-1,4-benzodioxin-6-yl)-1,3,4-oxadiazole Investigative 71212517 C23H16F2N2O3S 438.4 C1COC2=C(O1)C=CC(=C2)C3=NN=C(O3)SCC4=CC=C(C=C4)C5=CC(=CC(=C5)F)F IC50 ~ 100000 nM Poor binder T99989 Casein kinase I epsilon B5AST9 N-[4-[5-[[4-(2-Cyanophenyl)phenyl]methylsulfanyl]-1,3,4-oxadiazol-2-yl]pyridin-2-yl]acetamide Investigative 71578745 C23H17N5O2S 427.5 CC(=O)NC1=NC=CC(=C1)C2=NN=C(O2)SCC3=CC=C(C=C3)C4=CC=CC=C4C#N IC50 ~ 100000 nM Poor binder T99989 Casein kinase I epsilon B6J8GD 3-[4-[(5-Pyridin-4-yl-1,3,4-oxadiazol-2-yl)sulfanylmethyl]phenyl]benzonitrile Investigative 71212514 C21H14N4OS 370.4 C1=CC(=CC(=C1)C2=CC=C(C=C2)CSC3=NN=C(O3)C4=CC=NC=C4)C#N IC50 ~ 100000 nM Poor binder T99989 Casein kinase I epsilon B79YJF 2-[(4-Phenylphenyl)methylsulfanyl]-5-pyridin-4-yl-1,3,4-oxadiazole Investigative 24370907 C20H15N3OS 345.4 C1=CC=C(C=C1)C2=CC=C(C=C2)CSC3=NN=C(O3)C4=CC=NC=C4 IC50 ~ 100000 nM Poor binder T99989 Casein kinase I epsilon B7OY1C 2-[4-[(5-Pyridin-4-yl-1,3,4-oxadiazol-2-yl)sulfanylmethyl]phenyl]benzonitrile Investigative 30291292 C21H14N4OS 370.4 C1=CC=C(C(=C1)C#N)C2=CC=C(C=C2)CSC3=NN=C(O3)C4=CC=NC=C4 IC50 ~ 100000 nM Poor binder T99989 Casein kinase I epsilon B9HKQ6 N-[4-(5-Benzylsulfanyl-1,3,4-oxadiazol-2-yl)pyridin-2-yl]acetamide Investigative 71578658 C16H14N4O2S 326.4 CC(=O)NC1=NC=CC(=C1)C2=NN=C(O2)SCC3=CC=CC=C3 IC50 ~ 100000 nM Poor binder T99989 Casein kinase I epsilon BCRO12 2-(2,3-Dihydro-1,4-benzodioxin-6-yl)-5-[[4-(2-nitrophenyl)phenyl]methylsulfanyl]-1,3,4-oxadiazole Investigative 71578307 C23H17N3O5S 447.5 C1COC2=C(O1)C=CC(=C2)C3=NN=C(O3)SCC4=CC=C(C=C4)C5=CC=CC=C5[N+](=O)[O-] IC50 ~ 100000 nM Poor binder T99989 Casein kinase I epsilon BD9GE4 2-[4-[[5-(1,3-Benzodioxol-5-yl)-1,3,4-oxadiazol-2-yl]sulfanylmethyl]phenyl]-5-methoxybenzonitrile Investigative 71212317 C24H17N3O4S 443.5 COC1=CC(=C(C=C1)C2=CC=C(C=C2)CSC3=NN=C(O3)C4=CC5=C(C=C4)OCO5)C#N IC50 = 50000 nM Poor binder T99989 Casein kinase I epsilon BEP25N 2-[[4-(2-Nitrophenyl)phenyl]methylsulfanyl]-5-pyridin-4-yl-1,3,4-oxadiazole Investigative 71578447 C20H14N4O3S 390.4 C1=CC=C(C(=C1)C2=CC=C(C=C2)CSC3=NN=C(O3)C4=CC=NC=C4)[N+](=O)[O-] IC50 ~ 100000 nM Poor binder T99989 Casein kinase I epsilon BG1T9K 4-[4-[(5-Pyridin-4-yl-1,3,4-oxadiazol-2-yl)sulfanylmethyl]phenyl]benzonitrile Investigative 71212434 C21H14N4OS 370.4 C1=CC(=CC=C1CSC2=NN=C(O2)C3=CC=NC=C3)C4=CC=C(C=C4)C#N IC50 ~ 100000 nM Poor binder T99989 Casein kinase I epsilon BHTK41 2-[4-[[5-(2,3-Dihydro-1,4-benzodioxin-6-yl)-1,3,4-oxadiazol-2-yl]sulfanylmethyl]phenyl]-5-methoxybenzonitrile Investigative 71212446 C25H19N3O4S 457.5 COC1=CC(=C(C=C1)C2=CC=C(C=C2)CSC3=NN=C(O3)C4=CC5=C(C=C4)OCCO5)C#N IC50 ~ 100000 nM Poor binder T99989 Casein kinase I epsilon BIO5X9 2-(1,3-Benzodioxol-5-yl)-5-[[4-(3-nitrophenyl)phenyl]methylsulfanyl]-1,3,4-oxadiazole Investigative 71578375 C22H15N3O5S 433.4 C1OC2=C(O1)C=C(C=C2)C3=NN=C(O3)SCC4=CC=C(C=C4)C5=CC(=CC=C5)[N+](=O)[O-] IC50 ~ 100000 nM Poor binder T99989 Casein kinase I epsilon BJ69QM 2-(2H-1,3-Benzodioxol-5-yl)-5-[({[1,1'-biphenyl]-4-yl}methyl)sulfanyl]-1,3,4-oxadiazole Investigative 7458031 C22H16N2O3S 388.4 C1OC2=C(O1)C=C(C=C2)C3=NN=C(O3)SCC4=CC=C(C=C4)C5=CC=CC=C5 IC50 ~ 100000 nM Poor binder T99989 Casein kinase I epsilon BJM01F 4-[4-[[5-(1,3-Benzodioxol-5-yl)-1,3,4-oxadiazol-2-yl]sulfanylmethyl]phenyl]benzonitrile Investigative 57522818 C23H15N3O3S 413.4 C1OC2=C(O1)C=C(C=C2)C3=NN=C(O3)SCC4=CC=C(C=C4)C5=CC=C(C=C5)C#N IC50 = 60000 nM Poor binder T99989 Casein kinase I epsilon BK59PQ 2-(1,3-Benzodioxol-5-yl)-5-[[4-(2-nitrophenyl)phenyl]methylsulfanyl]-1,3,4-oxadiazole Investigative 71578373 C22H15N3O5S 433.4 C1OC2=C(O1)C=C(C=C2)C3=NN=C(O3)SCC4=CC=C(C=C4)C5=CC=CC=C5[N+](=O)[O-] IC50 ~ 100000 nM Poor binder T99989 Casein kinase I epsilon BMED31 2-[4-[[5-[(3R)-3-(Methoxymethyl)-2,3-dihydro-1,4-benzodioxin-6-yl]-1,3,4-oxadiazol-2-yl]sulfanylmethyl]phenyl]benzonitrile Investigative 57523094 C26H21N3O4S 471.5 COC[C@@H]1COC2=C(O1)C=C(C=C2)C3=NN=C(O3)SCC4=CC=C(C=C4)C5=CC=CC=C5C#N IC50 ~ 100000 nM Poor binder T99989 Casein kinase I epsilon BO02QN 2-(2,3-Dihydro-1,4-benzodioxin-6-yl)-5-[[4-(4-methoxyphenyl)phenyl]methylsulfanyl]-1,3,4-oxadiazole Investigative 71212395 C24H20N2O4S 432.5 COC1=CC=C(C=C1)C2=CC=C(C=C2)CSC3=NN=C(O3)C4=CC5=C(C=C4)OCCO5 IC50 ~ 100000 nM Poor binder T99989 Casein kinase I epsilon BO0JH1 2-[4-[[5-[(3S)-3-(Methoxymethyl)-2,3-dihydro-1,4-benzodioxin-6-yl]-1,3,4-oxadiazol-2-yl]sulfanylmethyl]phenyl]benzonitrile Investigative 57523095 C26H21N3O4S 471.5 COC[C@H]1COC2=C(O1)C=C(C=C2)C3=NN=C(O3)SCC4=CC=C(C=C4)C5=CC=CC=C5C#N IC50 ~ 100000 nM Poor binder T99989 Casein kinase I epsilon BQV6B2 5-Fluoro-2-[4-[(5-pyridin-4-yl-1,3,4-oxadiazol-2-yl)sulfanylmethyl]phenyl]benzonitrile Investigative 71578520 C21H13FN4OS 388.4 C1=CC(=CC=C1CSC2=NN=C(O2)C3=CC=NC=C3)C4=C(C=C(C=C4)F)C#N IC50 ~ 100000 nM Poor binder T99989 Casein kinase I epsilon BS0W8Z 2-[4-[[5-(2,3-Dihydro-1,4-benzodioxin-6-yl)-1,3,4-oxadiazol-2-yl]sulfanylmethyl]phenyl]benzonitrile Investigative 57522819 C24H17N3O3S 427.5 C1COC2=C(O1)C=CC(=C2)C3=NN=C(O3)SCC4=CC=C(C=C4)C5=CC=CC=C5C#N IC50 ~ 100000 nM Poor binder T99989 Casein kinase I epsilon BS1R6Q 2-(2,3-Dihydro-1,4-benzodioxin-6-yl)-5-[[4-(3-nitrophenyl)phenyl]methylsulfanyl]-1,3,4-oxadiazole Investigative 71212337 C23H17N3O5S 447.5 C1COC2=C(O1)C=CC(=C2)C3=NN=C(O3)SCC4=CC=C(C=C4)C5=CC(=CC=C5)[N+](=O)[O-] IC50 ~ 100000 nM Poor binder T99989 Casein kinase I epsilon BTS9M3 3-[4-[[5-(1,3-Benzodioxol-5-yl)-1,3,4-oxadiazol-2-yl]sulfanylmethyl]phenyl]benzonitrile Investigative 71578374 C23H15N3O3S 413.4 C1OC2=C(O1)C=C(C=C2)C3=NN=C(O3)SCC4=CC=C(C=C4)C5=CC=CC(=C5)C#N IC50 ~ 100000 nM Poor binder T99989 Casein kinase I epsilon BUK1D4 Methyl 4-[[5-(2,3-dihydro-1,4-benzodioxin-6-yl)-1,3,4-oxadiazol-2-yl]sulfanylmethyl]benzoate Investigative 70694953 C19H16N2O5S 384.4 COC(=O)C1=CC=C(C=C1)CSC2=NN=C(O2)C3=CC4=C(C=C3)OCCO4 IC50 ~ 100000 nM Poor binder T99989 Casein kinase I epsilon BVAM65 2-[4-[[5-(2,3-Dihydro-1,4-benzodioxin-6-yl)-1,3,4-oxadiazol-2-yl]sulfanylmethyl]phenyl]-5-fluorobenzonitrile Investigative 57522820 C24H16FN3O3S 445.5 C1COC2=C(O1)C=CC(=C2)C3=NN=C(O3)SCC4=CC=C(C=C4)C5=C(C=C(C=C5)F)C#N IC50 ~ 100000 nM Poor binder T99989 Casein kinase I epsilon BWE0H2 3-[4-[[5-(2,3-Dihydro-1,4-benzodioxin-6-yl)-1,3,4-oxadiazol-2-yl]sulfanylmethyl]phenyl]benzonitrile Investigative 71212291 C24H17N3O3S 427.5 C1COC2=C(O1)C=CC(=C2)C3=NN=C(O3)SCC4=CC=C(C=C4)C5=CC=CC(=C5)C#N IC50 ~ 100000 nM Poor binder T99989 Casein kinase I epsilon BX80VR 2-(2,3-Dihydro-1,4-benzodioxin-6-yl)-5-[(4-phenylphenyl)methylsulfanyl]-1,3,4-oxadiazole Investigative 71212419 C23H18N2O3S 402.5 C1COC2=C(O1)C=CC(=C2)C3=NN=C(O3)SCC4=CC=C(C=C4)C5=CC=CC=C5 IC50 ~ 100000 nM Poor binder T99989 Casein kinase I epsilon BYQU48 4'-({[5-(2H-1,3-Benzodioxol-5-yl)-1,3,4-oxadiazol-2-yl]sulfanyl}methyl)-[1,1'-biphenyl]-2-carbonitrile Investigative 30291209 C23H15N3O3S 413.4 C1OC2=C(O1)C=C(C=C2)C3=NN=C(O3)SCC4=CC=C(C=C4)C5=CC=CC=C5C#N IC50 ~ 100000 nM Poor binder T99989 Casein kinase I epsilon BZM1D2 4-[4-[[5-(2,3-Dihydro-1,4-benzodioxin-6-yl)-1,3,4-oxadiazol-2-yl]sulfanylmethyl]phenyl]benzonitrile Investigative 71212233 C24H17N3O3S 427.5 C1COC2=C(O1)C=CC(=C2)C3=NN=C(O3)SCC4=CC=C(C=C4)C5=CC=C(C=C5)C#N IC50 ~ 100000 nM Poor binder