TTD_Target_ID Target_Name TTD_Drug_ID Drug_Name Drug_Highest_Status Drug_PubchemID Molecular_Formula Molecular_Weight Canonical_SMILES Activity Binder_Type T69085 Transcription factor AP-1 B6I4XF (Z)-3-[(1S,4As,7S,7aS)-7-hydroxy-4-methoxycarbonyl-5-methyl-1-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4a,7a-dihydro-1H-cyclopenta[c]pyran-7-carbonyl]oxy-2-(4-hydroxy-3-methoxyphenyl)prop-2-enoic acid Investigative 118716171 C28H32O16 624.5 CC1=C[C@]([C@@H]2[C@@H]1C(=CO[C@H]2O[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CO)O)O)O)C(=O)OC)(C(=O)O/C=C(/C4=CC(=C(C=C4)O)OC)\\C(=O)O)O IC50 = 69600 nM Poor binder T69085 Transcription factor AP-1 B6S8QZ 2-Anthracenecarboxylic acid, 9,10-dihydro-3,8-dihydroxy-9,10-dioxo-1-propyl- Investigative 10336479 C18H14O6 326.3 CCCC1=C2C(=CC(=C1C(=O)O)O)C(=O)C3=C(C2=O)C(=CC=C3)O IC50 = 100000 nM Poor binder T69085 Transcription factor AP-1 BS4FB2 2-[(4R,10S,13S,16S,19S,22S,25S,31R)-31-Acetamido-25-(3-amino-3-oxopropyl)-4-carbamoyl-19-(carboxymethyl)-13-methyl-16,22-bis(2-methylpropyl)-6,9,12,15,18,21,24,27,30-nonaoxo-1,2-dithia-5,8,11,14,17,20,23,26,29-nonazacyclodotriacont-10-yl]acetic acid Investigative 90668287 C40H64N12O16S2 1033.099 C[C@H]1C(=O)N[C@H](C(=O)NCC(=O)N[C@@H](CSSC[C@@H](C(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1)CC(C)C)CC(=O)O)CC(C)C)CCC(=O)N)NC(=O)C)C(=O)N)CC(=O)O IC50 = 64000 nM Poor binder