Index SMILES AR AR-LBD AhR Aromatase ER ER-LBD PPAR-gamma ARE ATAD5 HSE p53 Compound_1 OCC(N)(C)C 0.072 0.057 0.049 0.397 0.004 0.011 0.341 0.021 0.283 0.0 0.101 Compound_2 OCC(N)(C)C 0.072 0.057 0.049 0.397 0.004 0.011 0.341 0.021 0.283 0.0 0.101 Compound_3 OCC(CO)(C)C 0.725 0.05 0.113 0.48 0.035 0.034 0.534 0.582 0.367 0.221 0.365 Compound_4 OCC(C(C(=O)NCCCC(=O)O)O)(C)C 0.008 0.033 0.003 0.109 0.021 0.015 0.001 0.06 0.34 0.002 0.014 Compound_5 OCC([C@H](C(=O)NCCC(=O)[O-])O)(C)C 0.02 0.039 0.002 0.156 0.018 0.016 0.001 0.119 0.058 0.002 0.056 Compound_6 OCC([C@H](C(=O)NCCC(=O)O)O)(C)C 0.01 0.043 0.002 0.092 0.018 0.016 0.001 0.044 0.088 0.002 0.019 Compound_7 Fc1ccc(c(c1)F)Oc1cc(=O)n(c2c1cnc(n2)NCC(O)(C)C)C 0.952 0.538 0.972 0.503 0.563 0.296 0.416 0.349 0.612 0.663 0.381 Compound_8 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_9 CC(Cc1ccccc1)(O)C 0.116 0.101 0.294 0.512 0.05 0.052 0.876 0.41 0.529 0.167 0.122 Compound_10 CC(c1ccccc1)(c1ccc(cc1)Nc1ccc(cc1)C(c1ccccc1)(C)C)C 0.957 0.563 0.912 0.565 0.986 0.978 0.987 0.937 0.837 0.911 0.908 Compound_11 CC(c1ccc(cc1)O)(c1ccc(cc1)O)C 0.976 0.629 0.722 0.637 0.948 0.983 0.981 0.957 0.711 0.747 0.875 Compound_12 O=C(c1cccnc1Oc1ccc2c(c1)non2)NCc1ccc(cc1)C(O)(C)C 0.494 0.588 0.641 0.536 0.722 0.646 0.994 0.099 0.443 0.007 0.494 Compound_13 CC(c1cc(Cl)c(c(c1)Cl)O)(c1cc(Cl)c(c(c1)Cl)O)C 0.945 0.517 0.722 0.686 0.961 0.862 0.992 0.984 0.719 0.99 0.99 Compound_14 CC(c1cc(Br)c(c(c1)Br)O)(c1cc(Br)c(c(c1)Br)O)C 0.961 0.512 0.722 0.686 0.682 0.707 0.993 0.984 0.476 0.996 0.989 Compound_15 C=CC(O)(C)C 0.77 0.051 0.253 0.574 0.238 0.02 0.659 0.967 0.647 0.863 0.836 Compound_16 CC(OOC(C)(C)C)(C)C 0.856 0.064 0.174 0.506 0.096 0.047 0.926 0.658 0.819 0.98 0.869 Compound_17 OOC(C)(C)C 0.774 0.048 0.082 0.489 0.058 0.041 0.859 0.459 0.739 0.809 0.858 Compound_18 NC(=O)NC(C)(C)C 0.111 0.071 0.034 0.214 0.006 0.01 0.079 0.019 0.217 0.027 0.142 Compound_19 O[C@H](CN1CCN(C[C@H]1C(=O)NC(C)(C)C)Cc1cccnc1)C[C@H](C(=O)N[C@@H]1[C@H](O)Cc2c1cccc2)Cc1ccccc1 0.599 0.711 0.061 0.198 0.366 0.543 0.114 0.023 0.257 0.98 0.607 Compound_20 Clc1ccc(cc1)C(=O)NN(C(C)(C)C)C(=O)c1ccccc1 0.379 0.676 0.294 0.288 0.187 0.886 0.947 0.448 0.433 0.88 0.641