TTD_Target_ID	Target_Name	TTD_Drug_ID	Drug_Name	Drug_Highest_Status	Drug_PubchemID	Molecular_Formula	Molecular_Weight	Canonical_SMILES	Activity	Binder_Type
T77913	Histamine H1 receptor	D0D9FV	Orphenadrine	Approved	4601	C18H23NO	269.4	CC1=CC=CC=C1C(C2=CC=CC=C2)OCCN(C)C	IC50 = 97723.72 nM	Poor binder
T77913	Histamine H1 receptor	D0E1WI	Fentanyl	Approved	3345	C22H28N2O	336.5	CCC(=O)N(C1CCN(CC1)CCC2=CC=CC=C2)C3=CC=CC=C3	IC50 = 147910.84 nM	Poor binder
T77913	Histamine H1 receptor	B02ZDR	(4-(3-(4-((2s)-2-Aminopropanoyl)-1-piperazinyl)propoxy)phenyl)(cyclopropyl)methanone	Investigative	12016525	C20H29N3O3	359.5	C[C@@H](C(=O)N1CCN(CC1)CCCOC2=CC=C(C=C2)C(=O)C3CC3)N	Ki = 53703.18 nM	Poor binder
T77913	Histamine H1 receptor	B0E4ST	2-(3,4-Dichlorophenyl)-1H-imidazole-4-ethaneamine	Investigative	44369359	C11H11Cl2N3	256.13	C1=CC(=C(C=C1C2=NC=C(N2)CCN)Cl)Cl	IC50 = 50118.72 nM	Poor binder
T77913	Histamine H1 receptor	B0FLO8	((S)-1-{(S)-1-[3-(4-Acetyl-phenoxy)-propyl]-pyrrolidin-3-ylcarbamoyl}-2-hydroxy-ethyl)-carbamic acid tert-butyl ester	Investigative	44334556	C23H35N3O6	449.5	CC(=O)C1=CC=C(C=C1)OCCCN2CC[C@@H](C2)NC(=O)[C@H](CO)NC(=O)OC(C)(C)C	Ki = 75000 nM	Poor binder
T77913	Histamine H1 receptor	B29RUX	Adiphenine	Investigative	2031	C20H25NO2	311.4	CCN(CC)CCOC(=O)C(C1=CC=CC=C1)C2=CC=CC=C2	IC50 = 112201.85 nM	Poor binder
T77913	Histamine H1 receptor	B4T8SX	(2R)-2-Amino-1-[4-[3-[4-(cyclopropanecarbonyl)phenoxy]propyl]piperazin-1-yl]-3-(1,3-thiazol-2-yl)propan-1-one	Investigative	44304311	C23H30N4O3S	442.6	C1CC1C(=O)C2=CC=C(C=C2)OCCCN3CCN(CC3)C(=O)[C@@H](CC4=NC=CS4)N	Ki = 100000 nM	Poor binder
T77913	Histamine H1 receptor	B5EG2J	((S)-1-{(S)-1-[3-(4-Acetyl-phenoxy)-propyl]-pyrrolidin-3-ylcarbamoyl}-ethyl)-carbamic acid tert-butyl ester	Investigative	44333987	C23H35N3O5	433.5	C[C@@H](C(=O)N[C@H]1CCN(C1)CCCOC2=CC=C(C=C2)C(=O)C)NC(=O)OC(C)(C)C	Ki = 60000 nM	Poor binder
T77913	Histamine H1 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	IC50 ~ 50000 nM	Poor binder
T77913	Histamine H1 receptor	B7ORB1	1-[4-[3-[4-(Cyclopropanecarbonyl)phenoxy]propyl]piperazin-1-yl]-2-(methylamino)ethanone	Investigative	44304067	C20H29N3O3	359.5	CNCC(=O)N1CCN(CC1)CCCOC2=CC=C(C=C2)C(=O)C3CC3	Ki = 100000 nM	Poor binder
T77913	Histamine H1 receptor	B7R3OU	(2R)-2-Amino-1-[4-[3-[4-(cyclopropanecarbonyl)phenoxy]propyl]piperazin-1-yl]butan-1-one	Investigative	44304211	C21H31N3O3	373.5	CC[C@H](C(=O)N1CCN(CC1)CCCOC2=CC=C(C=C2)C(=O)C3CC3)N	Ki = 70794.58 nM	Poor binder
T77913	Histamine H1 receptor	B9HU8R	(+)-(S)-N,N-Dimethyl-2-(3-(1-(pyridin-3-yl)ethyl)benzo[b]thiophen-2-yl)ethanamine	Investigative	11515125	C19H22N2S	310.5	C[C@@H](C1=CN=CC=C1)C2=C(SC3=CC=CC=C32)CCN(C)C	Ki = 79000 nM	Poor binder
T77913	Histamine H1 receptor	B9OP0K	1-[4-[3-[4-(Cyclopropanecarbonyl)phenoxy]propyl]piperazin-1-yl]-2-[(2R)-pyrrolidin-2-yl]ethanone	Investigative	44304332	C23H33N3O3	399.5	C1C[C@@H](NC1)CC(=O)N2CCN(CC2)CCCOC3=CC=C(C=C3)C(=O)C4CC4	Ki = 95499.26 nM	Poor binder
T77913	Histamine H1 receptor	BJ40GP	(2R)-2-Amino-1-[4-[3-[4-(cyclopropanecarbonyl)phenoxy]propyl]piperazin-1-yl]-3-(1H-imidazol-5-yl)propan-1-one	Investigative	44304719	C23H31N5O3	425.5	C1CC1C(=O)C2=CC=C(C=C2)OCCCN3CCN(CC3)C(=O)[C@@H](CC4=CN=CN4)N	Ki = 95499.26 nM	Poor binder
T77913	Histamine H1 receptor	BO0QU4	(1-{(S)-1-[3-(4-Acetyl-phenoxy)-propyl]-pyrrolidin-3-ylcarbamoyl}-ethyl)-carbamic acid tert-butyl ester	Investigative	44334281	C23H35N3O5	433.5	C[C@H](C(=O)N[C@H]1CCN(C1)CCCOC2=CC=C(C=C2)C(=O)C)NC(=O)OC(C)(C)C	Ki = 56000 nM	Poor binder
T77913	Histamine H1 receptor	BO2I5Y	1-{4-[3-((S)-3-Amino-pyrrolidin-1-yl)-propoxy]-phenyl}-ethanone	Investigative	44334521	C15H22N2O2	262.35	CC(=O)C1=CC=C(C=C1)OCCCN2CC[C@@H](C2)N	Ki = 90000 nM	Poor binder
T77913	Histamine H1 receptor	BVEL93	(1-{(S)-1-[3-(4-Acetyl-phenoxy)-propyl]-pyrrolidin-3-ylcarbamoyl}-2-hydroxy-ethyl)-carbamic acid tert-butyl ester	Investigative	44334252	C23H35N3O6	449.5	CC(=O)C1=CC=C(C=C1)OCCCN2CC[C@@H](C2)NC(=O)[C@@H](CO)NC(=O)OC(C)(C)C	Ki = 80000 nM	Poor binder
T77913	Histamine H1 receptor	BZTC89	N-[(3S)-1-[3-[4-(Cyclopropylcarbonyl)phenoxy]propyl]pyrrolidine-3beta-yl]-1-methyl-1H-imidazole-4-sulfonamide	Investigative	44334234	C21H28N4O4S	432.5	CN1C=C(N=C1)S(=O)(=O)N[C@H]2CCN(C2)CCCOC3=CC=C(C=C3)C(=O)C4CC4	Ki = 91000 nM	Poor binder
T77913	Histamine H1 receptor	D05BYD	A-304121	Investigative	9906860	C20H29N3O3	359.5	C[C@H](C(=O)N1CCN(CC1)CCCOC2=CC=C(C=C2)C(=O)C3CC3)N	Ki = 69183.1 nM	Poor binder