TTD_Target_ID	Target_Name	TTD_Drug_ID	Drug_Name	Drug_Highest_Status	Drug_PubchemID	Molecular_Formula	Molecular_Weight	Canonical_SMILES	Activity	Binder_Type
T23499	Endothelin A receptor	B03ADV	N-(3,4-Dimethyl-isoxazol-5-yl)-2,4,6-trimethyl-benzenesulfonamide	Investigative	18617394	C14H18N2O3S	294.37	CC1=CC(=C(C(=C1)C)S(=O)(=O)NC2=C(C(=NO2)C)C)C	IC50 = 53000 nM	Poor binder
T23499	Endothelin A receptor	B2I6EP	N-[2-(3,4-Dimethoxyphenyl)ethyl]-3-[[4-[2-[(3,4-dimethyl-1,2-oxazol-5-yl)sulfamoyl]phenyl]phenyl]methyl]-7-methyl-2-propylbenzimidazole-5-carboxamide	Investigative	127035545	C40H43N5O6S	721.9	CCCC1=NC2=C(N1CC3=CC=C(C=C3)C4=CC=CC=C4S(=O)(=O)NC5=C(C(=NO5)C)C)C=C(C=C2C)C(=O)NCCC6=CC(=C(C=C6)OC)OC	IC50 = 55000 nM	Poor binder
T23499	Endothelin A receptor	B2T8EF	(3S)-3-[[(2S)-2-[[(2S)-2-Acetamido-3-(1H-imidazol-5-yl)propanoyl]amino]-4-methylpentanoyl]amino]-4-[(2S)-2-[[(2S,3S)-1-[[(1S)-1-carboxy-2-(1H-indol-3-yl)ethyl]amino]-3-methyl-1-oxopentan-2-yl]carbamoyl]pyrrolidin-1-yl]-4-oxobutanoic acid	Investigative	73351511	C40H55N9O10	821.9	CC[C@H](C)[C@@H](C(=O)N[C@@H](CC1=CNC2=CC=CC=C21)C(=O)O)NC(=O)[C@@H]3CCCN3C(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC4=CN=CN4)NC(=O)C	IC50 ~ 50000 nM	Poor binder
T23499	Endothelin A receptor	B2YMZ0	4-Dimethylamino-N-(3,4-dimethyl-isoxazol-5-yl)-benzenesulfonamide	Investigative	14973488	C13H17N3O3S	295.36	CC1=C(ON=C1C)NS(=O)(=O)C2=CC=C(C=C2)N(C)C	IC50 = 84000 nM	Poor binder
T23499	Endothelin A receptor	B4G5FW	(2S,4S)-5,8-Dimethoxy-6-methyl-4-phenyl-1,2,3,4-tetrahydronaphthalene-2-carboxylic Acid	Investigative	10336497	C20H22O4	326.4	CC1=CC(=C2C[C@H](C[C@H](C2=C1OC)C3=CC=CC=C3)C(=O)O)OC	IC50 = 160000 nM	Poor binder
T23499	Endothelin A receptor	B6D1FU	(2E,4E)-Hexa-2,4-dienoic acid (5R,9aS,9bS)-1,9b-dihydroxy-6,6,9a-trimethyl-1,3,5,5a,6,7,8,9,9a,9b-decahydro-naphtho[1,2-c]furan-5-yl ester	Investigative	44383536	C21H30O5	362.5	C/C=C/C=C/C(=O)O[C@@H]1C=C2COC([C@@]2([C@@]3(C1C(CCC3)(C)C)C)O)O	IC50 = 50000 nM	Poor binder
T23499	Endothelin A receptor	B6E1CW	(2E,4E,6E)-Octa-2,4,6-trienoic acid (5R,9aS,9bS)-9b-hydroxy-6,6,9a-trimethyl-1-oxo-1,3,5,5a,6,7,8,9,9a,9b-decahydro-naphtho[1,2-c]furan-5-yl ester	Investigative	44383592	C23H30O5	386.5	C/C=C/C=C/C=C/C(=O)O[C@@H]1C=C2COC(=O)[C@@]2([C@@]3(C1C(CCC3)(C)C)C)O	IC50 = 135000 nM	Poor binder
T23499	Endothelin A receptor	B6GRU0	Histidyl-leucyl-aspartyl-isoleucyl-isoleucyl-tryptophan	Investigative	129432	C39H57N9O9	795.9	CC[C@H](C)[C@@H](C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](CC1=CNC2=CC=CC=C21)C(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC3=CN=CN3)N	IC50 ~ 50000 nM	Poor binder
T23499	Endothelin A receptor	B6M9DI	(5S,6R,7R)-5-(3,4-Dimethoxyphenyl)-4-methoxy-6,7-bis(methoxymethyl)-5,6,7,8-tetrahydrobenzo[f][1,3]benzodioxole	Investigative	10477792	C24H30O7	430.5	COC[C@@H]1CC2=CC3=C(C(=C2[C@@H]([C@H]1COC)C4=CC(=C(C=C4)OC)OC)OC)OCO3	IC50 = 75000 nM	Poor binder
T23499	Endothelin A receptor	B7F0PA	3-{2-[2-Acetylamino-3-(3H-imidazol-4-yl)-propionylamino]-4-methyl-pentanoylamino}-N-(1-{1-[1-carboxy-2-(1H-indol-3-yl)-ethylcarbamoyl]-2-methyl-butylcarbamoyl}-2-methyl-butyl)-succinamic acid	Investigative	44284385	C41H59N9O10	838	CC[C@H](C)[C@@H](C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](CC1=CNC2=CC=CC=C21)C(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC3=CN=CN3)NC(=O)C	IC50 ~ 50000 nM	Poor binder
T23499	Endothelin A receptor	B9EXN1	(2S)-2-[[(2S,3S)-2-[[(2S)-1-[(2S)-2-[[(2S)-2-[[(2S)-2-Acetamido-3-(1H-imidazol-5-yl)propanoyl]amino]-4-methylpentanoyl]amino]-4-amino-4-oxobutanoyl]pyrrolidine-2-carbonyl]amino]-3-methylpentanoyl]amino]-3-(1H-indol-3-yl)propanoic acid	Investigative	73352983	C40H56N10O9	820.9	CC[C@H](C)[C@@H](C(=O)N[C@@H](CC1=CNC2=CC=CC=C21)C(=O)O)NC(=O)[C@@H]3CCCN3C(=O)[C@H](CC(=O)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC4=CN=CN4)NC(=O)C	IC50 ~ 50000 nM	Poor binder
T23499	Endothelin A receptor	B9J4QG	3-Anthracen-9-yl-2-benzo[1,3]dioxol-5-yl-propionic acid methyl ester	Investigative	44332641	C25H20O4	384.4	COC(=O)C(CC1=C2C=CC=CC2=CC3=CC=CC=C31)C4=CC5=C(C=C4)OCO5	IC50 = 76000 nM	Poor binder
T23499	Endothelin A receptor	BBJ2Z9	Acridin-9-yl-benzo[1,3]dioxol-5-yl-acetic acid benzyl ester	Investigative	44332807	C29H21NO4	447.5	C1OC2=C(O1)C=C(C=C2)C(C3=C4C=CC=CC4=NC5=CC=CC=C53)C(=O)OCC6=CC=CC=C6	IC50 = 57000 nM	Poor binder
T23499	Endothelin A receptor	BE4J2F	Benzo[1,3]dioxol-5-yl-(2-methyl-quinolin-4-yl)-acetic acid methyl ester	Investigative	44332803	C20H17NO4	335.4	CC1=NC2=CC=CC=C2C(=C1)C(C3=CC4=C(C=C3)OCO4)C(=O)OC	IC50 = 61000 nM	Poor binder
T23499	Endothelin A receptor	BF68GB	2-(6-Oxo-3-phenylmethoxy-11H-benzo[b][1,4]benzodiazepin-5-yl)acetic acid	Investigative	19934540	C22H18N2O4	374.4	C1=CC=C(C=C1)COC2=CC3=C(C=C2)NC4=CC=CC=C4C(=O)N3CC(=O)O	Ki = 109000 nM	Poor binder
T23499	Endothelin A receptor	BFY8E1	(2S)-2-[[(2S,3S)-2-[[(2S)-1-[(2S)-2-[[(2S)-2-[[(2R)-2-Acetamido-3-(1H-imidazol-5-yl)propanoyl]amino]-4-methylpentanoyl]amino]-4-amino-4-oxobutanoyl]pyrrolidine-2-carbonyl]amino]-3-methylpentanoyl]amino]-3-(1H-indol-3-yl)propanoic acid	Investigative	73348424	C40H56N10O9	820.9	CC[C@H](C)[C@@H](C(=O)N[C@@H](CC1=CNC2=CC=CC=C21)C(=O)O)NC(=O)[C@@H]3CCCN3C(=O)[C@H](CC(=O)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](CC4=CN=CN4)NC(=O)C	IC50 ~ 50000 nM	Poor binder
T23499	Endothelin A receptor	BJ5GW0	2-[3-(1H-Indole-3-carbonylamino)-6-oxo-11-propylbenzo[b][1,4]benzodiazepin-5-yl]acetic acid	Investigative	19934535	C27H24N4O4	468.5	CCCN1C2=C(C=C(C=C2)NC(=O)C3=CNC4=CC=CC=C43)N(C(=O)C5=CC=CC=C51)CC(=O)O	Ki = 80000 nM	Poor binder
T23499	Endothelin A receptor	BKWG67	Phe-Leu-Asp-Ile-Ile-Trp	Investigative	44321125	C42H59N7O9	806	CC[C@H](C)[C@@H](C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](CC1=CNC2=CC=CC=C21)C(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC3=CC=CC=C3)N	IC50 ~ 100000 nM	Poor binder
T23499	Endothelin A receptor	BLM93Z	Sulfathiazole	Investigative	5340	C9H9N3O2S2	255.3	C1=CC(=CC=C1N)S(=O)(=O)NC2=NC=CS2	IC50 = 69000 nM	Poor binder
T23499	Endothelin A receptor	BOQX95	Acridin-9-yl-benzo[1,3]dioxol-5-yl-acetic acid tert-butyl ester	Investigative	44332578	C26H23NO4	413.5	CC(C)(C)OC(=O)C(C1=CC2=C(C=C1)OCO2)C3=C4C=CC=CC4=NC5=CC=CC=C53	IC50 = 66000 nM	Poor binder
T23499	Endothelin A receptor	BP0JH9	(2R,3R,4S)-4-(1,3-Benzodioxol-5-yl)-1-[2-[bis(2-methylphenyl)methylamino]-2-oxoethyl]-2-[4-(2-propan-2-yloxyethoxy)phenyl]pyrrolidine-3-carboxylic acid;2,2,2-trifluoroacetic acid	Investigative	44347539	C42H45F3N2O9	778.8	CC1=CC=CC=C1C(C2=CC=CC=C2C)NC(=O)CN3C[C@@H]([C@H]([C@@H]3C4=CC=C(C=C4)OCCOC(C)C)C(=O)O)C5=CC6=C(C=C5)OCO6.C(=O)(C(F)(F)F)O	IC50 = 51703 nM	Poor binder
T23499	Endothelin A receptor	BP49NJ	N-Tert-butyl-3-[[4-[2-[(3,4-dimethyl-1,2-oxazol-5-yl)sulfamoyl]phenyl]phenyl]methyl]-7-methyl-2-propylbenzimidazole-5-carboxamide	Investigative	127037497	C34H39N5O4S	613.8	CCCC1=NC2=C(N1CC3=CC=C(C=C3)C4=CC=CC=C4S(=O)(=O)NC5=C(C(=NO5)C)C)C=C(C=C2C)C(=O)NC(C)(C)C	IC50 = 140000 nM	Poor binder
T23499	Endothelin A receptor	BQAH36	2-(2,4,6-Trimethyl-phenoxymethyl)-thiophene-3-sulfonic acid (4-bromo-3-methyl-isoxazol-5-yl)-amide	Investigative	23445457	C18H19BrN2O4S2	471.4	CC1=CC(=C(C(=C1)C)OCC2=C(C=CS2)S(=O)(=O)NC3=C(C(=NO3)C)Br)C	IC50 = 62000 nM	Poor binder
T23499	Endothelin A receptor	BRN68Z	2-[3-(Naphthalene-1-carbonylamino)-6-oxo-11-propylbenzo[b][1,4]benzodiazepin-5-yl]acetic acid	Investigative	44320537	C29H25N3O4	479.5	CCCN1C2=C(C=C(C=C2)NC(=O)C3=CC=CC4=CC=CC=C43)N(C(=O)C5=CC=CC=C51)CC(=O)O	Ki = 83000 nM	Poor binder
T23499	Endothelin A receptor	BUC56A	3-[[4-[2-[(3,4-Dimethyl-1,2-oxazol-5-yl)sulfamoyl]phenyl]phenyl]methyl]-N-[2-(4-methoxyphenyl)ethyl]-7-methyl-2-propylbenzimidazole-5-carboxamide	Investigative	127035380	C39H41N5O5S	691.8	CCCC1=NC2=C(N1CC3=CC=C(C=C3)C4=CC=CC=C4S(=O)(=O)NC5=C(C(=NO5)C)C)C=C(C=C2C)C(=O)NCCC6=CC=C(C=C6)OC	IC50 = 200000 nM	Poor binder
T23499	Endothelin A receptor	BUH76G	N-(3,4-Dimethylisoxazol-5-yl)-4-nitrobenzenesulfonamide	Investigative	22616255	C11H11N3O5S	297.29	CC1=C(ON=C1C)NS(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-]	IC50 = 90000 nM	Poor binder
T23499	Endothelin A receptor	BUY9R8	(2E,4E,6E)-Octa-2,4,6-trienoic acid (5R,9aS,9bS)-1,9b-dihydroxy-6,6,9a-trimethyl-1,3,5,5a,6,7,8,9,9a,9b-decahydro-naphtho[1,2-c]furan-5-yl ester	Investigative	44383537	C23H32O5	388.5	C/C=C/C=C/C=C/C(=O)O[C@@H]1C=C2COC([C@@]2([C@@]3(C1C(CCC3)(C)C)C)O)O	IC50 = 62000 nM	Poor binder
T23499	Endothelin A receptor	BYE0F1	3-[[4-[2-[(3,4-Dimethyl-1,2-oxazol-5-yl)sulfamoyl]phenyl]phenyl]methyl]-N-[2-(4-fluorophenyl)ethyl]-7-methyl-2-propylbenzimidazole-5-carboxamide	Investigative	127034757	C38H38FN5O4S	679.8	CCCC1=NC2=C(N1CC3=CC=C(C=C3)C4=CC=CC=C4S(=O)(=O)NC5=C(C(=NO5)C)C)C=C(C=C2C)C(=O)NCCC6=CC=C(C=C6)F	IC50 = 56000 nM	Poor binder
T23499	Endothelin A receptor	BZ1H7E	2-Acridin-9-yl-2-benzo[1,3]dioxol-5-yl-acetamide	Investigative	44332624	C22H16N2O3	356.4	C1OC2=C(O1)C=C(C=C2)C(C3=C4C=CC=CC4=NC5=CC=CC=C53)C(=O)N	IC50 = 77000 nM	Poor binder