TTD_Target_ID Target_Name TTD_Drug_ID Drug_Name Drug_Highest_Status Drug_PubchemID Molecular_Formula Molecular_Weight Canonical_SMILES Activity Binder_Type T74238 Leukotriene CysLT2 receptor D05DVP Zafirlukast Approved 5717 C31H33N3O6S 575.7 CC1=CC=CC=C1S(=O)(=O)NC(=O)C2=CC(=C(C=C2)CC3=CN(C4=C3C=C(C=C4)NC(=O)OC5CCCC5)C)OC IC50 = 58000 nM Poor binder T74238 Leukotriene CysLT2 receptor B13MTJ 4,6-Dichloro-3-[(E)-3-[[3-[(E)-2-(7-chloroquinolin-2-yl)ethenyl]phenyl]methoxy]-3-oxoprop-1-enyl]-1H-indole-2-carboxylic acid Investigative 127043252 C30H19Cl3N2O4 577.8 C1=CC(=CC(=C1)/C=C/C2=NC3=C(C=CC(=C3)Cl)C=C2)COC(=O)/C=C/C4=C(NC5=C4C(=CC(=C5)Cl)Cl)C(=O)O IC50 ~ 100000 nM Poor binder T74238 Leukotriene CysLT2 receptor B1KU8T 4,6-Dichloro-3-[(E)-3-(4-cyanobutoxy)-3-oxoprop-1-enyl]-1H-indole-2-carboxylic acid Investigative 127045343 C17H14Cl2N2O4 381.2 C1=C(C=C(C2=C1NC(=C2/C=C/C(=O)OCCCCC#N)C(=O)O)Cl)Cl IC50 ~ 100000 nM Poor binder T74238 Leukotriene CysLT2 receptor B1YJL7 4,6-Dichloro-3-[(E)-3-oxo-3-phenoxyprop-1-enyl]-1H-indole-2-carboxylic acid Investigative 127043253 C18H11Cl2NO4 376.2 C1=CC=C(C=C1)OC(=O)/C=C/C2=C(NC3=C2C(=CC(=C3)Cl)Cl)C(=O)O IC50 ~ 100000 nM Poor binder T74238 Leukotriene CysLT2 receptor B2M4ZE 4,6-Dichloro-3-[(E)-3-cyclohexyloxy-3-oxoprop-1-enyl]-1H-indole-2-carboxylic acid Investigative 127043410 C18H17Cl2NO4 382.2 C1CCC(CC1)OC(=O)/C=C/C2=C(NC3=C2C(=CC(=C3)Cl)Cl)C(=O)O IC50 ~ 100000 nM Poor binder T74238 Leukotriene CysLT2 receptor B4FU5J 5-Chloro-3-[(E)-3-[3-[(E)-2-(7-chloroquinolin-2-yl)ethenyl]anilino]-3-oxoprop-1-enyl]-1H-indole-2-carboxylic acid Investigative 127043241 C29H19Cl2N3O3 528.4 C1=CC(=CC(=C1)NC(=O)/C=C/C2=C(NC3=C2C=C(C=C3)Cl)C(=O)O)/C=C/C4=NC5=C(C=CC(=C5)Cl)C=C4 IC50 ~ 100000 nM Poor binder T74238 Leukotriene CysLT2 receptor B4H3KX 3-[(E)-3-[[3-[(E)-2-(7-Chloroquinolin-2-yl)ethenyl]phenyl]methoxy]-3-oxoprop-1-enyl]-1H-indole-2-carboxylic acid Investigative 127043233 C30H21ClN2O4 508.9 C1=CC=C2C(=C1)C(=C(N2)C(=O)O)/C=C/C(=O)OCC3=CC(=CC=C3)/C=C/C4=NC5=C(C=CC(=C5)Cl)C=C4 IC50 ~ 100000 nM Poor binder T74238 Leukotriene CysLT2 receptor B5QNI1 4,6-Dichloro-3-[(E)-3-(cyclohexylmethoxy)-3-oxoprop-1-enyl]-1H-indole-2-carboxylic acid Investigative 127045334 C19H19Cl2NO4 396.3 C1CCC(CC1)COC(=O)/C=C/C2=C(NC3=C2C(=CC(=C3)Cl)Cl)C(=O)O IC50 ~ 100000 nM Poor binder T74238 Leukotriene CysLT2 receptor B7DN8P 4,6-Dichloro-3-[(E)-3-[3-[(E)-2-(7-chloroquinolin-2-yl)ethenyl]anilino]-3-oxoprop-1-enyl]-1H-indole-2-carboxylic acid Investigative 127043049 C29H18Cl3N3O3 562.8 C1=CC(=CC(=C1)NC(=O)/C=C/C2=C(NC3=C2C(=CC(=C3)Cl)Cl)C(=O)O)/C=C/C4=NC5=C(C=CC(=C5)Cl)C=C4 IC50 ~ 100000 nM Poor binder T74238 Leukotriene CysLT2 receptor B7JU2N 4,6-Dichloro-3-[(E)-3-oxo-3-pentoxyprop-1-enyl]-1H-indole-2-carboxylic acid Investigative 127043411 C17H17Cl2NO4 370.2 CCCCCOC(=O)/C=C/C1=C(NC2=C1C(=CC(=C2)Cl)Cl)C(=O)O IC50 ~ 100000 nM Poor binder T74238 Leukotriene CysLT2 receptor B84FEX 4,6-Dichloro-3-[(E)-3-oxo-3-(3-phenylpropoxy)prop-1-enyl]-1H-indole-2-carboxylic acid Investigative 127043408 C21H17Cl2NO4 418.3 C1=CC=C(C=C1)CCCOC(=O)/C=C/C2=C(NC3=C2C(=CC(=C3)Cl)Cl)C(=O)O IC50 ~ 100000 nM Poor binder T74238 Leukotriene CysLT2 receptor B87FVK 6-Chloro-3-[(E)-3-[3-[(E)-2-(7-chloroquinolin-2-yl)ethenyl]anilino]-3-oxoprop-1-enyl]-1H-indole-2-carboxylic acid Investigative 127043242 C29H19Cl2N3O3 528.4 C1=CC(=CC(=C1)NC(=O)/C=C/C2=C(NC3=C2C=CC(=C3)Cl)C(=O)O)/C=C/C4=NC5=C(C=CC(=C5)Cl)C=C4 IC50 = 87000 nM Poor binder T74238 Leukotriene CysLT2 receptor B8ITB9 [3-[(E)-2-(7-Chloroquinolin-2-yl)ethenyl]phenyl]methyl (E)-3-(4,6-dichloro-1H-indol-3-yl)prop-2-enoate Investigative 127043048 C29H19Cl3N2O2 533.8 C1=CC(=CC(=C1)/C=C/C2=NC3=C(C=CC(=C3)Cl)C=C2)COC(=O)/C=C/C4=CNC5=C4C(=CC(=C5)Cl)Cl IC50 ~ 100000 nM Poor binder T74238 Leukotriene CysLT2 receptor B9OJ8Z 3-[(E)-3-[3-[(E)-2-(7-Chloroquinolin-2-yl)ethenyl]anilino]-3-oxoprop-1-enyl]-6-methoxy-1H-indole-2-carboxylic acid Investigative 127043617 C30H22ClN3O4 524 COC1=CC2=C(C=C1)C(=C(N2)C(=O)O)/C=C/C(=O)NC3=CC=CC(=C3)/C=C/C4=NC5=C(C=CC(=C5)Cl)C=C4 IC50 ~ 100000 nM Poor binder T74238 Leukotriene CysLT2 receptor BC7ZU0 3-[(E)-3-[3-[(E)-2-(7-Chloroquinolin-2-yl)ethenyl]anilino]-3-oxoprop-1-enyl]-4,6-difluoro-1H-indole-2-carboxylic acid Investigative 127043247 C29H18ClF2N3O3 529.9 C1=CC(=CC(=C1)NC(=O)/C=C/C2=C(NC3=C2C(=CC(=C3)F)F)C(=O)O)/C=C/C4=NC5=C(C=CC(=C5)Cl)C=C4 IC50 = 76000 nM Poor binder T74238 Leukotriene CysLT2 receptor BM5Q1T 4,6-Dichloro-3-[(E)-3-(4-methylpentoxy)-3-oxoprop-1-enyl]-1H-indole-2-carboxylic acid Investigative 127044872 C18H19Cl2NO4 384.2 CC(C)CCCOC(=O)/C=C/C1=C(NC2=C1C(=CC(=C2)Cl)Cl)C(=O)O IC50 ~ 100000 nM Poor binder T74238 Leukotriene CysLT2 receptor BMI51N 4,6-Dichloro-3-[(E)-3-oxo-3-phenylmethoxyprop-1-enyl]-1H-indole-2-carboxylic acid Investigative 127043406 C19H13Cl2NO4 390.2 C1=CC=C(C=C1)COC(=O)/C=C/C2=C(NC3=C2C(=CC(=C3)Cl)Cl)C(=O)O IC50 ~ 100000 nM Poor binder T74238 Leukotriene CysLT2 receptor BT4A6B 3-[3-[3-[(E)-2-(7-Chloroquinolin-2-yl)ethenyl]anilino]-3-oxopropyl]-1H-indole-2-carboxylic acid Investigative 127043237 C29H22ClN3O3 496 C1=CC=C2C(=C1)C(=C(N2)C(=O)O)CCC(=O)NC3=CC=CC(=C3)/C=C/C4=NC5=C(C=CC(=C5)Cl)C=C4 IC50 = 50000 nM Poor binder T74238 Leukotriene CysLT2 receptor BTWJ54 3-[(E)-3-[3-[(E)-2-(7-Chloroquinolin-2-yl)ethenyl]anilino]-3-oxoprop-1-enyl]-1H-indole-2-carboxylic acid Investigative 127043050 C29H20ClN3O3 493.9 C1=CC=C2C(=C1)C(=C(N2)C(=O)O)/C=C/C(=O)NC3=CC=CC(=C3)/C=C/C4=NC5=C(C=CC(=C5)Cl)C=C4 IC50 = 58000 nM Poor binder T74238 Leukotriene CysLT2 receptor BW4CJ9 4,6-Dichloro-3-[(E)-3-oxo-3-(4-phenylbutoxy)prop-1-enyl]-1H-indole-2-carboxylic acid Investigative 127043409 C22H19Cl2NO4 432.3 C1=CC=C(C=C1)CCCCOC(=O)/C=C/C2=C(NC3=C2C(=CC(=C3)Cl)Cl)C(=O)O IC50 ~ 100000 nM Poor binder T74238 Leukotriene CysLT2 receptor BWJO05 7-Chloro-3-[(E)-3-[3-[(E)-2-(7-chloroquinolin-2-yl)ethenyl]anilino]-3-oxoprop-1-enyl]-1H-indole-2-carboxylic acid Investigative 127043243 C29H19Cl2N3O3 528.4 C1=CC(=CC(=C1)NC(=O)/C=C/C2=C(NC3=C2C=CC=C3Cl)C(=O)O)/C=C/C4=NC5=C(C=CC(=C5)Cl)C=C4 IC50 ~ 100000 nM Poor binder T74238 Leukotriene CysLT2 receptor BYJC43 4,6-Dichloro-3-[(E)-3-oxo-3-(2-phenylethoxy)prop-1-enyl]-1H-indole-2-carboxylic acid Investigative 127043407 C20H15Cl2NO4 404.2 C1=CC=C(C=C1)CCOC(=O)/C=C/C2=C(NC3=C2C(=CC(=C3)Cl)Cl)C(=O)O IC50 ~ 100000 nM Poor binder