TTD_Target_ID	Target_Name	TTD_Drug_ID	Drug_Name	Drug_Highest_Status	Drug_PubchemID	Molecular_Formula	Molecular_Weight	Canonical_SMILES	Activity	Binder_Type
T00442	HUMAN catechol-O-methyl-transferase	D0E4WF	METHYLTHIOADENOSINE	Terminated	439176	C11H15N5O3S	297.34	CSC[C@@H]1[C@H]([C@H]([C@@H](O1)N2C=NC3=C(N=CN=C32)N)O)O	Ki > 5400000 nM	Non binder
T00442	HUMAN catechol-O-methyl-transferase	B3N1MW	3-[2-Methyl-4-(Trifluoromethyl)-1,3-Thiazol-5-Yl]-1H-1,2,4-Triazole	Investigative	5152843	C7H5F3N4S	234.2	CC1=NC(=C(S1)C2=NC=NN2)C(F)(F)F	Ki = 251000 nM	Non binder
T00442	HUMAN catechol-O-methyl-transferase	B7M3TG	[(2R,3S,4R,5R)-5-(6-Aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-[2-[5-[2-[benzyl(methyl)amino]-1-hydroxyethyl]-2-methoxyphenyl]ethyl]-methylsulfanium;iodide	Investigative	45266294	C30H39IN6O6S	738.6	CN(CC1=CC=CC=C1)CC(C2=CC(=C(C=C2)OC)CC[S+](C)OC[C@@H]3[C@H]([C@H]([C@@H](O3)N4C=NC5=C(N=CN=C54)N)O)O)O.[I-]	Ki = 500000 nM	Non binder
T00442	HUMAN catechol-O-methyl-transferase	B90PDG	(3-Amino-3-carboxypropyl)-[2-(2-methoxyphenyl)ethyl]-methylsulfanium;iodide	Investigative	45266258	C14H22INO3S	411.3	COC1=CC=CC=C1CC[S+](C)CCC(C(=O)O)N.[I-]	Ki = 5800000 nM	Non binder
T00442	HUMAN catechol-O-methyl-transferase	BA7ZI5	5'-(Dimethylsulfonio)-5'-deoxyadenosine iodide	Investigative	45266261	C12H18IN5O3S	439.28	C[S+](C)C[C@@H]1[C@H]([C@H]([C@@H](O1)N2C=NC3=C(N=CN=C32)N)O)O.[I-]	Ki = 6000000 nM	Non binder
T00442	HUMAN catechol-O-methyl-transferase	BRY76C	[(2R,3S,4R,5R)-5-(6-Aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-methyl-(2-phenylethyl)sulfanium;iodide	Investigative	45266259	C19H24IN5O4S	545.4	C[S+](CCC1=CC=CC=C1)OC[C@@H]2[C@H]([C@H]([C@@H](O2)N3C=NC4=C(N=CN=C43)N)O)O.[I-]	Ki = 800000 nM	Non binder
T00442	HUMAN catechol-O-methyl-transferase	BYJ43W	[(2R,3S,4R,5R)-5-(6-Aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-[2-(2-methoxyphenyl)ethyl]-methylsulfanium;iodide	Investigative	45266260	C20H26IN5O5S	575.4	COC1=CC=CC=C1CC[S+](C)OC[C@@H]2[C@H]([C@H]([C@@H](O2)N3C=NC4=C(N=CN=C43)N)O)O.[I-]	Ki = 800000 nM	Non binder