TTD_Target_ID	Target_Name	TTD_Drug_ID	Drug_Name	Drug_Highest_Status	Drug_PubchemID	Molecular_Formula	Molecular_Weight	Canonical_SMILES	Activity	Binder_Type
T78709	5-HT 1A receptor	D0Y3DN	Flavonoid derivative 4	Patented	5280343	C15H10O7	302.23	C1=CC(=C(C=C1C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)O)O)O	EC50 ~ 100000 nM	Poor binder
T78709	5-HT 1A receptor	B04WHU	Synephrine	Investigative	7172	C9H13NO2	167.2	CNCC(C1=CC=C(C=C1)O)O	Ki = 63000 nM	Poor binder
T78709	5-HT 1A receptor	B2QME1	Hyperoside	Investigative	5281643	C21H20O12	464.4	C1=CC(=C(C=C1C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)O[C@H]4[C@@H]([C@H]([C@H]([C@H](O4)CO)O)O)O)O)O	Ki ~ 100000 nM	Poor binder
T78709	5-HT 1A receptor	B35AWE	7-(4-Phenylpiperazin-1-yl)-2,8,13-triazatricyclo[7.4.0.02,6]trideca-1(9),3,5,7,10,12-hexaene	Investigative	10853821	C20H19N5	329.4	C1CN(CCN1C2=CC=CC=C2)C3=NC4=C(N=CC=C4)N5C3=CC=C5	IC50 ~ 100000 nM	Poor binder
T78709	5-HT 1A receptor	B39WUA	Chembl4210128	Investigative	145964982	C25H29FN4O3	452.5	C1CC1NC(=O)C2=CC(=NC=C2)OCCCCN3CCC(CC3)C4=NOC5=C4C=CC(=C5)F	EC50 ~ 100000 nM	Poor binder
T78709	5-HT 1A receptor	B3B8UO	8-(4-Benzylpiperazin-1-yl)-4-phenyl-3-thia-1,7-diazatricyclo[7.3.0.02,6]dodeca-2(6),4,7,9,11-pentaene	Investigative	10502452	C26H24N4S	424.6	C1CN(CCN1CC2=CC=CC=C2)C3=NC4=C(N5C3=CC=C5)SC(=C4)C6=CC=CC=C6	IC50 ~ 100000 nM	Poor binder
T78709	5-HT 1A receptor	B3UF9I	7-[4-[(2,4-Dichlorophenyl)methyl]piperazin-1-yl]-2,8,13-triazatricyclo[7.4.0.02,6]trideca-1(9),3,5,7,10,12-hexaene	Investigative	10645335	C21H19Cl2N5	412.3	C1CN(CCN1CC2=C(C=C(C=C2)Cl)Cl)C3=NC4=C(N=CC=C4)N5C3=CC=C5	IC50 = 61659.5 nM	Poor binder
T78709	5-HT 1A receptor	B4CB9W	Chembl4218526	Investigative	145969167	C24H29FN4O3	440.5	CCNC(=O)C1=CC(=CN=C1)OCCCCN2CCC(CC2)C3=NOC4=C3C=CC(=C4)F	EC50 ~ 100000 nM	Poor binder
T78709	5-HT 1A receptor	B4MT9F	Cacticin	Investigative	5318644	C22H22O12	478.4	COC1=C(C=CC(=C1)C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)O[C@H]4[C@@H]([C@H]([C@H]([C@H](O4)CO)O)O)O)O	Ki ~ 100000 nM	Poor binder
T78709	5-HT 1A receptor	B4R7OD	Chembl4280940	Investigative	14576389	C25H30FN3O3	439.5	C1C[C@H]2C[C@@H]1[C@H]3[C@@H]2C(=O)N(C3=O)CCCCN4CCC(CC4)C5=NOC6=C5C=CC(=C6)F	EC50 ~ 100000 nM	Poor binder
T78709	5-HT 1A receptor	B5SAI7	Chembl4284353	Investigative	145991244	C23H29N3O2S	411.6	CC1(C2C1C(=O)N(C2=O)CCCCN3CCN(CC3)C4=C5C=CSC5=CC=C4)C	EC50 ~ 100000 nM	Poor binder
T78709	5-HT 1A receptor	B5ZG4K	Chembl4205772	Investigative	145975393	C23H27FN4O3	426.5	CNC(=O)C1=NC(=CC=C1)OCCCCN2CCC(CC2)C3=NOC4=C3C=CC(=C4)F	EC50 ~ 100000 nM	Poor binder
T78709	5-HT 1A receptor	B67YHI	6-Chloro-3-(4-(3-(2-chloro-4-fluorophenyl)-1,2,4-oxadiazol-5-yl)piperidin-1-yl)quinoline	Investigative	24894134	C22H17Cl2FN4O	443.3	C1CN(CCC1C2=NC(=NO2)C3=C(C=C(C=C3)F)Cl)C4=CN=C5C=CC(=CC5=C4)Cl	EC50 ~ 50000 nM	Poor binder
T78709	5-HT 1A receptor	B69JEU	Rutaecarpine	Investigative	65752	C18H13N3O	287.3	C1CN2C(=NC3=CC=CC=C3C2=O)C4=C1C5=CC=CC=C5N4	Ki ~ 100000 nM	Poor binder
T78709	5-HT 1A receptor	B7EMY0	Limonin	Investigative	179651	C26H30O8	470.5	C[C@@]12CC[C@H]3[C@]([C@@]14[C@H](O4)C(=O)O[C@H]2C5=COC=C5)(C(=O)C[C@@H]6[C@@]37COC(=O)C[C@@H]7OC6(C)C)C	Ki ~ 100000 nM	Poor binder
T78709	5-HT 1A receptor	B7JUN4	8-(4-Benzylpiperazin-1-yl)-4,5-dimethyl-3-thia-1,7-diazatricyclo[7.3.0.02,6]dodeca-2(6),4,7,9,11-pentaene	Investigative	10809561	C22H24N4S	376.5	CC1=C(SC2=C1N=C(C3=CC=CN32)N4CCN(CC4)CC5=CC=CC=C5)C	IC50 = 125892.54 nM	Poor binder
T78709	5-HT 1A receptor	B80UPR	7-(4-Benzylpiperazin-1-yl)-10-methyl-2,8,13-triazatricyclo[7.4.0.02,6]trideca-1(13),3,5,7,9,11-hexaene	Investigative	10498554	C22H23N5	357.5	CC1=C2C(=NC=C1)N3C=CC=C3C(=N2)N4CCN(CC4)CC5=CC=CC=C5	IC50 = 50118.72 nM	Poor binder
T78709	5-HT 1A receptor	B8QU5M	2-[4-[4-(6-Nitroquinolin-2-yl)piperazin-1-yl]butyl]isoindole-1,3-dione	Investigative	57381318	C25H25N5O4	459.5	C1CN(CCN1CCCCN2C(=O)C3=CC=CC=C3C2=O)C4=NC5=C(C=C4)C=C(C=C5)[N+](=O)[O-]	Ki = 59000 nM	Poor binder
T78709	5-HT 1A receptor	B8TGK3	4-Phenyl-8-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]-3-thia-1,7-diazatricyclo[7.3.0.02,6]dodeca-2(6),4,7,9,11-pentaene	Investigative	10790813	C26H21F3N4S	478.5	C1CN(CCN1C2=CC=CC(=C2)C(F)(F)F)C3=NC4=C(N5C3=CC=C5)SC(=C4)C6=CC=CC=C6	IC50 ~ 100000 nM	Poor binder
T78709	5-HT 1A receptor	B8WCY1	4-(4-Benzylpiperazin-1-yl)-8-chloropyrrolo[1,2-a]quinoxaline	Investigative	10619583	C22H21ClN4	376.9	C1CN(CCN1CC2=CC=CC=C2)C3=NC4=C(C=C(C=C4)Cl)N5C3=CC=C5	IC50 = 89125.09 nM	Poor binder
T78709	5-HT 1A receptor	B8XER2	(1S,12S)-23,23-Dimethyl-5,7,17-trioxa-23-azoniahexacyclo[10.10.1.02,10.04,8.013,21.015,19]tricosa-2,4(8),9,13,15(19),20-hexaene;chloride	Investigative	45266443	C21H22ClNO3	371.9	C[N+]1([C@H]2CC3=CC4=C(COC4)C=C3[C@@H]1CC5=CC6=C(C=C25)OCO6)C.[Cl-]	EC50 ~ 100000 nM	Poor binder
T78709	5-HT 1A receptor	B9I1VO	7-(4-Benzylpiperazin-1-yl)-12-phenylmethoxy-2,8,13-triazatricyclo[7.4.0.02,6]trideca-1(9),3,5,7,10,12-hexaene	Investigative	11797762	C28H27N5O	449.5	C1CN(CCN1CC2=CC=CC=C2)C3=NC4=C(N=C(C=C4)OCC5=CC=CC=C5)N6C3=CC=C6	IC50 = 54954.09 nM	Poor binder
T78709	5-HT 1A receptor	BC0AL9	Pseudoprotopine	Investigative	185559	C20H19NO5	353.4	CN1CCC2=CC3=C(C=C2C(=O)CC4=CC5=C(C=C4C1)OCO5)OCO3	EC50 ~ 100000 nM	Poor binder
T78709	5-HT 1A receptor	BC3ND2	8-[(1-Ethylpiperidin-4-yl)methoxy]-3-thia-1,7-diazatricyclo[7.3.0.02,6]dodeca-2(6),4,7,9,11-pentaene	Investigative	9861687	C17H21N3OS	315.4	CCN1CCC(CC1)COC2=NC3=C(N4C2=CC=C4)SC=C3	IC50 ~ 100000 nM	Poor binder
T78709	5-HT 1A receptor	BEX95F	Chembl4202520	Investigative	145975992	C24H28FN3O	393.5	C1CN(CCC1C2=CC=C(C=C2)F)CCN3CCC4(C3)C5=CC=CC=C5NC4=O	Ki = 52010 nM	Poor binder
T78709	5-HT 1A receptor	BFD9Q2	Chembl4282051	Investigative	145981310	C26H31N3O2S	449.6	C1CN(CCN1CCCCCN2C(=O)[C@@H]3[C@@H]4C[C@H]([C@@H]3C2=O)C=C4)C5=C6C=CSC6=CC=C5	EC50 ~ 100000 nM	Poor binder
T78709	5-HT 1A receptor	BHJV91	Chembl4213576	Investigative	18133517	C19H23BrN2O3S	439.4	C1CN(CCC1NS(=O)(=O)C2=CC=CC=C2)CCOC3=CC=C(C=C3)Br	Ki = 52610 nM	Poor binder
T78709	5-HT 1A receptor	BI2EY5	8-Piperidin-1-yl-3-thia-1,7-diazatricyclo[7.3.0.02,6]dodeca-2(6),4,7,9,11-pentaene	Investigative	10539093	C14H15N3S	257.36	C1CCN(CC1)C2=NC3=C(N4C2=CC=C4)SC=C3	IC50 = 64565.42 nM	Poor binder
T78709	5-HT 1A receptor	BIW6P5	7,12-Bis(4-benzylpiperazin-1-yl)-2,8,13-triazatricyclo[7.4.0.02,6]trideca-1(9),3,5,7,10,12-hexaene	Investigative	10553922	C32H35N7	517.7	C1CN(CCN1CC2=CC=CC=C2)C3=NC4=C(C=C3)N=C(C5=CC=CN54)N6CCN(CC6)CC7=CC=CC=C7	IC50 ~ 100000 nM	Poor binder
T78709	5-HT 1A receptor	BJ2P7U	Ethyl 4-(2,8,13-triazatricyclo[7.4.0.02,6]trideca-1(9),3,5,7,10,12-hexaen-7-yl)piperazine-1-carboxylate	Investigative	10663820	C17H19N5O2	325.4	CCOC(=O)N1CCN(CC1)C2=NC3=C(N=CC=C3)N4C2=CC=C4	IC50 ~ 100000 nM	Poor binder
T78709	5-HT 1A receptor	BJ62BY	Chembl4217039	Investigative	145972382	C25H29FN4O3	452.5	C1CC1NC(=O)C2=CC(=CN=C2)OCCCCN3CCC(CC3)C4=NOC5=C4C=CC(=C5)F	EC50 ~ 100000 nM	Poor binder
T78709	5-HT 1A receptor	BJ6W9A	8-(4-Phenylpiperidin-1-yl)-3-thia-1,7-diazatricyclo[7.3.0.02,6]dodeca-2(6),4,7,9,11-pentaene	Investigative	10568666	C20H19N3S	333.5	C1CN(CCC1C2=CC=CC=C2)C3=NC4=C(N5C3=CC=C5)SC=C4	IC50 ~ 100000 nM	Poor binder
T78709	5-HT 1A receptor	BM7LV1	4-Phenyl-8-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]-5-thia-1,7-diazatricyclo[7.3.0.02,6]dodeca-2(6),3,7,9,11-pentaene	Investigative	10814515	C26H21F3N4S	478.5	C1CN(CCN1C2=CC=CC(=C2)C(F)(F)F)C3=NC4=C(C=C(S4)C5=CC=CC=C5)N6C3=CC=C6	IC50 ~ 100000 nM	Poor binder
T78709	5-HT 1A receptor	BO3H2X	8-(4-Phenylpiperazin-1-yl)-3-thia-1,7-diazatricyclo[7.3.0.02,6]dodeca-2(6),4,7,9,11-pentaene	Investigative	10496957	C19H18N4S	334.4	C1CN(CCN1C2=CC=CC=C2)C3=NC4=C(N5C3=CC=C5)SC=C4	IC50 ~ 100000 nM	Poor binder
T78709	5-HT 1A receptor	BPHB67	4-(4-Benzylpiperazin-1-yl)-7-chloropyrrolo[1,2-a]quinoxaline	Investigative	10738329	C22H21ClN4	376.9	C1CN(CCN1CC2=CC=CC=C2)C3=NC4=C(C=CC(=C4)Cl)N5C3=CC=C5	IC50 ~ 100000 nM	Poor binder
T78709	5-HT 1A receptor	BQHF10	7-[4-[(4-Fluorophenyl)methyl]piperazin-1-yl]-12-methoxy-2,8,13-triazatricyclo[7.4.0.02,6]trideca-1(9),3,5,7,10,12-hexaene	Investigative	10715484	C22H22FN5O	391.4	COC1=NC2=C(C=C1)N=C(C3=CC=CN32)N4CCN(CC4)CC5=CC=C(C=C5)F	IC50 = 56234.13 nM	Poor binder
T78709	5-HT 1A receptor	BR90PF	Chembl4204832	Investigative	145975595	C23H27FN4O3	426.5	CNC(=O)C1=CC(=NC=C1)OCCCCN2CCC(CC2)C3=NOC4=C3C=CC(=C4)F	EC50 ~ 100000 nM	Poor binder
T78709	5-HT 1A receptor	BSM3N9	7-[4-[(4-Fluorophenyl)methyl]piperazin-1-yl]-10-methyl-2,8,13-triazatricyclo[7.4.0.02,6]trideca-1(13),3,5,7,9,11-hexaene	Investigative	10714509	C22H22FN5	375.4	CC1=C2C(=NC=C1)N3C=CC=C3C(=N2)N4CCN(CC4)CC5=CC=C(C=C5)F	IC50 = 97723.72 nM	Poor binder
T78709	5-HT 1A receptor	BU3K2W	(4-Fluorophenyl)-[4-(3-thia-1,7-diazatricyclo[7.3.0.02,6]dodeca-2(6),4,7,9,11-pentaen-8-yl)piperazin-1-yl]methanone	Investigative	10547809	C20H17FN4OS	380.4	C1CN(CCN1C2=NC3=C(N4C2=CC=C4)SC=C3)C(=O)C5=CC=C(C=C5)F	IC50 = 102329.3 nM	Poor binder
T78709	5-HT 1A receptor	BUGW35	Chembl4213586	Investigative	145963975	C23H27FN4O3	426.5	CNC(=O)C1=CC(=CN=C1)OCCCCN2CCC(CC2)C3=NOC4=C3C=CC(=C4)F	EC50 ~ 100000 nM	Poor binder
T78709	5-HT 1A receptor	BVI90L	8-[4-(4-Chlorophenyl)piperazin-1-yl]-3-thia-1,7-diazatricyclo[7.3.0.02,6]dodeca-2(6),4,7,9,11-pentaene	Investigative	10523090	C19H17ClN4S	368.9	C1CN(CCN1C2=CC=C(C=C2)Cl)C3=NC4=C(N5C3=CC=C5)SC=C4	IC50 ~ 100000 nM	Poor binder
T78709	5-HT 1A receptor	BX3D8C	l-Evodiamine	Investigative	6971167	C19H17N3O	303.4	CN1[C@H]2C3=C(CCN2C(=O)C4=CC=CC=C41)C5=CC=CC=C5N3	Ki ~ 100000 nM	Poor binder
T78709	5-HT 1A receptor	BX63HT	Chembl4166667	Investigative	17055181	C23H24BrNO	410.3	CC1=CC=C(C=C1)COC2=C(C=C(C=C2)Br)CNC(C)C3=CC=CC=C3	Ki = 195600 nM	Poor binder
T78709	5-HT 1A receptor	BX86MC	Chembl4209705	Investigative	145965433	C24H29FN4O3	440.5	CCNC(=O)C1=CC(=NC=C1)OCCCCN2CCC(CC2)C3=NOC4=C3C=CC(=C4)F	EC50 ~ 100000 nM	Poor binder
T78709	5-HT 1A receptor	BYRB51	8-(4-Benzylpiperazino)pyrido[2,3-h]pyrrolo[1,2-a]quinoxaline	Investigative	10834414	C25H23N5	393.5	C1CN(CCN1CC2=CC=CC=C2)C3=NC4=C(C5=C(C=C4)N=CC=C5)N6C3=CC=C6	IC50 = 63095.73 nM	Poor binder
T78709	5-HT 1A receptor	D0Y1YR	gingerol	Investigative	442793	C17H26O4	294.4	CCCCC[C@@H](CC(=O)CCC1=CC(=C(C=C1)O)OC)O	Ki ~ 100000 nM	Poor binder