TTD_Target_ID Target_Name TTD_Drug_ID Drug_Name Drug_Highest_Status Drug_PubchemID Molecular_Formula Molecular_Weight Canonical_SMILES Activity Binder_Type T23666 Aryl hydrocarbon receptor B06QSF 1,3-Difluoro-5-[(Z)-2-(4-fluorophenyl)ethenyl]benzene Investigative 11310856 C14H9F3 234.22 C1=CC(=CC=C1/C=C\\C2=CC(=CC(=C2)F)F)F Ki = 15885467.49 nM Non binder T23666 Aryl hydrocarbon receptor B1P9WZ 2,8-Dichlorodibenzofuran Investigative 21510 C12H6Cl2O 237.08 C1=CC2=C(C=C1Cl)C3=C(O2)C=CC(=C3)Cl EC50 = 257039.58 nM Non binder T23666 Aryl hydrocarbon receptor B31VIY 1-[(E)-2-(4-Butoxyphenyl)ethenyl]-3,5-dimethoxybenzene Investigative 11358876 C20H24O3 312.4 CCCCOC1=CC=C(C=C1)/C=C/C2=CC(=CC(=C2)OC)OC Ki = 50118723.36 nM Non binder T23666 Aryl hydrocarbon receptor B37YHF 1,3-Dichloro-5-[(Z)-2-(4-chlorophenyl)ethenyl]benzene Investigative 11266077 C14H9Cl3 283.6 C1=CC(=CC=C1/C=C\\C2=CC(=CC(=C2)Cl)Cl)Cl Ki = 76913044.03 nM Non binder T23666 Aryl hydrocarbon receptor B4VJ3A 1,3-Dichloro-5-[(E)-2-(3-methoxyphenyl)ethenyl]benzene Investigative 11208222 C15H12Cl2O 279.2 COC1=CC=CC(=C1)/C=C/C2=CC(=CC(=C2)Cl)Cl Ki = 175388050.2 nM Non binder T23666 Aryl hydrocarbon receptor B53RBO 1-[(E)-2-(4-Ethoxyphenyl)ethenyl]-3,5-dimethoxybenzene Investigative 11300595 C18H20O3 284.3 CCOC1=CC=C(C=C1)/C=C/C2=CC(=CC(=C2)OC)OC Ki = 199986187 nM Non binder T23666 Aryl hydrocarbon receptor B5SY9T 1,3-Dichloro-5-[(E)-2-[4-(trifluoromethyl)phenyl]ethenyl]benzene Investigative 11438491 C15H9Cl2F3 317.1 C1=CC(=CC=C1/C=C/C2=CC(=CC(=C2)Cl)Cl)C(F)(F)F Ki = 200447202.7 nM Non binder T23666 Aryl hydrocarbon receptor B6K9MY 1-[(Z)-2-(4-Butoxyphenyl)ethenyl]-3,5-dimethoxybenzene Investigative 11243890 C20H24O3 312.4 CCCCOC1=CC=C(C=C1)/C=C\\C2=CC(=CC(=C2)OC)OC Ki = 23280912.58 nM Non binder T23666 Aryl hydrocarbon receptor B7LWR4 1,3-Dichloro-5-[(1E)-2-(4-chlorophenyl)ethenyl]-benzene Investigative 9838722 C14H9Cl3 283.6 C1=CC(=CC=C1/C=C/C2=CC(=CC(=C2)Cl)Cl)Cl Ki = 831763771.1 nM Non binder T23666 Aryl hydrocarbon receptor B7X3MA 1,3-Dichloro-5-[(Z)-2-[3-(trifluoromethyl)phenyl]ethenyl]benzene Investigative 11197891 C15H9Cl2F3 317.1 C1=CC(=CC(=C1)C(F)(F)F)/C=C\\C2=CC(=CC(=C2)Cl)Cl Ki = 52722986.14 nM Non binder T23666 Aryl hydrocarbon receptor B8PJ3A 2,6-Dichlorodibenzofuran Investigative 43255 C12H6Cl2O 237.08 C1=CC2=C(C(=C1)Cl)OC3=C2C=C(C=C3)Cl EC50 = 246036.76 nM Non binder T23666 Aryl hydrocarbon receptor B8WKC0 1,3-Bis(trifluoromethyl)-5-[(Z)-2-[4-(trifluoromethyl)phenyl]ethenyl]benzene Investigative 11153316 C17H9F9 384.24 C1=CC(=CC=C1/C=C\\C2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F)C(F)(F)F Ki = 16672472.13 nM Non binder T23666 Aryl hydrocarbon receptor B9D8XI 1,3-Difluoro-5-[(E)-2-(4-methoxyphenyl)ethenyl]benzene Investigative 11425113 C15H12F2O 246.25 COC1=CC=C(C=C1)/C=C/C2=CC(=CC(=C2)F)F Ki = 108893009.3 nM Non binder T23666 Aryl hydrocarbon receptor BA0VP9 1-[(Z)-2-(4-Ethoxyphenyl)ethenyl]-3,5-dimethoxybenzene Investigative 11482995 C18H20O3 284.3 CCOC1=CC=C(C=C1)/C=C\\C2=CC(=CC(=C2)OC)OC Ki = 15417004.53 nM Non binder T23666 Aryl hydrocarbon receptor BG8JH2 1,3-Bis(trifluoromethyl)-5-[(E)-2-[4-(trifluoromethyl)phenyl]ethenyl]benzene Investigative 10407651 C17H9F9 384.24 C1=CC(=CC=C1/C=C/C2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F)C(F)(F)F Ki = 476430986.8 nM Non binder T23666 Aryl hydrocarbon receptor BI7PO1 1,3-Dichloro-5-[(Z)-2-[4-(trifluoromethyl)phenyl]ethenyl]benzene Investigative 11244016 C15H9Cl2F3 317.1 C1=CC(=CC=C1/C=C\\C2=CC(=CC(=C2)Cl)Cl)C(F)(F)F Ki = 71449632.61 nM Non binder T23666 Aryl hydrocarbon receptor BIZ79Y Dibenzofuran Investigative 568 C12H8O 168.19 C1=CC=C2C(=C1)C3=CC=CC=C3O2 EC50 = 1000000 nM Non binder T23666 Aryl hydrocarbon receptor BJR03D 1,3-Dichloro-5-[(E)-2-[3-(trifluoromethyl)phenyl]ethenyl]benzene Investigative 11209303 C15H9Cl2F3 317.1 C1=CC(=CC(=C1)C(F)(F)F)/C=C/C2=CC(=CC(=C2)Cl)Cl Ki = 147231250.2 nM Non binder T23666 Aryl hydrocarbon receptor BKD2B8 4-Chlorodibenzofuran Investigative 53154 C12H7ClO 202.63 C1=CC=C2C(=C1)C3=C(O2)C(=CC=C3)Cl EC50 = 1000000 nM Non binder T23666 Aryl hydrocarbon receptor BL6V8H 1,3-Difluoro-5-[(E)-2-(4-fluorophenyl)ethenyl]benzene Investigative 11287739 C14H9F3 234.22 C1=CC(=CC=C1/C=C/C2=CC(=CC(=C2)F)F)F Ki = 263633138.6 nM Non binder T23666 Aryl hydrocarbon receptor BN1BZ5 1-[(E)-2-(4-Fluorophenyl)ethenyl]-3,5-dimethoxybenzene Investigative 11414230 C16H15FO2 258.29 COC1=CC(=CC(=C1)/C=C/C2=CC=C(C=C2)F)OC Ki = 322849412.2 nM Non binder T23666 Aryl hydrocarbon receptor BQ5LC3 2-Chlorodibenzofuran Investigative 32781 C12H7ClO 202.63 C1=CC=C2C(=C1)C3=C(O2)C=CC(=C3)Cl EC50 = 279898.13 nM Non binder T23666 Aryl hydrocarbon receptor BST7Z2 1,3-Dichloro-5-[(Z)-2-(4-methoxyphenyl)ethenyl]benzene Investigative 11414783 C15H12Cl2O 279.2 COC1=CC=C(C=C1)/C=C\\C2=CC(=CC(=C2)Cl)Cl Ki = 79432823.47 nM Non binder T23666 Aryl hydrocarbon receptor BT2E8R 1-[(Z)-2-(4-Fluorophenyl)ethenyl]-3,5-dimethoxybenzene Investigative 11230651 C16H15FO2 258.29 COC1=CC(=CC(=C1)/C=C\\C2=CC=C(C=C2)F)OC Ki = 10423174.29 nM Non binder T23666 Aryl hydrocarbon receptor BT4G0S 1,3-Dichloro-5-[(1E)-2-(4-methoxyphenyl)ethenyl]-benzene Investigative 10062125 C15H12Cl2O 279.2 COC1=CC=C(C=C1)/C=C/C2=CC(=CC(=C2)Cl)Cl Ki = 714496326.1 nM Non binder T23666 Aryl hydrocarbon receptor BTJB95 1,3-Dichloro-5-[(Z)-2-(3-methoxyphenyl)ethenyl]benzene Investigative 11391816 C15H12Cl2O 279.2 COC1=CC=CC(=C1)/C=C\\C2=CC(=CC(=C2)Cl)Cl Ki = 41686938.35 nM Non binder T23666 Aryl hydrocarbon receptor BVEZ46 1,3-Difluoro-5-[(Z)-2-(4-methoxyphenyl)ethenyl]benzene Investigative 11817441 C15H12F2O 246.25 COC1=CC=C(C=C1)/C=C\\C2=CC(=CC(=C2)F)F Ki = 45498806.02 nM Non binder T23666 Aryl hydrocarbon receptor D03NTD 3,4',5-trimethoxy-(Z)-stilbene Investigative 9878556 C17H18O3 270.32 COC1=CC=C(C=C1)/C=C\\C2=CC(=CC(=C2)OC)OC Ki = 13335214.32 nM Non binder T23666 Aryl hydrocarbon receptor D0O9NE TRISMETHOXYRESVERATROL Investigative 5388063 C17H18O3 270.32 COC1=CC=C(C=C1)/C=C/C2=CC(=CC(=C2)OC)OC Ki = 130016957.8 nM Non binder