Index SMILES AR AR-LBD AhR Aromatase ER ER-LBD PPAR-gamma ARE ATAD5 HSE p53 Compound_1 COP(=O)(SC)N 0.691 0.099 0.051 0.274 0.407 0.189 0.484 0.012 0.697 0.211 0.582 Compound_2 COP(=O)(OC)C 0.864 0.082 0.294 0.536 0.401 0.083 0.959 0.722 0.753 0.965 0.708 Compound_3 COC(=O)Nc1ccc(c(c1)Cl)Cl 0.953 0.456 0.995 0.812 0.345 0.098 0.992 0.958 0.568 0.889 0.278 Compound_4 CCNc1nc(N)nc(n1)Cl 0.239 0.161 0.657 0.447 0.02 0.022 0.0 0.132 0.775 0.092 0.081 Compound_5 CCNc1ccccc1 0.631 0.206 0.912 0.469 0.08 0.064 0.023 0.15 0.659 0.944 0.415 Compound_6 CCCc1ccccc1 0.704 0.131 0.443 0.566 0.055 0.06 0.997 0.487 0.825 0.996 0.261 Compound_7 CC1=CC2C(C1C)C1CC2C=C1 0.987 0.43 0.4 0.508 0.717 0.101 0.537 0.925 0.419 0.994 0.805 Compound_8 Cc1ccccc1S 0.819 0.286 0.828 0.657 0.159 0.254 0.991 0.965 0.822 0.999 0.479 Compound_9 Cc1ccc(cc1)S 0.796 0.293 0.81 0.654 0.297 0.165 0.991 0.456 0.844 0.999 0.312 Compound_10 Cc1cc(=O)[nH]o1 0.589 0.45 0.314 0.391 0.084 0.038 0.078 0.005 0.68 0.902 0.649 Compound_11 C=Cc1cccc(c1)C 0.944 0.271 0.818 0.593 0.031 0.047 0.979 0.973 0.847 0.998 0.294 Compound_12 Cc1ccc(c(c1)N(=O)=O)N(=O)=O 0.964 0.235 0.843 0.643 0.494 0.021 0.997 0.982 0.844 0.999 0.917 Compound_13 Clc1c(C)cc(c(c1C)Cl)O 0.873 0.133 0.353 0.627 0.607 0.263 0.667 0.357 0.675 0.958 0.675 Compound_14 CC=C1CC2CC1C=C2 0.864 0.455 0.276 0.562 0.413 0.029 0.979 0.956 0.461 0.996 0.806 Compound_15 CC(Cl)(Cl)C 0.928 0.117 0.721 0.63 0.127 0.281 0.996 0.905 0.621 0.991 0.842 Compound_16 CC(=O)Nc1ccc(cc1)O 0.445 0.337 0.705 0.431 0.512 0.124 0.084 0.128 0.956 0.044 0.177 Compound_17 C1N2CN3CN1CN(C2)C3 0.471 0.357 0.117 0.262 0.249 0.098 0.002 0.958 0.831 0.991 0.188 Compound_18 OCCN1CCNCC1 0.008 0.087 0.012 0.133 0.004 0.001 -0.0 0.542 0.057 0.056 0.065 Compound_19 O=C(N1CCOC21CCCCC2)C(Cl)Cl 0.238 0.445 0.039 0.607 0.694 0.703 0.896 0.994 0.349 0.941 0.872 Compound_20 OS(=O)(=O)NC1CCCCC1 0.141 0.176 0.105 0.241 0.087 0.34 0.002 0.481 0.241 0.047 0.402 Compound_21 Oc1ccc(cc1C1CCCC1)Cl 0.555 0.268 0.625 0.77 0.524 0.43 0.62 0.969 0.793 0.947 0.815 Compound_22 ON=C1CCCCC1 0.831 0.402 0.72 0.484 0.102 0.336 0.851 0.668 0.483 0.871 0.798 Compound_23 ClC1=C(Cl)C2(C(C1(Cl)C1C2COS(=O)(=O)OC1)(Cl)Cl)Cl 0.924 0.831 0.521 0.643 0.827 0.432 0.978 0.984 0.145 0.999 0.421 Compound_24 SCc1ccco1 0.522 0.209 0.098 0.452 0.076 0.517 0.958 0.854 0.498 0.948 0.939 Compound_25 N#Cc1ccncc1 0.693 0.255 0.474 0.591 0.082 0.083 0.013 0.032 0.924 0.924 0.795 Compound_26 OCCc1ccccn1 0.035 0.183 0.737 0.406 0.021 0.157 0.024 0.777 0.36 0.006 0.372 Compound_27 N#Cc1ccccn1 0.604 0.295 0.544 0.561 0.181 0.152 0.067 0.93 0.942 0.849 0.885 Compound_28 OS(=O)(=O)c1ccc2c(c1)cccc2 0.909 0.481 0.98 0.484 0.854 0.494 0.977 0.906 0.494 0.915 0.129 Compound_29 O=C1C=CC(=O)c2c1cccc2 0.726 0.523 0.947 0.615 0.058 0.534 0.33 0.893 0.909 0.981 0.991 Compound_30 c1ccc2c(c1)Sc1c(O2)cccc1 0.473 0.672 0.908 0.57 0.648 0.45 0.891 0.526 0.834 0.998 0.781