TTD_Target_ID Target_Name TTD_Drug_ID Drug_Name Drug_Highest_Status Drug_PubchemID Molecular_Formula Molecular_Weight Canonical_SMILES Activity Binder_Type T94400 Mycobacterium Thymidine monophosphate kinase D03KXY Doxifluridine Approved 18343 C9H11FN2O5 246.19 C[C@@H]1[C@H]([C@H]([C@@H](O1)N2C=C(C(=O)NC2=O)F)O)O Ki = 560000 nM Non binder T94400 Mycobacterium Thymidine monophosphate kinase B1XKJ4 Ethyl 3-[4-[(5-methyl-2,4-dioxopyrimidin-1-yl)methyl]phenyl]propanoate Investigative 5276671 C17H20N2O4 316.35 CCOC(=O)CCC1=CC=C(C=C1)CN2C=C(C(=O)NC2=O)C Ki = 265000 nM Non binder T94400 Mycobacterium Thymidine monophosphate kinase B1Y3CU [(2R,3S,5R)-5-[2,4-Dioxo-5-(2-thienyl)pyrimidin-1-yl]-3-hydroxy-tetrahydrofuran-2-yl]methyl dihydrogen phosphate Investigative 502269 C13H15N2O8PS 390.31 C1[C@@H]([C@H](O[C@H]1N2C=C(C(=O)NC2=O)C3=CC=CS3)COP(=O)(O)O)O Ki = 270000 nM Non binder T94400 Mycobacterium Thymidine monophosphate kinase B3DW6A 2-[(2R,3S,5R)-3-Hydroxy-5-(5-methyl-2,4-dioxo-pyrimidin-1-yl)tetrahydrofuran-2-yl]-N-methyl-ethanesulfonamide Investigative 71508267 C12H19N3O6S 333.36 CC1=CN(C(=O)NC1=O)[C@H]2C[C@@H]([C@H](O2)CCS(=O)(=O)NC)O Ki = 240000 nM Non binder T94400 Mycobacterium Thymidine monophosphate kinase B4B3NS [(2S,3S,4R,5R)-3-(Aminomethyl)-4-hydroxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methyl dihydrogen phosphate Investigative 3006432 C11H18N3O8P 351.25 CC1=CN(C(=O)NC1=O)[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)(O)O)CN)O Ki = 315000 nM Non binder T94400 Mycobacterium Thymidine monophosphate kinase B4DYO8 1-((2R,5S)-4-Azido-3-hydroxy-5-iodomethyl-tetrahydro-furan-2-yl)-5-methyl-1H-pyrimidine-2,4-dione Investigative 510574 C10H12IN5O4 393.14 CC1=CN(C(=O)NC1=O)[C@H]2[C@@H]([C@@H]([C@H](O2)CI)N=[N+]=[N-])O Ki = 490000 nM Non binder T94400 Mycobacterium Thymidine monophosphate kinase B5V6QF 1-[2-[(5-Methyl-2,4-dioxo-pyrimidin-1-yl)methoxy]ethyl]-3-phenyl-thiourea Investigative 23636348 C15H18N4O3S 334.4 CC1=CN(C(=O)NC1=O)COCCNC(=S)NC2=CC=CC=C2 Ki = 260000 nM Non binder T94400 Mycobacterium Thymidine monophosphate kinase B64EZX 3'-Deoxy-3'-aminothymidine monophosphate Investigative 162501 C10H16N3O7P 321.22 CC1=CN(C(=O)NC1=O)[C@H]2C[C@@H]([C@H](O2)COP(=O)(O)O)N Ki = 235000 nM Non binder T94400 Mycobacterium Thymidine monophosphate kinase B9OEN2 1-[(2R,4S,5R)-4-Hydroxy-5-(2-methylsulfonylethyl)tetrahydrofuran-2-yl]-5-methyl-pyrimidine-2,4-dione Investigative 71508217 C12H18N2O6S 318.35 CC1=CN(C(=O)NC1=O)[C@H]2C[C@@H]([C@H](O2)CCS(=O)(=O)C)O Ki = 340000 nM Non binder T94400 Mycobacterium Thymidine monophosphate kinase BC9TH4 1-Benzyl-2,4-dioxo-1,2,3,4-tetrahydropyrimidine-5-carbonitrile Investigative 2823137 C12H9N3O2 227.22 C1=CC=C(C=C1)CN2C=C(C(=O)NC2=O)C#N Ki = 980000 nM Non binder T94400 Mycobacterium Thymidine monophosphate kinase BCR6X2 3'-Amino-3'-deoxythymidine Investigative 108074 C10H15N3O4 241.24 CC1=CN(C(=O)NC1=O)[C@H]2C[C@@H]([C@H](O2)CO)N Ki = 230000 nM Non binder T94400 Mycobacterium Thymidine monophosphate kinase BDM85C 5-Methyl-7-Propyl-1,6-Naphthyridin-2(1h)-One Investigative 19093772 C12H14N2O 202.25 CCCC1=CC2=C(C=CC(=O)N2)C(=N1)C IC50 = 590000 nM Non binder T94400 Mycobacterium Thymidine monophosphate kinase BG2S0Q 1-((2R,5R)-4-Amino-3-hydroxy-5-methyl-tetrahydro-furan-2-yl)-5-methyl-1H-pyrimidine-2,4-dione Investigative 510575 C10H15N3O4 241.24 C[C@@H]1[C@H]([C@H]([C@@H](O1)N2C=C(C(=O)NC2=O)C)O)N Ki = 1900000 nM Non binder T94400 Mycobacterium Thymidine monophosphate kinase BGI52E 5-Methyl-2-oxo-1H-1,6-naphthyridine-3-carbonitrile Investigative 5713068 C10H7N3O 185.18 CC1=NC=CC2=C1C=C(C(=O)N2)C#N IC50 = 634000 nM Non binder T94400 Mycobacterium Thymidine monophosphate kinase BJ0VH2 4-[4-[(2,4-Dioxopyrimidin-1-yl)methyl]phenyl]butanoic acid Investigative 16726539 C15H16N2O4 288.3 C1=CC(=CC=C1CCCC(=O)O)CN2C=CC(=O)NC2=O Ki = 202000 nM Non binder T94400 Mycobacterium Thymidine monophosphate kinase BJ3EZ0 1-[(2R,3R,4R,5S)-4-(Aminomethyl)-3-chloro-5-(hydroxymethyl)tetrahydrofuran-2-yl]-5-methyl-pyrimidine-2,4-dione Investigative 5273624 C11H16ClN3O4 289.71 CC1=CN(C(=O)NC1=O)[C@H]2[C@@H]([C@@H]([C@H](O2)CO)CN)Cl Ki = 390000 nM Non binder T94400 Mycobacterium Thymidine monophosphate kinase BJS65D Spongothymidine Investigative 65049 C10H14N2O6 258.23 CC1=CN(C(=O)NC1=O)[C@H]2[C@H]([C@@H]([C@H](O2)CO)O)O Ki = 238000 nM Non binder T94400 Mycobacterium Thymidine monophosphate kinase BK1TM7 Edoxudine Investigative 66377 C11H16N2O5 256.25 CCC1=CN(C(=O)NC1=O)[C@H]2C[C@@H]([C@H](O2)CO)O Ki = 1140000 nM Non binder T94400 Mycobacterium Thymidine monophosphate kinase BP1W8Y 1-[(3-Chlorophenyl)methyl]-2,4-dioxo-pyrimidine-5-carbonitrile Investigative 2823141 C12H8ClN3O2 261.66 C1=CC(=CC(=C1)Cl)CN2C=C(C(=O)NC2=O)C#N Ki = 810000 nM Non binder T94400 Mycobacterium Thymidine monophosphate kinase BP58GV 1-(4-Aminomethyl-3-hydroxy-5-hydroxymethyl-tetrahydro-furan-2-yl)-5-methyl-1H-pyrimidine-2,4-dione Investigative 508216 C11H17N3O5 271.27 CC1=CN(C(=O)NC1=O)[C@H]2[C@@H]([C@@H]([C@H](O2)CO)CN)O Ki = 393000 nM Non binder T94400 Mycobacterium Thymidine monophosphate kinase BQ4PJ7 1-(4-Azidomethyl-3-hydroxy-5-hydroxymethyl-tetrahydro-furan-2-yl)-5-methyl-1H-pyrimidine-2,4-dione Investigative 477014 C11H15N5O5 297.27 CC1=CN(C(=O)NC1=O)[C@H]2[C@@H]([C@@H]([C@H](O2)CO)CN=[N+]=[N-])O Ki = 770000 nM Non binder T94400 Mycobacterium Thymidine monophosphate kinase BWSY31 1-[(2R,4S,5R)-5-[[4-(4-Chlorophenyl)triazol-1-yl]methyl]-4-hydroxy-tetrahydrofuran-2-yl]-5-methyl-pyrimidine-2,4-dione Investigative 57395804 C18H18ClN5O4 403.8 CC1=CN(C(=O)NC1=O)[C@H]2C[C@@H]([C@H](O2)CN3C=C(N=N3)C4=CC=C(C=C4)Cl)O Ki = 201000 nM Non binder T94400 Mycobacterium Thymidine monophosphate kinase D0X1ZP 5-fluorouridine Investigative 9427 C9H11FN2O6 262.19 C1=C(C(=O)NC(=O)N1[C@H]2[C@@H]([C@@H]([C@H](O2)CO)O)O)F Ki = 521000 nM Non binder