TTD_Target_ID	Target_Name	TTD_Drug_ID	Drug_Name	Drug_Highest_Status	Drug_PubchemID	Molecular_Formula	Molecular_Weight	Canonical_SMILES	Activity	Binder_Type
T55709	Choline kinase	B42LDS	4-Pyrrolidin-1-yl-1-[[3-[(4-pyrrolidin-1-ylpyridin-1-ium-1-yl)methyl]phenyl]methyl]pyridin-1-ium;dibromide	Investigative	11082270	C26H32Br2N4	560.4	C1CCN(C1)C2=CC=[N+](C=C2)CC3=CC(=CC=C3)C[N+]4=CC=C(C=C4)N5CCCC5.[Br-].[Br-]	IC50 = 84200 nM	Poor binder
T55709	Choline kinase	B4F8GI	1-[[4-[2-[4-[[7-Amino-8-methyl-4-(N-methylanilino)quinolin-1-ium-1-yl]methyl]phenyl]ethyl]phenyl]methyl]-4-N,8-dimethyl-4-N-phenylquinolin-1-ium-4,7-diamine;dibromide	Investigative	11216769	C50H50Br2N6	894.8	CC1=C(C=CC2=C(C=C[N+](=C12)CC3=CC=C(C=C3)CCC4=CC=C(C=C4)C[N+]5=C6C(=C(C=CC6=C(C=C5)N(C)C7=CC=CC=C7)N)C)N(C)C8=CC=CC=C8)N.[Br-].[Br-]	IC50 = 133000 nM	Poor binder
T55709	Choline kinase	B5U4IW	1-[[4-[4-[[7-Amino-8-methyl-4-(N-methylanilino)quinolin-1-ium-1-yl]methyl]phenyl]phenyl]methyl]-4-N,8-dimethyl-4-N-phenylquinolin-1-ium-4,7-diamine;dibromide	Investigative	11205213	C48H46Br2N6	866.7	CC1=C(C=CC2=C(C=C[N+](=C12)CC3=CC=C(C=C3)C4=CC=C(C=C4)C[N+]5=C6C(=C(C=CC6=C(C=C5)N(C)C7=CC=CC=C7)N)C)N(C)C8=CC=CC=C8)N.[Br-].[Br-]	IC50 = 96100 nM	Poor binder
T55709	Choline kinase	B6CV7U	4-Piperidin-1-yl-1-[[(1S,2S)-2-[(4-piperidin-1-ylpyridin-1-ium-1-yl)methyl]cyclopropyl]methyl]pyridin-1-ium;dibromide	Investigative	44396776	C25H36Br2N4	552.4	C1CCN(CC1)C2=CC=[N+](C=C2)C[C@H]3C[C@@H]3C[N+]4=CC=C(C=C4)N5CCCCC5.[Br-].[Br-]	IC50 = 98000 nM	Poor binder
T55709	Choline kinase	B8GPI6	1-[[3-[3-[[7-Amino-4-(4-chloro-N-methylanilino)-8-methylquinolin-1-ium-1-yl]methyl]phenyl]phenyl]methyl]-4-N-(4-chlorophenyl)-4-N,8-dimethylquinolin-1-ium-4,7-diamine;dibromide	Investigative	11355042	C48H44Br2Cl2N6	935.6	CC1=C(C=CC2=C(C=C[N+](=C12)CC3=CC(=CC=C3)C4=CC=CC(=C4)C[N+]5=C6C(=C(C=CC6=C(C=C5)N(C)C7=CC=C(C=C7)Cl)N)C)N(C)C8=CC=C(C=C8)Cl)N.[Br-].[Br-]	IC50 = 147000 nM	Poor binder
T55709	Choline kinase	BA8R6G	1-[[4-[2-[4-[(4-Aminoquinolin-1-ium-1-yl)methyl]phenyl]ethyl]phenyl]methyl]quinolin-1-ium-4-amine;dibromide	Investigative	10628095	C34H32Br2N4	656.5	C1=CC=C2C(=C1)C(=CC=[N+]2CC3=CC=C(C=C3)CCC4=CC=C(C=C4)C[N+]5=CC=C(C6=CC=CC=C65)N)N.[Br-].[Br-]	IC50 = 80000 nM	Poor binder
T55709	Choline kinase	BB0QP2	4-Piperidin-1-yl-1-[[3-[(4-piperidin-1-ylpyridin-1-ium-1-yl)methyl]phenyl]methyl]pyridin-1-ium;dibromide	Investigative	10984774	C28H36Br2N4	588.4	C1CCN(CC1)C2=CC=[N+](C=C2)CC3=CC(=CC=C3)C[N+]4=CC=C(C=C4)N5CCCCC5.[Br-].[Br-]	IC50 = 52800 nM	Poor binder
T55709	Choline kinase	BBN0A2	1-[[(1S,2S)-2-[[4-(3,5-Dichloro-N-methylanilino)pyridin-1-ium-1-yl]methyl]cyclopropyl]methyl]-N-(3,5-dichlorophenyl)-N-methylpyridin-1-ium-4-amine;dibromide	Investigative	44396762	C29H28Br2Cl4N4	734.2	CN(C1=CC=[N+](C=C1)C[C@H]2C[C@@H]2C[N+]3=CC=C(C=C3)N(C)C4=CC(=CC(=C4)Cl)Cl)C5=CC(=CC(=C5)Cl)Cl.[Br-].[Br-]	IC50 ~ 100000 nM	Poor binder
T55709	Choline kinase	BE06ZW	1-[[3-[3-[[7-Amino-8-methyl-4-(N-methylanilino)quinolin-1-ium-1-yl]methyl]phenyl]phenyl]methyl]-4-N,8-dimethyl-4-N-phenylquinolin-1-ium-4,7-diamine;dibromide	Investigative	11320446	C48H46Br2N6	866.7	CC1=C(C=CC2=C(C=C[N+](=C12)CC3=CC(=CC=C3)C4=CC=CC(=C4)C[N+]5=C6C(=C(C=CC6=C(C=C5)N(C)C7=CC=CC=C7)N)C)N(C)C8=CC=CC=C8)N.[Br-].[Br-]	IC50 = 56800 nM	Poor binder
T55709	Choline kinase	BE4N8Q	1-[[4-[4-[(4-Amino-7-chloroquinolin-1-ium-1-yl)methyl]phenyl]phenyl]methyl]-7-chloroquinolin-1-ium-4-amine;dibromide	Investigative	11445422	C32H26Br2Cl2N4	697.3	C1=CC(=CC=C1C[N+]2=C3C=C(C=CC3=C(C=C2)N)Cl)C4=CC=C(C=C4)C[N+]5=C6C=C(C=CC6=C(C=C5)N)Cl.[Br-].[Br-]	IC50 = 63300 nM	Poor binder
T55709	Choline kinase	BEWV70	1-[[4-[4-[(4-Aminoquinolin-1-ium-1-yl)methyl]phenyl]phenyl]methyl]quinolin-1-ium-4-amine;dibromide	Investigative	11342615	C32H28Br2N4	628.4	C1=CC=C2C(=C1)C(=CC=[N+]2CC3=CC=C(C=C3)C4=CC=C(C=C4)C[N+]5=CC=C(C6=CC=CC=C65)N)N.[Br-].[Br-]	IC50 = 81100 nM	Poor binder
T55709	Choline kinase	BG4JC8	[4-[(4-Methyl-1,4-diazepan-1-yl)methyl]phenyl]methanamine	Investigative	18525875	C14H23N3	233.35	CN1CCCN(CC1)CC2=CC=C(C=C2)CN	IC50 = 87000 nM	Poor binder
T55709	Choline kinase	BH5YK7	8-[(2R)-1-(3,5-Difluorophenyl)pyrrolidin-2-yl]-6-(morpholine-4-carbonyl)-2-morpholino-chromen-4-one	Investigative	66557964	C28H29F2N3O5	525.5	C1C[C@@H](N(C1)C2=CC(=CC(=C2)F)F)C3=CC(=CC4=C3OC(=CC4=O)N5CCOCC5)C(=O)N6CCOCC6	IC50 ~ 50000 nM	Poor binder
T55709	Choline kinase	BHW82Y	2-[[5-(4-Ethoxyphenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]-N-(2,2,6,6-tetramethylpiperidin-4-yl)acetamide	Investigative	54575995	C21H31N5O2S	417.6	CCOC1=CC=C(C=C1)C2=NC(=NN2)SCC(=O)NC3CC(NC(C3)(C)C)(C)C	IC50 ~ 100000 nM	Poor binder
T55709	Choline kinase	BJ0T3K	1-[[4-[2-[4-[(4-Carboxypyridin-1-ium-1-yl)methyl]phenyl]ethyl]phenyl]methyl]pyridin-1-ium-4-carboxylic acid;dibromide	Investigative	10817558	C28H26Br2N2O4	614.3	C1=CC(=CC=C1CCC2=CC=C(C=C2)C[N+]3=CC=C(C=C3)C(=O)O)C[N+]4=CC=C(C=C4)C(=O)O.[Br-].[Br-]	IC50 = 136700 nM	Poor binder
T55709	Choline kinase	BMH6E7	4-Pyrrolidin-1-yl-1-[[(1S,2S)-2-[(4-pyrrolidin-1-ylpyridin-1-ium-1-yl)methyl]cyclopropyl]methyl]pyridin-1-ium;dibromide	Investigative	44396626	C23H32Br2N4	524.3	C1CCN(C1)C2=CC=[N+](C=C2)C[C@H]3C[C@@H]3C[N+]4=CC=C(C=C4)N5CCCC5.[Br-].[Br-]	IC50 ~ 100000 nM	Poor binder
T55709	Choline kinase	BO73HS	4-Methyl-1-[[4-[2-[4-[(4-methylpyridin-1-ium-1-yl)methyl]phenyl]ethyl]phenyl]methyl]pyridin-1-ium;dibromide	Investigative	10792844	C28H30Br2N2	554.4	CC1=CC=[N+](C=C1)CC2=CC=C(C=C2)CCC3=CC=C(C=C3)C[N+]4=CC=C(C=C4)C.[Br-].[Br-]	IC50 = 100000 nM	Poor binder
T55709	Choline kinase	BT10OH	N-Methyl-1-[[(1S,2S)-2-[[4-(N-methylanilino)pyridin-1-ium-1-yl]methyl]cyclopropyl]methyl]-N-phenylpyridin-1-ium-4-amine;dibromide	Investigative	44396710	C29H32Br2N4	596.4	CN(C1=CC=CC=C1)C2=CC=[N+](C=C2)C[C@H]3C[C@@H]3C[N+]4=CC=C(C=C4)N(C)C5=CC=CC=C5.[Br-].[Br-]	IC50 ~ 100000 nM	Poor binder
T55709	Choline kinase	BUV58G	2-[[5-(4-Ethoxyphenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]-N-(3-methoxyphenyl)acetamide	Investigative	54575921	C19H20N4O3S	384.5	CCOC1=CC=C(C=C1)C2=NC(=NN2)SCC(=O)NC3=CC(=CC=C3)OC	IC50 = 50000 nM	Poor binder
T55709	Choline kinase	BW3M6U	1-[[4-[2-[4-[[7-Amino-4-(4-chloro-N-methylanilino)-8-methylquinolin-1-ium-1-yl]methyl]phenyl]ethyl]phenyl]methyl]-4-N-(4-chlorophenyl)-4-N,8-dimethylquinolin-1-ium-4,7-diamine;dibromide	Investigative	11457348	C50H48Br2Cl2N6	963.7	CC1=C(C=CC2=C(C=C[N+](=C12)CC3=CC=C(C=C3)CCC4=CC=C(C=C4)C[N+]5=C6C(=C(C=CC6=C(C=C5)N(C)C7=CC=C(C=C7)Cl)N)C)N(C)C8=CC=C(C=C8)Cl)N.[Br-].[Br-]	IC50 = 57500 nM	Poor binder
T55709	Choline kinase	BWM67E	[1-[[4-[2-[4-[[4-(Hydroxymethyl)pyridin-1-ium-1-yl]methyl]phenyl]ethyl]phenyl]methyl]pyridin-1-ium-4-yl]methanol;dibromide	Investigative	10769646	C28H30Br2N2O2	586.4	C1=CC(=CC=C1CCC2=CC=C(C=C2)C[N+]3=CC=C(C=C3)CO)C[N+]4=CC=C(C=C4)CO.[Br-].[Br-]	IC50 = 100000 nM	Poor binder