TTD_Target_ID	Target_Name	TTD_Drug_ID	Drug_Name	Drug_Highest_Status	Drug_PubchemID	Molecular_Formula	Molecular_Weight	Canonical_SMILES	Activity	Binder_Type
T09826	DNA topoisomerase I	D0H3WI	Ribavirin	Approved	37542	C8H12N4O5	244.2	C1=NC(=NN1[C@H]2[C@@H]([C@@H]([C@H](O2)CO)O)O)C(=O)N	IC50 = 65880 nM	Poor binder
T09826	DNA topoisomerase I	D0J4JM	Reserpine	Approved	5770	C33H40N2O9	608.7	CO[C@H]1[C@@H](C[C@@H]2CN3CCC4=C([C@H]3C[C@@H]2[C@@H]1C(=O)OC)NC5=C4C=CC(=C5)OC)OC(=O)C6=CC(=C(C(=C6)OC)OC)OC	IC50 = 160000 nM	Poor binder
T09826	DNA topoisomerase I	B01OLA	(5E)-5-[(4-Bromothiophen-2-yl)methylidene]-2-sulfanylideneimidazolidin-4-one	Investigative	122192375	C8H5BrN2OS2	289.2	C1=C(SC=C1Br)/C=C/2\\C(=O)NC(=S)N2	EC50 ~ 100000 nM	Poor binder
T09826	DNA topoisomerase I	B0HP4U	(4R,7E)-7-(7-Chloro-2-oxo-1H-indol-3-ylidene)-4-ethyl-4-hydroxy-1,8-dihydropyrano[3,4-f]indolizine-3,6,10-trione	Investigative	44383740	C21H15ClN2O6	426.8	CC[C@]1(C2=C(COC1=O)C(=O)N3C/C(=C\\4/C5=C(C(=CC=C5)Cl)NC4=O)/C(=O)C3=C2)O	IC50 ~ 100000 nM	Poor binder
T09826	DNA topoisomerase I	B0V7NU	3-[(E)-4-Nitrobenzylidene]benzofuran-2(3H)-one	Investigative	14203214	C15H9NO4	267.24	C1=CC=C2C(=C1)/C(=C\\C3=CC=C(C=C3)[N+](=O)[O-])/C(=O)O2	IC50 = 120000 nM	Poor binder
T09826	DNA topoisomerase I	B12HXS	N-Benzothiazol-2-yl-4-hydroxy-benzamide	Investigative	28392752	C14H10N2O2S	270.31	C1=CC=C2C(=C1)N=C(S2)NC(=O)C3=CC=C(C=C3)O	IC50 ~ 100000 nM	Poor binder
T09826	DNA topoisomerase I	B1RL5N	3-[[4-[Bis(1-hydroxy-3,4-dioxonaphthalen-2-yl)methyl]phenyl]-(1-hydroxy-3,4-dioxonaphthalen-2-yl)methyl]-4-hydroxynaphthalene-1,2-dione	Investigative	419666	C48H26O12	794.7	C1=CC=C2C(=C1)C(=C(C(=O)C2=O)C(C3=CC=C(C=C3)C(C4=C(C5=CC=CC=C5C(=O)C4=O)O)C6=C(C7=CC=CC=C7C(=O)C6=O)O)C8=C(C9=CC=CC=C9C(=O)C8=O)O)O	IC50 = 60000 nM	Poor binder
T09826	DNA topoisomerase I	B3K8CM	(19S)-19-Ethyl-7-fluoro-19-hydroxy-14,18-dioxo-17-oxa-3,13-diazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4(9),5,7,10,15(20)-heptaene-10-carboxylic acid	Investigative	10409273	C21H15FN2O6	410.4	CC[C@@]1(C2=C(COC1=O)C(=O)N3CC4=C(C5=C(C=CC(=C5)F)N=C4C3=C2)C(=O)O)O	IC50 ~ 100000 nM	Poor binder
T09826	DNA topoisomerase I	B3LA0Q	5,15-Bis(4-bromophenyl)-10,20-bis(4-pyridin-4-ylphenyl)-21,23-dihydroporphyrin	Investigative	137645246	C54H34Br2N6	926.7	C1=CC(=CC=C1C2=CC=NC=C2)C3=C4C=CC(=C(C5=NC(=C(C6=CC=C(N6)C(=C7C=CC3=N7)C8=CC=C(C=C8)Br)C9=CC=C(C=C9)C1=CC=NC=C1)C=C5)C1=CC=C(C=C1)Br)N4	EC50 ~ 50000 nM	Poor binder
T09826	DNA topoisomerase I	B41XLZ	N-(2-Benzamidophenyl)benzamide	Investigative	231860	C20H16N2O2	316.4	C1=CC=C(C=C1)C(=O)NC2=CC=CC=C2NC(=O)C3=CC=CC=C3	IC50 ~ 100000 nM	Poor binder
T09826	DNA topoisomerase I	B4IT1H	(7E)-4-Ethyl-4-hydroxy-7-(1-methyl-2-oxoindol-3-ylidene)-1,8-dihydropyrano[3,4-f]indolizine-3,6,10-trione	Investigative	10453990	C22H18N2O6	406.4	CCC1(C2=C(COC1=O)C(=O)N3C/C(=C\\4/C5=CC=CC=C5N(C4=O)C)/C(=O)C3=C2)O	IC50 ~ 100000 nM	Poor binder
T09826	DNA topoisomerase I	B4NTW0	Tetraphenylporphyrin	Investigative	86280046	C44H30N4	614.7	C1=CC=C(C=C1)C2=C3C=CC(=C(C4=NC(=C(C5=CC=C(N5)C(=C6C=CC2=N6)C7=CC=CC=C7)C8=CC=CC=C8)C=C4)C9=CC=CC=C9)N3	EC50 ~ 50000 nM	Poor binder
T09826	DNA topoisomerase I	B4T8IE	(7E)-4-Ethyl-4-hydroxy-7-(6-methoxy-2-oxo-1H-indol-3-ylidene)-1,8-dihydropyrano[3,4-f]indolizine-3,6,10-trione	Investigative	9979625	C22H18N2O7	422.4	CCC1(C2=C(COC1=O)C(=O)N3C/C(=C\\4/C5=C(C=C(C=C5)OC)NC4=O)/C(=O)C3=C2)O	IC50 ~ 100000 nM	Poor binder
T09826	DNA topoisomerase I	B51HXL	Chembl4170688	Investigative	145950672	C19H11F3N2S	356.4	C1=CC2=C(C(=CC(=N2)C3=CC=C(C=C3)C(F)(F)F)C4=CSC=C4)N=C1	IC50 = 82080 nM	Poor binder
T09826	DNA topoisomerase I	B53RGT	(5E)-5-[(3,5-Dimethylphenyl)methylidene]imidazolidine-2,4-dione	Investigative	122192381	C12H12N2O2	216.24	CC1=CC(=CC(=C1)/C=C/2\\C(=O)NC(=O)N2)C	EC50 ~ 100000 nM	Poor binder
T09826	DNA topoisomerase I	B5OA8Z	Acetic acid 2-acetoxy-5-[2-(3,4-diacetoxy-benzoylamino)-phenylcarbamoyl]-phenyl ester	Investigative	44290804	C28H24N2O10	548.5	CC(=O)OC1=C(C=C(C=C1)C(=O)NC2=CC=CC=C2NC(=O)C3=CC(=C(C=C3)OC(=O)C)OC(=O)C)OC(=O)C	IC50 = 88000 nM	Poor binder
T09826	DNA topoisomerase I	B5OGW1	Chembl4165844	Investigative	145952636	C26H17FN2	376.4	C1=CC=C(C=C1)C2=CC=C(C=C2)C3=CC(=NC4=C3N=CC=C4)C5=CC=C(C=C5)F	IC50 = 83250 nM	Poor binder
T09826	DNA topoisomerase I	B5V3SG	2-Thioxo-5-[(3,4,5-trimethoxyphenyl)methylene]-1,3-diazolidin-4-one	Investigative	743742	C13H14N2O4S	294.33	COC1=CC(=CC(=C1OC)OC)/C=C/2\\C(=O)NC(=S)N2	EC50 = 93200 nM	Poor binder
T09826	DNA topoisomerase I	B60JIF	Ganoderiol F	Investigative	471008	C30H46O3	454.7	C[C@H](CCC=C(CO)CO)[C@H]1CC[C@@]2([C@@]1(CC=C3C2=CC[C@@H]4[C@@]3(CCC(=O)C4(C)C)C)C)C	IC50 = 106000 nM	Poor binder
T09826	DNA topoisomerase I	B61JVZ	Methyl (E)-3-[(19S)-19-ethyl-19-hydroxy-14,18-dioxo-17-oxa-3,13-diazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2(11),3,5,7,9,15(20)-heptaen-7-yl]prop-2-enoate	Investigative	44381326	C24H20N2O6	432.4	CC[C@@]1(C2=C(COC1=O)C(=O)N3CC4=C(C3=C2)N=C5C=CC(=CC5=C4)/C=C/C(=O)OC)O	IC50 ~ 100000 nM	Poor binder
T09826	DNA topoisomerase I	B6O0TC	Chembl4168199	Investigative	145954110	C21H16N2O	312.4	COC1=CC=CC(=C1)C2=NC3=C(C(=C2)C4=CC=CC=C4)N=CC=C3	IC50 = 82030 nM	Poor binder
T09826	DNA topoisomerase I	B6PIZ5	(5E)-5-(3,4-Dimethoxybenzylidene)-2-thioxoimidazolidin-4-one	Investigative	717415	C12H12N2O3S	264.3	COC1=C(C=C(C=C1)/C=C/2\\C(=O)NC(=S)N2)OC	EC50 ~ 100000 nM	Poor binder
T09826	DNA topoisomerase I	B7MEP6	(5E)-5-[(4-Methoxy-3-methylphenyl)methylidene]imidazolidine-2,4-dione	Investigative	122192380	C12H12N2O3	232.23	CC1=C(C=CC(=C1)/C=C/2\\C(=O)NC(=O)N2)OC	EC50 ~ 100000 nM	Poor binder
T09826	DNA topoisomerase I	B7MLP4	(7E)-4-Ethyl-4-hydroxy-7-(5-nitro-2-oxo-1H-indol-3-ylidene)-1,8-dihydropyrano[3,4-f]indolizine-3,6,10-trione	Investigative	10433196	C21H15N3O8	437.4	CCC1(C2=C(COC1=O)C(=O)N3C/C(=C\\4/C5=C(C=CC(=C5)[N+](=O)[O-])NC4=O)/C(=O)C3=C2)O	IC50 ~ 100000 nM	Poor binder
T09826	DNA topoisomerase I	B7SJF3	Aesculioside IIIf	Investigative	44479228	C57H88O23	1141.3	C/C=C(\\C)/C(=O)O[C@H]1[C@@H](C(C[C@@H]2[C@]1([C@@H]([C@@H]([C@@]3(C2=CC[C@H]4[C@]3(CC[C@@H]5[C@@]4(CC[C@@H](C5(C)C)O[C@H]6[C@@H]([C@H]([C@@H]([C@H](O6)C(=O)O)O)O[C@H]7[C@@H]([C@H]([C@@H](O7)CO)O)O)O[C@H]8[C@@H]([C@H]([C@@H]([C@H](O8)CO)O)O)O)C)C)C)O)O)CO)(C)C)OC(=O)/C(=C/C)/C	IC50 = 53700 nM	Poor binder
T09826	DNA topoisomerase I	B83FBO	(5E)-5-[(4-Methoxy-3-methylphenyl)methylidene]-2-sulfanylideneimidazolidin-4-one	Investigative	840074	C12H12N2O2S	248.3	CC1=C(C=CC(=C1)/C=C/2\\C(=O)NC(=S)N2)OC	EC50 ~ 100000 nM	Poor binder
T09826	DNA topoisomerase I	B8H6PX	Acetic acid 2-acetoxy-5-[4-(3,4-diacetoxy-benzoylamino)-phenylcarbamoyl]-phenyl ester	Investigative	44291373	C28H24N2O10	548.5	CC(=O)OC1=C(C=C(C=C1)C(=O)NC2=CC=C(C=C2)NC(=O)C3=CC(=C(C=C3)OC(=O)C)OC(=O)C)OC(=O)C	IC50 ~ 100000 nM	Poor binder
T09826	DNA topoisomerase I	B8Q0GC	(4S,7E)-4-Ethyl-4-hydroxy-7-(2-oxo-1H-indol-3-ylidene)-1,8-dihydropyrano[3,4-f]indolizine-3,6,10-trione	Investigative	10363086	C21H16N2O6	392.4	CC[C@@]1(C2=C(COC1=O)C(=O)N3C/C(=C\\4/C5=CC=CC=C5NC4=O)/C(=O)C3=C2)O	IC50 ~ 100000 nM	Poor binder
T09826	DNA topoisomerase I	B8ZK4M	AesculiosideIV-23C1	Investigative	21580556	C57H88O23	1141.3	C/C=C(/C)\\C(=O)O[C@H]1[C@@H](C(C[C@@H]2[C@]1([C@@H](C[C@@]3(C2=CC[C@H]4[C@]3(CC[C@@H]5[C@@]4(CC[C@@H]([C@]5(C)CO)O[C@H]6[C@@H]([C@H]([C@@H]([C@H](O6)C(=O)O)O)O[C@H]7[C@@H]([C@H]([C@@H](O7)CO)O)O)O[C@H]8[C@@H]([C@H]([C@@H]([C@H](O8)CO)O)O)O)C)C)C)O)CO)(C)C)OC(=O)/C(=C\\C)/C	IC50 = 53000 nM	Poor binder
T09826	DNA topoisomerase I	B9AV3R	[(3R,4S,5R)-3,4-Dihydroxy-5-[5-hydroxy-2-(4-hydroxyphenyl)-4-oxo-7-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxychromen-3-yl]oxyoxolan-3-yl]methyl acetate	Investigative	25067894	C28H30O15	606.5	C[C@H]1[C@@H]([C@H]([C@H]([C@@H](O1)OC2=CC(=C3C(=C2)OC(=C(C3=O)O[C@@H]4[C@H]([C@@](CO4)(COC(=O)C)O)O)C5=CC=C(C=C5)O)O)O)O)O	IC50 = 150000 nM	Poor binder
T09826	DNA topoisomerase I	B9QK7P	Aesculioside IIIb	Investigative	46888251	C56H88O24	1145.3	C/C=C(/C)\\C(=O)O[C@H]1[C@@H]([C@]2([C@@H](CC1(C)C)C3=CC[C@@H]4[C@]5(CC[C@@H]([C@]([C@@H]5CC[C@]4([C@@]3([C@H]([C@H]2O)O)C)C)(C)CO)O[C@H]6[C@@H]([C@H]([C@@H]([C@H](O6)C(=O)O)O)O[C@H]7[C@@H]([C@H]([C@@H](O7)CO)O)O)O[C@H]8[C@@H]([C@H]([C@@H]([C@H](O8)CO)O)O)O)C)CO)OC(=O)C(C)C	IC50 = 160000 nM	Poor binder
T09826	DNA topoisomerase I	B9WLN0	(4R,7E)-4-Ethyl-4-hydroxy-7-(6-methylsulfanyl-2-oxo-1H-indol-3-ylidene)-1,8-dihydropyrano[3,4-f]indolizine-3,6,10-trione	Investigative	44383210	C22H18N2O6S	438.5	CC[C@]1(C2=C(COC1=O)C(=O)N3C/C(=C\\4/C5=C(C=C(C=C5)SC)NC4=O)/C(=O)C3=C2)O	IC50 ~ 100000 nM	Poor binder
T09826	DNA topoisomerase I	BAEC53	Chembl4164762	Investigative	145959577	C20H13FN2	300.3	C1=CC=C(C=C1)C2=CC(=NC3=C2N=CC=C3)C4=CC=C(C=C4)F	IC50 = 72770 nM	Poor binder
T09826	DNA topoisomerase I	BAJ3S8	5-(4-Methylbenzylidene)-2-thioxoimidazolidin-4-one	Investigative	710216	C11H10N2OS	218.28	CC1=CC=C(C=C1)/C=C/2\\C(=O)NC(=S)N2	EC50 ~ 100000 nM	Poor binder
T09826	DNA topoisomerase I	BAYK58	Acetic acid 4-[2-(4-acetoxy-benzoylamino)-phenylcarbamoyl]-phenyl ester	Investigative	6620659	C24H20N2O6	432.4	CC(=O)OC1=CC=C(C=C1)C(=O)NC2=CC=CC=C2NC(=O)C3=CC=C(C=C3)OC(=O)C	IC50 ~ 100000 nM	Poor binder
T09826	DNA topoisomerase I	BB4OS6	(4R,7E)-4-Ethyl-4-hydroxy-7-(7-methyl-2-oxo-1H-indol-3-ylidene)-1,8-dihydropyrano[3,4-f]indolizine-3,6,10-trione	Investigative	44383864	C22H18N2O6	406.4	CC[C@]1(C2=C(COC1=O)C(=O)N3C/C(=C\\4/C5=CC=CC(=C5NC4=O)C)/C(=O)C3=C2)O	IC50 ~ 100000 nM	Poor binder
T09826	DNA topoisomerase I	BB54DK	6-(4-Methylpiperazin-1-yl)-2-[2-[4-(10-prop-2-ynoxydecoxy)phenyl]-3H-benzimidazol-5-yl]-1H-benzimidazole	Investigative	134153923	C38H46N6O2	618.8	CN1CCN(CC1)C2=CC3=C(C=C2)N=C(N3)C4=CC5=C(C=C4)N=C(N5)C6=CC=C(C=C6)OCCCCCCCCCCOCC#C	IC50 ~ 50000 nM	Poor binder
T09826	DNA topoisomerase I	BB92EQ	6-(4-Methylpiperazin-1-yl)-2-[2-[4-(12-prop-2-ynoxydodecoxy)phenyl]-3H-benzimidazol-5-yl]-1H-benzimidazole	Investigative	134144217	C40H50N6O2	646.9	CN1CCN(CC1)C2=CC3=C(C=C2)N=C(N3)C4=CC5=C(C=C4)N=C(N5)C6=CC=C(C=C6)OCCCCCCCCCCCCOCC#C	IC50 ~ 50000 nM	Poor binder
T09826	DNA topoisomerase I	BBU9Y0	2-[4-[[1-(4-Azidobutyl)triazol-4-yl]methoxy]phenyl]-6-(4-methylpiperazin-1-yl)-1H-benzimidazole	Investigative	137659985	C25H30N10O	486.6	CN1CCN(CC1)C2=CC3=C(C=C2)N=C(N3)C4=CC=C(C=C4)OCC5=CN(N=N5)CCCCN=[N+]=[N-]	IC50 ~ 50000 nM	Poor binder
T09826	DNA topoisomerase I	BCN91P	3-[2-(Dimethylamino)isopropoxy]benzo[b]naphtho[2,3-d]furan-6,11-dione	Investigative	44428908	C21H19NO4	349.4	CC(CN(C)C)OC1=CC2=C(C=C1)C3=C(O2)C(=O)C4=CC=CC=C4C3=O	IC50 = 59500 nM	Poor binder
T09826	DNA topoisomerase I	BCP4S7	(4R,7E)-4-Ethyl-4-hydroxy-7-(5-methyl-7-nitro-2-oxo-1H-indol-3-ylidene)-1,8-dihydropyrano[3,4-f]indolizine-3,6,10-trione	Investigative	44384424	C22H17N3O8	451.4	CC[C@]1(C2=C(COC1=O)C(=O)N3C/C(=C\\4/C5=C(C(=CC(=C5)C)[N+](=O)[O-])NC4=O)/C(=O)C3=C2)O	IC50 ~ 100000 nM	Poor binder
T09826	DNA topoisomerase I	BCUN15	Acetic acid 4-[4-(4-acetoxy-benzoylamino)-phenylcarbamoyl]-phenyl ester	Investigative	44290590	C24H20N2O6	432.4	CC(=O)OC1=CC=C(C=C1)C(=O)NC2=CC=C(C=C2)NC(=O)C3=CC=C(C=C3)OC(=O)C	IC50 ~ 100000 nM	Poor binder
T09826	DNA topoisomerase I	BD28VH	Simocyclinone D8	Investigative	54736483	C46H42ClNO18	932.3	C[C@@H]1[C@H]([C@@H](C[C@@H](O1)C2=C(C3=C(C=C2)C(=O)[C@]45[C@]([C@@H]3O)(O4)[C@H](C[C@]6([C@@]5(C(=O)C=C(C6)C)O)O)O)O)OC(=O)/C=C/C=C/C=C/C=C/C(=O)NC7=C(C8=C(C(=C(C=C8)O)Cl)OC7=O)O)OC(=O)C	IC50 = 60000 nM	Poor binder
T09826	DNA topoisomerase I	BD7B4F	8-(2-(Diethylamino)ethoxy)benzofuro[3,2-g]quinoline-5,11-dione	Investigative	44428913	C21H20N2O4	364.4	CCN(CC)CCOC1=CC2=C(C=C1)C3=C(O2)C(=O)C4=C(C3=O)C=CC=N4	IC50 = 64300 nM	Poor binder
T09826	DNA topoisomerase I	BE1I5X	Aesculioside IIIa	Investigative	46888258	C54H84O23	1101.2	C/C=C(/C)\\C(=O)O[C@H]1[C@@H]([C@@]2([C@@H](C[C@@]3(C(=CC[C@H]4[C@]3(CC[C@@H]5[C@@]4(CC[C@@H]([C@]5(C)CO)O[C@H]6[C@@H]([C@H]([C@@H]([C@H](O6)C(=O)O)O)O[C@H]7[C@@H]([C@H]([C@@H](O7)CO)O)O)O[C@H]8[C@@H]([C@H]([C@@H]([C@H](O8)CO)O)O)O)C)C)[C@@H]2CC1(C)C)C)O)COC(=O)C)O	IC50 = 118700 nM	Poor binder
T09826	DNA topoisomerase I	BE2L4G	6-(1-Hydroxypentyl)-5,8-dimethoxy-1,4-naphthoquinone	Investigative	14083910	C17H20O5	304.34	CCCCC(C1=CC(=C2C(=O)C=CC(=O)C2=C1OC)OC)O	IC50 = 83140 nM	Poor binder
T09826	DNA topoisomerase I	BE6W7K	Acetic acid 4-[3-(4-acetoxy-benzoylamino)-phenylcarbamoyl]-phenyl ester	Investigative	44290591	C24H20N2O6	432.4	CC(=O)OC1=CC=C(C=C1)C(=O)NC2=CC(=CC=C2)NC(=O)C3=CC=C(C=C3)OC(=O)C	IC50 ~ 100000 nM	Poor binder
T09826	DNA topoisomerase I	BE7FB6	(19S)-19-Ethyl-19-hydroxy-8-(2-phenylethyl)-17-oxa-3,13-diazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4,6,8,10,15(20)-heptaene-14,18-dione	Investigative	44381032	C28H24N2O4	452.5	CC[C@@]1(C2=C(COC1=O)C(=O)N3CC4=CC5=C(C=CC=C5N=C4C3=C2)CCC6=CC=CC=C6)O	IC50 ~ 100000 nM	Poor binder
T09826	DNA topoisomerase I	BFZ8G0	(7E)-4-Ethyl-7-(6-fluoro-7-methyl-2-oxo-1H-indol-3-ylidene)-4-hydroxy-1,8-dihydropyrano[3,4-f]indolizine-3,6,10-trione	Investigative	10455018	C22H17FN2O6	424.4	CCC1(C2=C(COC1=O)C(=O)N3C/C(=C\\4/C5=C(C(=C(C=C5)F)C)NC4=O)/C(=O)C3=C2)O	IC50 ~ 100000 nM	Poor binder
T09826	DNA topoisomerase I	BG6I4N	Chembl4167621	Investigative	145955703	C20H12F2N2	318.3	C1=CC=C(C=C1)C2=CC(=NC3=C2N=CC=C3)C4=CC(=C(C=C4)F)F	IC50 = 73110 nM	Poor binder
T09826	DNA topoisomerase I	BGK85F	4-Hydroxy-N-[4-[(4-hydroxybenzoyl)amino]phenyl]benzamide	Investigative	20544405	C20H16N2O4	348.4	C1=CC(=CC=C1C(=O)NC2=CC=C(C=C2)NC(=O)C3=CC=C(C=C3)O)O	IC50 ~ 100000 nM	Poor binder
T09826	DNA topoisomerase I	BGN54F	5,10-Bis(4-bromophenyl)-15,20-dipyridin-4-yl-21,23-dihydroporphyrin	Investigative	137648926	C42H26Br2N6	774.5	C1=CC(=CC=C1C2=C3C=CC(=C(C4=NC(=C(C5=CC=C(N5)C(=C6C=CC2=N6)C7=CC=C(C=C7)Br)C8=CC=NC=C8)C=C4)C9=CC=NC=C9)N3)Br	EC50 ~ 50000 nM	Poor binder
T09826	DNA topoisomerase I	BHP0N7	(E)-5-(3,4,5-Trimethoxybenzylidene)imidazolidine-2,4-dione	Investigative	760516	C13H14N2O5	278.26	COC1=CC(=CC(=C1OC)OC)/C=C/2\\C(=O)NC(=O)N2	EC50 ~ 100000 nM	Poor binder
T09826	DNA topoisomerase I	BI8QS2	(7E)-4-Ethyl-4-hydroxy-7-(5,6,7-trifluoro-2-oxo-1H-indol-3-ylidene)-1,8-dihydropyrano[3,4-f]indolizine-3,6,10-trione	Investigative	9980993	C21H13F3N2O6	446.3	CCC1(C2=C(COC1=O)C(=O)N3C/C(=C\\4/C5=CC(=C(C(=C5NC4=O)F)F)F)/C(=O)C3=C2)O	IC50 ~ 100000 nM	Poor binder
T09826	DNA topoisomerase I	BIG20Y	N-(2-Benzoylamino-4-hydroxyphenyl)-4-hydroxy-benzamide	Investigative	44290589	C20H16N2O4	348.4	C1=CC=C(C(=C1)NC(=O)C2=CC=C(C=C2)O)NC(=O)C3=CC=C(C=C3)O	IC50 ~ 100000 nM	Poor binder
T09826	DNA topoisomerase I	BIJ3C8	5,10,15,20-Tetra(4-pyridyl)-21H,23H-porphine	Investigative	135411729	C40H26N8	618.7	C1=CC2=C(C3=NC(=C(C4=CC=C(N4)C(=C5C=CC(=N5)C(=C1N2)C6=CC=NC=C6)C7=CC=NC=C7)C8=CC=NC=C8)C=C3)C9=CC=NC=C9	EC50 ~ 50000 nM	Poor binder
T09826	DNA topoisomerase I	BIS6N8	Kaempferol 3-O-beta-D-galactopyranosyl-7-O-alpha-L-rhamnopyranoside	Investigative	57390614	C27H30O15	594.5	C[C@H]1[C@@H]([C@H]([C@H]([C@@H](O1)OC2=CC(=C3C(=C2)OC(=C(C3=O)O[C@H]4[C@@H]([C@H]([C@H]([C@H](O4)CO)O)O)O)C5=CC=C(C=C5)O)O)O)O)O	IC50 = 180000 nM	Poor binder
T09826	DNA topoisomerase I	BJ21WX	Chembl4172657	Investigative	145950337	C21H13F3N2	350.3	C1=CC=C(C=C1)C2=CC(=NC3=C2N=CC=C3)C4=CC=C(C=C4)C(F)(F)F	IC50 = 72680 nM	Poor binder
T09826	DNA topoisomerase I	BJM4G0	Aesculioside IIa	Investigative	46888259	C52H82O22	1059.2	C/C=C(/C)\\C(=O)O[C@H]1[C@@H]([C@]2([C@@H](CC1(C)C)C3=CC[C@@H]4[C@]5(CC[C@@H](C([C@@H]5CC[C@]4([C@@]3([C@H]([C@H]2O)O)C)C)(C)C)O[C@H]6[C@@H]([C@H]([C@@H]([C@H](O6)C(=O)O)O)O[C@H]7[C@@H]([C@H]([C@@H](O7)CO)O)O)O[C@H]8[C@@H]([C@H]([C@H]([C@H](O8)CO)O)O)O)C)CO)O	IC50 = 109300 nM	Poor binder
T09826	DNA topoisomerase I	BJP9O3	Gallanilide	Investigative	80427	C13H11NO4	245.23	C1=CC=C(C=C1)NC(=O)C2=CC(=C(C(=C2)O)O)O	IC50 ~ 100000 nM	Poor binder
T09826	DNA topoisomerase I	BJZ4B3	(E)-3-(3,4-Dihydroxybenzylidene)benzofuran-2(3H)-one	Investigative	44401682	C15H10O4	254.24	C1=CC=C2C(=C1)/C(=C\\C3=CC(=C(C=C3)O)O)/C(=O)O2	IC50 = 160000 nM	Poor binder
T09826	DNA topoisomerase I	BK48LN	(5E)-5-(3-Methoxybenzylidene)-2-thioxoimidazolidin-4-one	Investigative	5810410	C11H10N2O2S	234.28	COC1=CC=CC(=C1)/C=C/2\\C(=O)NC(=S)N2	EC50 ~ 100000 nM	Poor binder
T09826	DNA topoisomerase I	BKAQ35	5-[(3,4-Dimethoxyphenyl)methylidene]imidazolidine-2,4-dione	Investigative	165798	C12H12N2O4	248.23	COC1=C(C=C(C=C1)C=C2C(=O)NC(=O)N2)OC	EC50 ~ 100000 nM	Poor binder
T09826	DNA topoisomerase I	BKS19W	N-(3-Benzoylamino-4-hydroxyphenyl)-4-hydroxy-benzamide	Investigative	20089392	C20H16N2O4	348.4	C1=CC(=CC(=C1)NC(=O)C2=CC=C(C=C2)O)NC(=O)C3=CC=C(C=C3)O	IC50 ~ 100000 nM	Poor binder
T09826	DNA topoisomerase I	BKWR41	(E)-9-Methoxy-11H-indeno[1,2-c]quinolin-11-oneO-2-morpholinoethyl Oxime	Investigative	46914919	C23H23N3O3	389.4	COC1=CC\\2=C(C=C1)C3=C(/C2=N/OCCN4CCOCC4)C5=CC=CC=C5N=C3	IC50 ~ 100000 nM	Poor binder
T09826	DNA topoisomerase I	BL7EP3	Kaempferol 3-O-beta-D-glucopyranosyl-7-O-alpha-L-rhamnopyranoside	Investigative	21606527	C27H30O15	594.5	C[C@H]1[C@@H]([C@H]([C@H]([C@@H](O1)OC2=CC(=C3C(=C2)OC(=C(C3=O)O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O)C5=CC=C(C=C5)O)O)O)O)O	IC50 = 110000 nM	Poor binder
T09826	DNA topoisomerase I	BLM5C3	Ganoderic acid T-N	Investigative	71459520	C32H48O5	512.7	C[C@H](CC/C=C(\\C)/C(=O)O)[C@H]1C[C@@H]([C@@]2([C@@]1(CC=C3C2=CC[C@@H]4[C@@]3(CC[C@@H](C4(C)C)O)C)C)C)OC(=O)C	IC50 = 55000 nM	Poor binder
T09826	DNA topoisomerase I	BLRG39	5-(4-Methoxybenzylidene)-2-thioxo-4-imidazolidinone	Investigative	722747	C11H10N2O2S	234.28	COC1=CC=C(C=C1)/C=C/2\\C(=O)NC(=S)N2	EC50 ~ 100000 nM	Poor binder
T09826	DNA topoisomerase I	BM20FG	(11E)-11-[3-(Dimethylamino)propoxyimino]-9-methoxy-5H-indeno[1,2-c]quinolin-6-one	Investigative	135939143	C22H23N3O3	377.4	CN(C)CCCO/N=C/1\\C2=C(C=CC(=C2)OC)C3=C1C4=CC=CC=C4NC3=O	IC50 ~ 100000 nM	Poor binder
T09826	DNA topoisomerase I	BM30RW	6-(4-Methylpiperazin-1-yl)-2'-(4-(undec-10-ynyloxy)phenyl)-1H,3'H-2, 5'-bibenzo[d]imidazole	Investigative	122178582	C36H42N6O	574.8	CN1CCN(CC1)C2=CC3=C(C=C2)N=C(N3)C4=CC5=C(C=C4)N=C(N5)C6=CC=C(C=C6)OCCCCCCCCCC#C	IC50 ~ 50000 nM	Poor binder
T09826	DNA topoisomerase I	BMB7E9	(5E)-5-[[5-(6-Methoxypyridin-3-yl)thiophen-2-yl]methylidene]imidazolidine-2,4-dione	Investigative	122192378	C14H11N3O3S	301.32	COC1=NC=C(C=C1)C2=CC=C(S2)/C=C/3\\C(=O)NC(=O)N3	EC50 ~ 100000 nM	Poor binder
T09826	DNA topoisomerase I	BMN35P	(7E)-7-(5-Chloro-2-oxo-1H-indol-3-ylidene)-4-ethyl-4-hydroxy-1,8-dihydropyrano[3,4-f]indolizine-3,6,10-trione	Investigative	11743236	C21H15ClN2O6	426.8	CCC1(C2=C(COC1=O)C(=O)N3C/C(=C\\4/C5=C(C=CC(=C5)Cl)NC4=O)/C(=O)C3=C2)O	IC50 ~ 100000 nM	Poor binder
T09826	DNA topoisomerase I	BMN60Q	6-(4-Methylpiperazin-1-yl)-2'-(4-(4-(prop-2-ynyloxy)butoxy)phenyl)-1H,3'H-2,5'-bibenzo[d]imidazole	Investigative	117968523	C32H34N6O2	534.7	CN1CCN(CC1)C2=CC3=C(C=C2)N=C(N3)C4=CC5=C(C=C4)N=C(N5)C6=CC=C(C=C6)OCCCCOCC#C	IC50 ~ 50000 nM	Poor binder
T09826	DNA topoisomerase I	BMTB14	(19S)-19-Ethyl-19-hydroxy-8-(morpholin-4-ylmethylideneamino)-17-oxa-3,13-diazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4(9),5,7,10,15(20)-heptaene-14,18-dione;hydrochloride	Investigative	45265491	C25H25ClN4O5	496.9	CC[C@@]1(C2=C(COC1=O)C(=O)N3CC4=CC5=C(C=CC=C5N=CN6CCOCC6)N=C4C3=C2)O.Cl	IC50 = 69000 nM	Poor binder
T09826	DNA topoisomerase I	BN1YL4	2'-(4-(Hex-5-ynyloxy)phenyl)-6-(4-methylpiperazin-1-yl)-1H,3'H-2,5'-bibenzo[d]imidazole	Investigative	117968363	C31H32N6O	504.6	CN1CCN(CC1)C2=CC3=C(C=C2)N=C(N3)C4=CC5=C(C=C4)N=C(N5)C6=CC=C(C=C6)OCCCCC#C	IC50 ~ 50000 nM	Poor binder
T09826	DNA topoisomerase I	BNRD32	4-Furan-2-yl-2-((E)-2-furan-2-yl-vinyl)-6-thiophen-2-yl-pyridine	Investigative	10064551	C19H13NO2S	319.4	C1=COC(=C1)/C=C/C2=NC(=CC(=C2)C3=CC=CO3)C4=CC=CS4	IC50 = 200000 nM	Poor binder
T09826	DNA topoisomerase I	BO47XR	6-(1-Hydroxypropyl)-5,8-dimethoxy-1,4-naphthoquinone	Investigative	44317608	C15H16O5	276.28	CCC(C1=CC(=C2C(=O)C=CC(=O)C2=C1OC)OC)O	IC50 = 121830 nM	Poor binder
T09826	DNA topoisomerase I	BO9YW5	(4R,7E)-4-Ethyl-4-hydroxy-7-[2-oxo-6-(trifluoromethoxy)-1H-indol-3-ylidene]-1,8-dihydropyrano[3,4-f]indolizine-3,6,10-trione	Investigative	44383263	C22H15F3N2O7	476.4	CC[C@]1(C2=C(COC1=O)C(=O)N3C/C(=C\\4/C5=C(C=C(C=C5)OC(F)(F)F)NC4=O)/C(=O)C3=C2)O	IC50 ~ 100000 nM	Poor binder
T09826	DNA topoisomerase I	BQB1R3	4-Furan-2-yl-2,6-di-thiophen-2-yl-pyridine	Investigative	12632564	C17H11NOS2	309.4	C1=COC(=C1)C2=CC(=NC(=C2)C3=CC=CS3)C4=CC=CS4	IC50 = 50000 nM	Poor binder
T09826	DNA topoisomerase I	BQTV82	6-(4-Methylpiperazin-1-yl)-2-[2-[4-(8-prop-2-ynoxyoctoxy)phenyl]-3H-benzimidazol-5-yl]-1H-benzimidazole	Investigative	134135688	C36H42N6O2	590.8	CN1CCN(CC1)C2=CC3=C(C=C2)N=C(N3)C4=CC5=C(C=C4)N=C(N5)C6=CC=C(C=C6)OCCCCCCCCOCC#C	IC50 ~ 50000 nM	Poor binder
T09826	DNA topoisomerase I	BQWS09	6-(1-Hydroxybutyl)-5,8-dimethoxy-1,4-naphthoquinone	Investigative	10039843	C16H18O5	290.31	CCCC(C1=CC(=C2C(=O)C=CC(=O)C2=C1OC)OC)O	IC50 = 129700 nM	Poor binder
T09826	DNA topoisomerase I	BR8B2W	Aesculioside IIc	Investigative	46888296	C52H82O21	1043.2	C/C=C(/C)\\C(=O)O[C@H]1[C@@H]([C@@]2([C@@H](C[C@@]3(C(=CC[C@H]4[C@]3(CC[C@@H]5[C@@]4(CC[C@@H](C5(C)C)O[C@H]6[C@@H]([C@H]([C@@H]([C@H](O6)C(=O)O)O)O[C@H]7[C@@H]([C@H]([C@@H](O7)CO)O)O)O[C@H]8[C@@H]([C@H]([C@H]([C@H](O8)CO)O)O)O)C)C)[C@@H]2CC1(C)C)C)O)CO)O	IC50 = 110500 nM	Poor binder
T09826	DNA topoisomerase I	BRJT74	9-Methoxy-11H-indeno[1,2-c]quinolin-11-one	Investigative	44604383	C17H11NO2	261.269	COC1=CC2=C(C=C1)C3=C(C2=O)C4=CC=CC=C4N=C3	IC50 ~ 100000 nM	Poor binder
T09826	DNA topoisomerase I	BS5XY8	Chembl4176453	Investigative	145972200	C26H17N3O2	403.4	C1=CC=C(C=C1)C2=CC=C(C=C2)C3=CC(=NC4=C3N=CC=C4)C5=CC(=CC=C5)[N+](=O)[O-]	IC50 = 67530 nM	Poor binder
T09826	DNA topoisomerase I	BS7ZJ6	Chembl4165426	Investigative	145956088	C22H12F6N2	418.3	C1=CC2=C(C(=CC(=N2)C3=CC=C(C=C3)C(F)(F)F)C4=CC=C(C=C4)C(F)(F)F)N=C1	IC50 = 50930 nM	Poor binder
T09826	DNA topoisomerase I	BT0IG5	(19S)-19-Ethyl-19-hydroxy-8-[(E)-2-phenylethenyl]-17-oxa-3,13-diazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4,6,8,10,15(20)-heptaene-14,18-dione	Investigative	44380930	C28H22N2O4	450.5	CC[C@@]1(C2=C(COC1=O)C(=O)N3CC4=CC5=C(C=CC=C5N=C4C3=C2)/C=C/C6=CC=CC=C6)O	IC50 ~ 100000 nM	Poor binder
T09826	DNA topoisomerase I	BTA53H	(4R,7E)-7-(5-Bromo-2-oxo-1H-indol-3-ylidene)-4-ethyl-4-hydroxy-1,8-dihydropyrano[3,4-f]indolizine-3,6,10-trione	Investigative	44383861	C21H15BrN2O6	471.3	CC[C@]1(C2=C(COC1=O)C(=O)N3C/C(=C\\4/C5=C(C=CC(=C5)Br)NC4=O)/C(=O)C3=C2)O	IC50 ~ 100000 nM	Poor binder
T09826	DNA topoisomerase I	BTB48Q	Aesculioside IVa	Investigative	46888245	C57H90O23	1143.3	CCC(C)C(=O)O[C@H]1[C@@H](C(C[C@@H]2[C@]1([C@@H]([C@@H]([C@@]3(C2=CC[C@H]4[C@]3(CC[C@@H]5[C@@]4(CC[C@@H](C5(C)C)O[C@H]6[C@@H]([C@H]([C@@H]([C@H](O6)C(=O)O)O)O[C@H]7[C@@H]([C@H]([C@@H](O7)CO)O)O)O[C@H]8[C@@H]([C@H]([C@H]([C@H](O8)CO)O)O)O)C)C)C)O)O)CO)(C)C)OC(=O)/C(=C\\C)/C	IC50 = 51800 nM	Poor binder
T09826	DNA topoisomerase I	BTMF02	(11E)-9-Methoxy-11-(2-morpholin-4-ylethoxyimino)-5H-indeno[1,2-c]quinolin-6-one	Investigative	135939145	C23H23N3O4	405.4	COC1=CC\\2=C(C=C1)C3=C(/C2=N/OCCN4CCOCC4)C5=CC=CC=C5NC3=O	IC50 ~ 100000 nM	Poor binder
T09826	DNA topoisomerase I	BV32FL	(4S,7E)-4-Ethyl-7-(5-fluoro-2-oxo-1H-indol-3-ylidene)-4-hydroxy-1,8-dihydropyrano[3,4-f]indolizine-3,6,10-trione	Investigative	11742280	C21H15FN2O6	410.4	CC[C@@]1(C2=C(COC1=O)C(=O)N3C/C(=C\\4/C5=C(C=CC(=C5)F)NC4=O)/C(=O)C3=C2)O	IC50 ~ 100000 nM	Poor binder
T09826	DNA topoisomerase I	BV65GQ	Aesculioside IIIc	Investigative	46888313	C57H90O23	1143.3	CCC(C)C(=O)O[C@H]1[C@@H](C(C[C@@H]2[C@]1([C@@H]([C@@H]([C@@]3(C2=CC[C@H]4[C@]3(CC[C@@H]5[C@@]4(CC[C@@H](C5(C)C)O[C@H]6[C@@H]([C@H]([C@@H]([C@H](O6)C(=O)O)O)O[C@H]7[C@@H]([C@H]([C@@H](O7)CO)O)O)O[C@H]8[C@@H]([C@H]([C@H]([C@H](O8)CO)O)O)O)C)C)C)O)O)CO)(C)C)OC(=O)/C(=C/C)/C	IC50 = 131700 nM	Poor binder
T09826	DNA topoisomerase I	BVQ53G	6-(1-Hydroxyethyl)-5,8-dimethoxy-1,4-naphthoquinone	Investigative	13714338	C14H14O5	262.26	CC(C1=CC(=C2C(=O)C=CC(=O)C2=C1OC)OC)O	IC50 = 110630 nM	Poor binder
T09826	DNA topoisomerase I	BVU8Z2	(5E)-5-[[4-(6-Methoxypyridin-3-yl)thiophen-2-yl]methylidene]imidazolidine-2,4-dione	Investigative	122192379	C14H11N3O3S	301.32	COC1=NC=C(C=C1)C2=CSC(=C2)/C=C/3\\C(=O)NC(=O)N3	EC50 ~ 100000 nM	Poor binder
T09826	DNA topoisomerase I	BWS0I1	(5E)-5-[(4-Bromothiophen-2-yl)methylidene]imidazolidine-2,4-dione	Investigative	1277565	C8H5BrN2O2S	273.11	C1=C(SC=C1Br)/C=C/2\\C(=O)NC(=O)N2	EC50 ~ 100000 nM	Poor binder
T09826	DNA topoisomerase I	BX6KP8	6-(4-Methylpiperazin-1-yl)-2-[2-[4-(6-prop-2-ynoxyhexoxy)phenyl]-3H-benzimidazol-5-yl]-1H-benzimidazole	Investigative	134157712	C34H38N6O2	562.7	CN1CCN(CC1)C2=CC3=C(C=C2)N=C(N3)C4=CC5=C(C=C4)N=C(N5)C6=CC=C(C=C6)OCCCCCCOCC#C	IC50 ~ 50000 nM	Poor binder
T09826	DNA topoisomerase I	BX8BU4	(5E)-5-[(4-Nitrophenyl)methylidene]-2-sulfanylideneimidazolidin-4-one	Investigative	6382696	C10H7N3O3S	249.25	C1=CC(=CC=C1/C=C/2\\C(=O)NC(=S)N2)[N+](=O)[O-]	EC50 ~ 100000 nM	Poor binder
T09826	DNA topoisomerase I	BXT06N	5-(4-Methylbenzylidene)imidazolidine-2,4-dione	Investigative	697030	C11H10N2O2	202.21	CC1=CC=C(C=C1)/C=C/2\\C(=O)NC(=O)N2	EC50 ~ 100000 nM	Poor binder
T09826	DNA topoisomerase I	BXU82Y	10-(4-Bromophenyl)-5,15,20-tris(4-pyridyl)-21H,23H-porphyrin	Investigative	135407394	C41H26BrN7	696.6	C1=CC(=CC=C1C2=C3C=CC(=C(C4=NC(=C(C5=CC=C(N5)C(=C6C=CC2=N6)C7=CC=NC=C7)C8=CC=NC=C8)C=C4)C9=CC=NC=C9)N3)Br	EC50 ~ 50000 nM	Poor binder
T09826	DNA topoisomerase I	BY7B2M	Chembl4169913	Investigative	145953065	C22H15F3N2	364.4	CC1=C(C2=C(C=CC=N2)N=C1C3=CC=C(C=C3)C(F)(F)F)C4=CC=CC=C4	IC50 = 70610 nM	Poor binder
T09826	DNA topoisomerase I	BZ3BK1	5,15-Bis(4-bromophenyl)-10,20-bis(4-pyridyl)-21H,23H-porphyrin	Investigative	136726274	C42H26Br2N6	774.5	C1=CC(=CC=C1C2=C3C=CC(=C(C4=NC(=C(C5=CC=C(N5)C(=C6C=CC2=N6)C7=CC=NC=C7)C8=CC=C(C=C8)Br)C=C4)C9=CC=NC=C9)N3)Br	EC50 ~ 50000 nM	Poor binder
T09826	DNA topoisomerase I	BZ74VT	4-[4-[10-[4-(4-Aminophenyl)phenyl]-15,20-dipyridin-4-yl-21,23-dihydroporphyrin-5-yl]phenyl]aniline	Investigative	137638477	C54H38N8	798.9	C1=CC(=CC=C1C2=CC=C(C=C2)N)C3=C4C=CC(=C(C5=NC(=C(C6=CC=C(N6)C(=C7C=CC3=N7)C8=CC=C(C=C8)C9=CC=C(C=C9)N)C1=CC=NC=C1)C=C5)C1=CC=NC=C1)N4	EC50 = 63430 nM	Poor binder
T09826	DNA topoisomerase I	BZP9S8	(11E)-9-Methoxy-11-(2-piperidin-1-ylethoxyimino)-5H-indeno[1,2-c]quinolin-6-one	Investigative	135939144	C24H25N3O3	403.5	COC1=CC\\2=C(C=C1)C3=C(/C2=N/OCCN4CCCCC4)C5=CC=CC=C5NC3=O	IC50 ~ 100000 nM	Poor binder
T09826	DNA topoisomerase I	D05ZVR	Netropsin	Investigative	4461	C18H26N10O3	430.5	CN1C=C(C=C1C(=O)NC2=CN(C(=C2)C(=O)NCCC(=N)N)C)NC(=O)CN=C(N)N	IC50 = 62000 nM	Poor binder
T09826	DNA topoisomerase I	D0G2JZ	Bisbenzimide (Hoechst 33258)	Investigative	1464	C27H28N6O	452.6	CCOC1=CC=C(C=C1)C2=NC3=C(N2)C=C(C=C3)C4=NC5=C(N4)C=C(C=C5)N6CCN(CC6)C	IC50 ~ 50000 nM	Poor binder