Index SMILES AR AR-LBD AhR Aromatase ER ER-LBD PPAR-gamma ARE ATAD5 HSE p53 Compound_1 O=C1C(=Cc2ccc(cc2)S(=O)(=O)O)C2C(C1(C)CC2)(C)C 0.868 0.774 0.478 0.383 0.914 0.532 0.033 0.76 0.243 0.99 0.223 Compound_2 CCOc1ncc(c(=O)[nH]1)F 0.251 0.385 0.009 0.469 0.075 0.024 0.247 0.018 0.315 0.027 0.817 Compound_3 CC(NC(=O)NS(=O)(=O)c1cnccc1Nc1cccc(c1)C)C 0.053 0.383 0.063 0.143 0.133 0.499 0.029 0.009 0.292 0.028 0.258 Compound_4 CNCCC(c1ccccc1)Oc1ccc(cc1)C(F)(F)F 0.053 0.439 0.052 0.358 0.561 0.774 0.538 0.028 0.058 0.001 0.174 Compound_5 CN(CC=C(c1cccnc1)c1ccc(cc1)Br)C 0.24 0.558 0.022 0.302 0.196 0.643 0.004 0.021 0.44 0.041 0.087 Compound_6 CCOC(=O)Nc1ccc(nc1N)NCc1ccc(cc1)F 0.053 0.606 0.983 0.36 0.329 0.821 0.001 0.045 0.058 0.041 0.315 Compound_7 CC12CCC3C(O2)(CO1)CCC1C3(C)CCCC1(C)C 0.947 0.589 0.046 0.481 0.81 0.589 0.88 0.548 0.456 0.948 0.448 Compound_8 OC(=O)CCCCCCNC1c2ccccc2CCc2c1cccc2 0.1 0.417 0.651 0.126 0.157 0.213 0.4 0.002 0.057 0.018 0.169 Compound_9 OC(COc1cccc2c1c1ccccc1[nH]2)CNC(C)C 0.052 0.638 0.45 0.121 0.853 0.662 0.1 0.001 0.129 0.101 0.25 Compound_10 Clc1ccc2c(c1)[nH]c(=O)n2C1CCN(CC1)CCCn1c(=O)[nH]c2c1cccc2 0.175 0.348 0.169 0.331 0.353 0.898 0.053 0.057 0.95 0.063 0.087 Compound_11 COc1ccc(cc1)CC1NCCC2=C1CCCC2 0.276 0.52 0.222 0.369 0.109 0.898 0.012 0.04 0.596 0.084 0.083 Compound_12 OC(=O)C1N2C(OC1=CCO)CC2=O 0.251 0.35 0.013 0.197 0.407 0.194 0.115 0.298 0.099 0.307 0.824 Compound_13 CCCCCCCCOC(=O)c1ccc(cc1)N(C)C 0.766 0.714 0.967 0.591 0.157 0.918 0.862 0.62 0.864 0.357 0.646 Compound_14 CCCCC(CC=CC1C(O)CC(=O)C1CCCCCCC(=O)OC)(O)C 0.915 0.745 0.041 0.537 0.847 0.446 0.517 0.852 0.245 0.959 0.851 Compound_15 COc1cc(CCNCC(COc2cccc(c2)C)O)ccc1OC 0.011 0.433 0.018 0.284 0.064 0.098 0.036 0.027 0.354 0.051 0.155 Compound_16 CC1CCC(C(C1)OC(=O)C(O)C)C(C)C 0.844 0.275 0.011 0.492 0.105 0.059 0.827 0.453 0.35 0.86 0.092 Compound_17 C=CCN1CCCC1CNC(=O)c1cc2[nH]nnc2cc1OC 0.209 0.572 0.038 0.239 0.581 0.65 0.076 0.157 0.166 0.04 0.237 Compound_18 Clc1ccc2c(c1)C(=NCc1n2c(C)nc1)c1ccccc1F 0.505 0.702 0.654 0.77 0.715 0.898 0.913 0.277 0.777 0.077 0.5 Compound_19 CCC(=O)N(C1(CCN(CC1)CCc1ccccc1)C(=O)OC)c1ccccc1 0.684 0.713 0.042 0.12 0.33 0.309 0.013 0.138 0.34 0.008 0.244 Compound_20 N#Cc1ccc2c(c1)COC2(CCCN(C)C)c1ccc(cc1)F 0.406 0.551 0.051 0.199 0.543 0.22 0.026 0.083 0.73 0.026 0.839 Compound_21 O=C(C1=C(O)c2sccc2S(=O)(=O)N1C)Nc1ccccn1 0.413 0.483 0.048 0.172 0.181 0.676 0.002 0.034 0.379 0.078 0.098 Compound_22 NCC1(CCCCC1)CC(=O)O 0.053 0.141 0.015 0.09 0.096 0.039 0.001 0.001 0.058 0.0 0.024 Compound_23 c1ccc(cc1)c1ccc(cc1)C(n1ccnc1)c1ccccc1 0.952 0.556 0.96 0.818 0.713 0.964 0.939 0.33 0.625 0.826 0.736