Index SMILES AR AR-LBD AhR Aromatase ER ER-LBD PPAR-gamma ARE ATAD5 HSE p53 Compound_1 O=C1C(=C(Cl)C(=O)c2c1cccc2)Cl 0.77 0.491 0.845 0.702 0.506 0.898 0.825 0.982 0.899 0.994 0.996 Compound_2 O=S(=O)(c1ccccc1)c1ccccc1 0.767 0.61 0.533 0.588 0.358 0.577 0.983 0.187 0.763 0.991 0.259 Compound_3 Sc1ccccc1 0.931 0.298 0.863 0.611 0.117 0.231 0.998 0.173 0.972 0.999 0.44 Compound_4 c1ccc(cc1)Oc1ccccc1 0.946 0.752 0.922 0.59 0.5 0.511 0.996 0.771 0.969 0.993 0.921 Compound_5 Brc1ccc(cc1)Oc1ccccc1 0.981 0.765 0.861 0.69 0.624 0.639 0.997 0.873 0.687 0.997 0.981 Compound_6 Oc1ccccc1 0.919 0.132 0.863 0.611 0.18 0.041 0.963 0.173 0.915 0.632 0.276 Compound_7 NNc1ccccc1 0.779 0.404 0.926 0.66 0.168 0.685 0.984 0.845 0.829 0.834 0.313 Compound_8 NC(=S)Nc1ccccc1 0.809 0.27 0.662 0.433 0.079 0.683 0.934 0.681 0.965 0.958 0.442 Compound_9 c1ccc(cc1)N=Nc1ccccc1 0.995 0.825 0.984 0.687 0.598 0.904 0.999 0.936 0.973 0.994 0.906 Compound_10 OCc1ccccc1 0.526 0.094 0.656 0.525 0.022 0.06 0.963 0.569 0.581 0.221 0.46 Compound_11 NCc1ccccc1 0.487 0.124 0.493 0.491 0.004 0.122 0.016 0.051 0.706 0.342 0.075 Compound_12 c1ccc(cc1)CCc1ccccc1 0.645 0.595 0.677 0.546 0.23 0.41 0.996 0.846 0.558 0.996 0.756 Compound_13 O=CCCc1ccccc1 0.684 0.115 0.401 0.521 0.038 0.266 1.0 0.672 0.767 0.906 0.6 Compound_14 c1ccc(cc1)Cc1ccccc1 0.877 0.58 0.763 0.532 0.23 0.41 0.996 0.938 0.904 0.998 0.824 Compound_15 OC(=O)Cc1ccccc1 0.029 0.067 0.135 0.229 0.059 0.031 0.995 0.017 0.26 0.006 0.031 Compound_16 c1ccc(cc1)c1n[nH]nn1 0.788 0.509 0.989 0.756 0.125 0.678 0.432 0.45 0.979 0.093 0.537 Compound_17 Oc1ccc(cc1)c1ccccc1 0.952 0.777 0.933 0.853 0.822 0.926 0.998 0.944 0.927 0.81 0.755 Compound_18 Oc1ccc(cc1Cl)c1ccccc1 0.951 0.715 0.789 0.769 0.933 0.733 0.985 0.979 0.895 0.991 0.987 Compound_19 O=N(=O)C=Cc1ccccc1 0.889 0.261 0.642 0.516 0.041 0.645 0.892 0.955 0.95 0.991 0.918 Compound_20 ClC(c1ccccc1)(Cl)Cl 0.942 0.166 0.81 0.702 0.093 0.466 0.995 0.963 0.166 0.998 0.446 Compound_21 N#Cc1ccccc1 0.979 0.231 0.661 0.601 0.278 0.04 0.995 0.564 0.923 0.991 0.834 Compound_22 OC/C=C/c1ccccc1 0.801 0.134 0.355 0.646 0.073 0.302 0.975 0.739 0.683 0.242 0.577 Compound_23 OC(=O)/C=C/c1ccccc1 0.849 0.172 0.327 0.354 0.299 0.313 0.992 0.219 0.778 0.295 0.239 Compound_24 Oc1ccccc1Br 0.97 0.134 0.526 0.57 0.556 0.559 0.991 0.875 0.718 0.996 0.929 Compound_25 Clc1nc(nc(n1)Cl)Nc1ccccc1Cl 0.904 0.708 0.986 0.561 0.436 0.696 0.274 0.906 0.8 0.9 0.264 Compound_26 O=Cc1ccccc1O 0.797 0.217 0.474 0.666 0.116 0.251 0.836 0.52 0.784 0.633 0.468 Compound_27 O=C1C=CC(=O)O1 0.927 0.187 0.574 0.64 0.397 0.211 0.995 1.0 0.991 0.886 0.703 Compound_28 O=C1C=CC(=O)C=C1 0.912 0.223 0.637 0.661 0.216 0.144 0.927 0.963 0.953 0.991 0.811