Index SMILES AR AR-LBD AhR Aromatase ER ER-LBD PPAR-gamma ARE ATAD5 HSE p53 Compound_1 Nc1ccc(cc1)C(=C1C=CC(=N)C(=C1)C)c1ccc(cc1)N 0.87 0.73 0.928 0.675 0.823 0.977 0.998 0.992 0.969 0.98 0.959 Compound_2 COC(=O)C1=C(C)NC(=C(C1c1cccc(c1)N(=O)=O)C(=O)OCCCN1CCC(CC1)(c1ccccc1)c1ccccc1)C 0.936 0.727 0.334 0.508 0.947 0.918 0.998 0.738 0.95 0.955 0.803 Compound_3 COC(=O)C1=C(C)NC(=C([C@H]1c1cccc(c1)N(=O)=O)C(=O)O[C@H]1CCN(C1)Cc1ccccc1)C 0.413 0.891 0.333 0.448 0.905 0.661 0.778 0.916 0.333 0.645 0.67 Compound_4 CN(CCC=C1c2ccccc2C(c2c1cccc2)(C)C)C 0.17 0.474 0.001 0.599 0.317 0.736 0.152 0.061 0.45 0.007 0.11 Compound_5 CC[C@H]1CN2CCc3c([C@@H]2C[C@@H]1C[C@H]1NCCc2c1cc(OC)c(c2)OC)cc(c(c3)OC)OC 0.298 0.644 0.056 0.713 0.053 0.898 0.255 0.848 0.914 0.054 0.641