TTD_Target_ID Target_Name TTD_Drug_ID Drug_Name Drug_Highest_Status Drug_PubchemID Molecular_Formula Molecular_Weight Canonical_SMILES Activity Binder_Type T13726 Retinoic acid receptor RXR-alpha D0Z5IU Sulindac Approved 1548887 C20H17FO3S 356.4 CC\\1=C(C2=C(/C1=C\\C3=CC=C(C=C3)S(=O)C)C=CC(=C2)F)CC(=O)O IC50 = 82900 nM Poor binder T13726 Retinoic acid receptor RXR-alpha B07JKC 2-[(3Z)-2,6-Dimethyl-3-[(4-propan-2-ylphenyl)methylidene]inden-1-yl]acetic acid Investigative 54588851 C23H24O2 332.4 CC1=CC2=C(C=C1)/C(=C\\C3=CC=C(C=C3)C(C)C)/C(=C2CC(=O)O)C IC50 ~ 100000 nM Poor binder T13726 Retinoic acid receptor RXR-alpha B0DM4T 2-[(3Z)-3-[[4-(Dimethylamino)phenyl]methylidene]-6-fluoro-2-methylinden-1-yl]acetic acid Investigative 10286680 C21H20FNO2 337.4 CC\\1=C(C2=C(/C1=C\\C3=CC=C(C=C3)N(C)C)C=CC(=C2)F)CC(=O)O IC50 ~ 100000 nM Poor binder T13726 Retinoic acid receptor RXR-alpha B0GDZ8 4-[5,7,7,10,10-Pentamethyl-2-(methylamino)-8,9-dihydronaphtho[2,3-b][1,5]benzodiazepin-12-yl]benzoic acid Investigative 44433353 C30H33N3O2 467.6 CC1(CCC(C2=C1C=C3C(=C2)N(C4=C(C=C(C=C4)NC)N=C3C5=CC=C(C=C5)C(=O)O)C)(C)C)C IC50 ~ 100000 nM Poor binder T13726 Retinoic acid receptor RXR-alpha B0ZD8Y 2-[(3Z)-3-[(3-Cyanophenyl)methylidene]-6-fluoro-2-methylinden-1-yl]acetic acid Investigative 54588816 C20H14FNO2 319.3 CC\\1=C(C2=C(/C1=C\\C3=CC(=CC=C3)C#N)C=CC(=C2)F)CC(=O)O IC50 ~ 100000 nM Poor binder T13726 Retinoic acid receptor RXR-alpha B1RL4V 2-[(3Z)-6-Fluoro-2-methyl-3-[(4-pyridin-2-ylphenyl)methylidene]inden-1-yl]acetic acid Investigative 54588856 C24H18FNO2 371.4 CC\\1=C(C2=C(/C1=C\\C3=CC=C(C=C3)C4=CC=CC=N4)C=CC(=C2)F)CC(=O)O IC50 ~ 100000 nM Poor binder T13726 Retinoic acid receptor RXR-alpha B3L4EI 2-[(3Z)-6-Fluoro-2-methyl-3-[(4-propan-2-ylphenyl)methylidene]inden-1-yl]acetamide Investigative 54589363 C22H22FNO 335.4 CC\\1=C(C2=C(/C1=C\\C3=CC=C(C=C3)C(C)C)C=CC(=C2)F)CC(=O)N IC50 ~ 100000 nM Poor binder T13726 Retinoic acid receptor RXR-alpha B59JQP 4-[2-(Butylamino)-5,7,7,10,10-pentamethyl-8,9-dihydronaphtho[2,3-b][1,5]benzodiazepin-12-yl]benzoic acid Investigative 44433354 C33H39N3O2 509.7 CCCCNC1=CC2=C(C=C1)N(C3=CC4=C(C=C3C(=N2)C5=CC=C(C=C5)C(=O)O)C(CCC4(C)C)(C)C)C IC50 ~ 100000 nM Poor binder T13726 Retinoic acid receptor RXR-alpha B5OHR7 2-[3-[(4-Methylphenyl)carbamoyl]-4-piperidin-1-ylphenyl]indazole-6-carboxylic acid Investigative 102004339 C27H26N4O3 454.5 CC1=CC=C(C=C1)NC(=O)C2=C(C=CC(=C2)N3C=C4C=CC(=CC4=N3)C(=O)O)N5CCCCC5 EC50 ~ 100000 nM Poor binder T13726 Retinoic acid receptor RXR-alpha B5RVP2 4-[(Z)-N-Ethoxy-C-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)carbonimidoyl]benzoic acid Investigative 10644298 C25H31NO3 393.5 CCO/N=C(/C1=CC=C(C=C1)C(=O)O)\\C2=CC3=C(C=C2C)C(CCC3(C)C)(C)C EC50 ~ 100000 nM Poor binder T13726 Retinoic acid receptor RXR-alpha B87SPI 2-[(3Z)-6-Chloro-2-methyl-3-[(4-propan-2-ylphenyl)methylidene]inden-1-yl]acetic acid Investigative 54588894 C22H21ClO2 352.9 CC\\1=C(C2=C(/C1=C\\C3=CC=C(C=C3)C(C)C)C=CC(=C2)Cl)CC(=O)O IC50 ~ 100000 nM Poor binder T13726 Retinoic acid receptor RXR-alpha B8JK1P 2-[(3Z)-6-Ethyl-2-methyl-3-[(4-propan-2-ylphenyl)methylidene]inden-1-yl]acetic acid Investigative 54588891 C24H26O2 346.5 CCC1=CC2=C(C=C1)/C(=C\\C3=CC=C(C=C3)C(C)C)/C(=C2CC(=O)O)C IC50 ~ 100000 nM Poor binder T13726 Retinoic acid receptor RXR-alpha BC10WA 2-[(3Z)-3-[(4-Tert-butylphenyl)methylidene]-6-fluoro-2-methylinden-1-yl]acetic acid Investigative 54588776 C23H23FO2 350.4 CC\\1=C(C2=C(/C1=C\\C3=CC=C(C=C3)C(C)(C)C)C=CC(=C2)F)CC(=O)O IC50 ~ 100000 nM Poor binder T13726 Retinoic acid receptor RXR-alpha BK6M3I 2-[(3Z)-3-[(4-Cyanophenyl)methylidene]-6-fluoro-2-methylinden-1-yl]acetic acid Investigative 54588815 C20H14FNO2 319.3 CC\\1=C(C2=C(/C1=C\\C3=CC=C(C=C3)C#N)C=CC(=C2)F)CC(=O)O IC50 ~ 100000 nM Poor binder T13726 Retinoic acid receptor RXR-alpha BR65OL 4-[(Z)-N-[(2-Methylpropan-2-yl)oxy]-C-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)carbonimidoyl]benzoic acid Investigative 10645862 C27H35NO3 421.6 CC1=CC2=C(C=C1/C(=N\\OC(C)(C)C)/C3=CC=C(C=C3)C(=O)O)C(CCC2(C)C)(C)C EC50 ~ 100000 nM Poor binder T13726 Retinoic acid receptor RXR-alpha BS3U7Q 2-[(3Z)-3-[(4-Ethoxyphenyl)methylidene]-6-fluoro-2-methylinden-1-yl]acetic acid Investigative 54588812 C21H19FO3 338.4 CCOC1=CC=C(C=C1)/C=C\\2/C(=C(C3=C2C=CC(=C3)F)CC(=O)O)C IC50 ~ 100000 nM Poor binder T13726 Retinoic acid receptor RXR-alpha BSG3K7 2-[(3Z)-2-Methyl-3-[(4-propan-2-ylphenyl)methylidene]inden-1-yl]acetic acid Investigative 54588850 C22H22O2 318.4 CC\\1=C(C2=CC=CC=C2/C1=C\\C3=CC=C(C=C3)C(C)C)CC(=O)O IC50 ~ 100000 nM Poor binder T13726 Retinoic acid receptor RXR-alpha BSMY03 4-[[(E)-Tert-Butoxyimino]-(3,5,5,8,8-pentamethyl-5,6,7,8-tetrahydro-naphthalen-2-yl)-methyl]-benzoic acid Investigative 10598286 C27H35NO3 421.6 CC1=CC2=C(C=C1/C(=N/OC(C)(C)C)/C3=CC=C(C=C3)C(=O)O)C(CCC2(C)C)(C)C EC50 ~ 100000 nM Poor binder T13726 Retinoic acid receptor RXR-alpha BTO28X 1-[(Z)-3-Methoxybenzylidene]-2-methyl-5-fluoro-1H-indene-3-acetic acid Investigative 44375294 C20H17FO3 324.3 CC\\1=C(C2=C(/C1=C\\C3=CC(=CC=C3)OC)C=CC(=C2)F)CC(=O)O IC50 ~ 100000 nM Poor binder T13726 Retinoic acid receptor RXR-alpha BU1Q6D 2-[(3Z)-6-Methoxy-2-methyl-3-[(4-propan-2-ylphenyl)methylidene]inden-1-yl]acetic acid Investigative 54588852 C23H24O3 348.4 CC\\1=C(C2=C(/C1=C\\C3=CC=C(C=C3)C(C)C)C=CC(=C2)OC)CC(=O)O IC50 ~ 100000 nM Poor binder T13726 Retinoic acid receptor RXR-alpha BV85PO 4-[2-(Benzylamino)-5,7,7,10,10-pentamethyl-8,9-dihydronaphtho[2,3-b][1,5]benzodiazepin-12-yl]benzoic acid Investigative 44433355 C36H37N3O2 543.7 CC1(CCC(C2=C1C=C3C(=C2)N(C4=C(C=C(C=C4)NCC5=CC=CC=C5)N=C3C6=CC=C(C=C6)C(=O)O)C)(C)C)C IC50 ~ 100000 nM Poor binder T13726 Retinoic acid receptor RXR-alpha BWN8Z9 1-[(Z)-4-Methoxybenzylidene]-2-methyl-5-fluoro-1H-indene-3-acetic acid Investigative 9858424 C20H17FO3 324.3 CC\\1=C(C2=C(/C1=C\\C3=CC=C(C=C3)OC)C=CC(=C2)F)CC(=O)O IC50 ~ 100000 nM Poor binder T13726 Retinoic acid receptor RXR-alpha BWU5L1 3-[(3Z)-6-Fluoro-2-methyl-3-[(4-propan-2-ylphenyl)methylidene]inden-1-yl]propanenitrile Investigative 54589361 C23H22FN 331.4 CC\\1=C(C2=C(/C1=C\\C3=CC=C(C=C3)C(C)C)C=CC(=C2)F)CCC#N IC50 ~ 100000 nM Poor binder T13726 Retinoic acid receptor RXR-alpha BX3KC2 2-[(3E)-6-Fluoro-2-methyl-3-[(4-propan-2-ylphenyl)methylidene]inden-1-yl]acetamide Investigative 54588811 C22H22FNO 335.4 CC\\1=C(C2=C(/C1=C/C3=CC=C(C=C3)C(C)C)C=CC(=C2)F)CC(=O)N IC50 ~ 100000 nM Poor binder T13726 Retinoic acid receptor RXR-alpha BXK05L 2-[(3Z)-3-[(4-Acetamidophenyl)methylidene]-6-fluoro-2-methylinden-1-yl]acetic acid Investigative 54588890 C21H18FNO3 351.4 CC\\1=C(C2=C(/C1=C\\C3=CC=C(C=C3)NC(=O)C)C=CC(=C2)F)CC(=O)O IC50 ~ 100000 nM Poor binder T13726 Retinoic acid receptor RXR-alpha BYGP36 2-[(3Z)-2-Methyl-6-propan-2-yl-3-[(4-propan-2-ylphenyl)methylidene]inden-1-yl]acetic acid Investigative 54588893 C25H28O2 360.5 CC\\1=C(C2=C(/C1=C\\C3=CC=C(C=C3)C(C)C)C=CC(=C2)C(C)C)CC(=O)O IC50 ~ 100000 nM Poor binder