Index SMILES AR AR-LBD AhR Aromatase ER ER-LBD PPAR-gamma ARE ATAD5 HSE p53 Compound_1 Brc1cc(Br)c(c(c1)Br)O 0.948 0.134 0.452 0.507 0.668 0.72 0.994 0.969 0.389 0.996 0.929 Compound_2 COC(=O)c1ccccc1O 0.682 0.183 0.232 0.567 0.228 0.066 0.043 0.032 0.169 0.125 0.089 Compound_3 O=C(c1ccccc1)CC(=O)c1ccccc1 0.908 0.622 0.592 0.55 0.248 0.951 0.95 0.761 0.95 0.216 0.96 Compound_4 N#CC(c1cc(cc(c1)C(C#N)(C)C)Cn1ncnc1)(C)C 0.355 0.514 0.393 0.827 0.088 0.396 0.437 0.036 0.555 0.06 0.533 Compound_5 CCOc1cc(C=O)ccc1O 0.411 0.156 0.37 0.671 0.526 0.171 0.384 0.727 0.224 0.646 0.423 Compound_6 COc1cc(C=O)ccc1O 0.681 0.134 0.291 0.674 0.472 0.221 0.506 0.022 0.543 0.54 0.341 Compound_7 OCCOc1ccccc1 0.375 0.097 0.476 0.566 0.329 0.098 0.894 0.37 0.261 0.205 0.189 Compound_8 CC(CC(CC(CC(C)C)O)C)C 0.924 0.065 0.403 0.435 0.079 0.037 0.89 0.193 0.227 0.65 0.425 Compound_9 Oc1ccc(cc1)O 0.926 0.165 0.846 0.588 0.393 0.113 0.958 0.283 0.91 0.142 0.466 Compound_10 CCCCCC(=O)OCC 0.746 0.003 0.551 0.723 0.06 0.028 0.987 0.592 0.059 0.998 0.912 Compound_11 [S-]C(=S)NCCNC(=S)[S-] 0.056 0.044 0.548 0.403 0.16 0.098 0.001 0.935 0.551 0.908 0.89 Compound_12 Fc1ccc(cc1)Oc1ccnc2c1c(Cl)cc(c2)Cl 0.952 0.786 0.983 0.601 0.942 0.683 0.581 0.921 0.956 0.996 0.994 Compound_13 CC(=O)O[C@@H]1C[C@@H]2C([C@@]1(C)CC2)(C)C 0.937 0.616 0.032 0.426 0.603 0.102 0.061 0.574 0.705 0.998 0.341 Compound_14 OC(=O)CCC(c1ccc(cc1)O)(c1ccc(cc1)O)C 0.87 0.694 0.346 0.268 0.961 0.958 0.971 0.067 0.194 0.192 0.035 Compound_15 CC(=O)OC/C=C(/C=C/C=C(/C=C/C1=C(C)CCCC1(C)C)\C)\C 0.984 0.325 0.95 0.48 0.857 0.941 0.994 0.997 0.973 0.995 0.595 Compound_16 Oc1ccc(c(c1)O)C(=O)c1ccc(cc1O)O 0.965 0.776 0.952 0.816 0.92 0.982 0.99 0.975 0.718 0.832 0.703 Compound_17 c1ccc2c(c1)sc1c2cccc1 0.951 0.745 0.976 0.623 0.509 0.381 0.996 0.33 0.981 0.999 0.087 Compound_18 CCCCCCCC/C=C\CCCCCCCC(=O)OC[C@H]([C@H]1OC[C@@H]([C@H]1O)O)O 0.944 0.5 0.095 0.726 0.568 0.157 0.948 0.962 0.272 0.988 0.117 Compound_19 [S-]c1ccccn1=O 0.623 0.253 0.913 0.557 0.091 0.209 0.823 0.785 0.955 0.991 0.918 Compound_20 CCc1cc(Cc2cc(CC)c(c(c2)CC)N)cc(c1N)CC 0.638 0.516 0.857 0.404 0.396 0.837 0.992 0.401 0.953 0.981 0.852