ASSAY_ID ASSAY PROJECT PLATE WELL WELL_TYPE RAW_VALUE_A BSUB_VALUE_A Z_SCORE_A RAW_VALUE_B BSUB_VALUE_B Z_SCORE_B COMPOSITE_Z REPRODUCIBILITY CHEMBANK_ID VIRTUAL_ID SMILES 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 A01 compound treatment 0.102 0.0311 8.0 0.111 0.0416 11.58 13.8481 0.9837 3044425 ChemDiv3_016545 Cc1cccc(NS(=O)(=O)c2ccc(cc2)n3cccn3)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 A02 compound treatment 0.08 0.00908 2.34 0.078 0.00859 2.39 3.3443 0.9999 3125146 ChemDiv3_016546 CCc1cccc(NS(=O)(=O)c2ccc3N(C)C(=O)C(C)(C)c3c2)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 A03 compound treatment 0.079 0.00808 2.08 0.077 0.00759 2.11 2.9653 1.0 3125147 ChemDiv3_016547 CC1Cc2cc(ccc2N1C(=O)C3CC3)S(=O)(=O)CCC(=O)Nc4ccccc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 A04 compound treatment 0.074 0.00308 0.79 0.074 0.00459 1.28 1.4643 0.9738 3044427 ChemDiv3_016548 COC(=O)CN1C(=O)COc2cc(ccc12)S(=O)(=O)NC(C)C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 A05 compound treatment 0.078 0.00708 1.82 0.075 0.00559 1.56 2.3894 0.9969 3044429 ChemDiv3_016549 Cc1ccccc1NS(=O)(=O)c2cc(F)ccc2CN3C(=O)c4cccnc4C3=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 A06 mock treatment 0.079 0.00808 2.08 0.076 0.00659 1.83 2.7684 0.998 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 A07 compound treatment 0.083 0.0121 3.11 0.081 0.0116 3.23 4.4813 0.9998 3044490 ChemDiv3_016550 Brc1ccc(cc1)N2CC(=O)Nc3ccccc3S2(=O)=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 A08 mock treatment 0.074 0.00308 0.79 0.074 0.00459 1.28 1.4643 0.9738 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 A09 compound treatment 0.094 0.0231 5.94 0.092 0.0226 6.29 8.6501 0.9996 3125148 ChemDiv3_016551 Cc1ccc(CNC(=O)CN2C=NS(=O)(=O)c3ccccc23)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 A10 mock treatment 0.073 0.00208 0.54 0.072 0.00259 0.72 0.8884 0.9894 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 A11 compound treatment 0.077 0.00608 1.57 0.077 0.00759 2.11 2.6012 0.9891 3125149 ChemDiv3_016552 Cc1nn2c(=O)c3ccc(cc3nc2s1)C(=O)NCc4ccc5OCOc5c4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 A12 mock treatment 0.077 0.00608 1.57 0.075 0.00559 1.56 2.2074 1.0 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 A13 compound treatment 0.073 0.00208 0.54 0.076 0.00659 1.83 1.6761 0.8771 3044432 ChemDiv3_016553 CC1(C)CC(=O)N(CC(=O)NCc2cccs2)c3ccccc3S1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 A14 mock treatment 0.069 -0.00192 -0.49 0.071 0.00159 0.44 -0.0368 -0.0556 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 A15 compound treatment 0.074 0.00308 0.79 0.072 0.00259 0.72 1.0704 0.9988 3125150 ChemDiv3_016554 CC(C)CCNC(=O)C1CCC(=O)N1C(C)C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 A16 mock treatment 0.073 0.00208 0.54 0.072 0.00259 0.72 0.8884 0.9894 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 A17 compound treatment 0.076 0.00508 1.31 0.072 0.00259 0.72 1.4345 0.9604 3044434 ChemDiv3_016555 CCC(C)N1C(CCC1=O)C(=O)NCc2ccc3OCOc3c2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 A18 mock treatment 0.075 0.00408 1.05 0.073 0.00359 1.0 1.4494 0.9997 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 A19 compound treatment 0.071 8.25E-5 0.02 0.073 0.00359 1.0 0.7212 0.722 3125151 ChemDiv3_016556 O=C(NCCCN1CCCC1)C2CCC(=O)N2C3CCCCC3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 A20 mock treatment 0.071 8.25E-5 0.02 0.071 0.00159 0.44 0.3273 0.7402 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 A21 compound treatment 0.074 0.00308 0.79 0.072 0.00259 0.72 1.0704 0.9988 3044491 ChemDiv3_016557 Clc1ccccc1CN2C(CCC2=O)C(=O)N3CCC4(CC3)OCCO4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 A22 mock treatment 0.074 0.00308 0.79 0.072 0.00259 0.72 1.0704 0.9988 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 A23 mock treatment 0.073 0.00208 0.54 0.072 0.00259 0.72 0.8884 0.9894 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 A24 positive control 0.076 0.00508 1.31 0.075 0.00559 1.56 2.0253 0.9963 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 B01 compound treatment 0.084 0.0131 3.37 0.082 0.0126 3.51 4.8602 0.9998 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 B02 compound treatment 0.087 0.0161 4.14 0.085 0.0156 4.34 5.9972 0.9997 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 B03 compound treatment 0.213 0.142 36.58 0.205 0.136 37.76 52.5676 0.9999 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 B04 compound treatment 0.095 0.0241 6.2 0.093 0.0236 6.57 9.0291 0.9996 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 B05 compound treatment 0.147 0.0761 19.59 0.14 0.0706 19.66 27.7516 1.0 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 B06 compound treatment 0.088 0.0171 4.4 0.089 0.0196 5.45 6.967 0.9943 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 B07 compound treatment 0.12 0.0491 12.64 0.115 0.0456 12.7 17.9129 1.0 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 B08 compound treatment 0.081 0.0101 2.6 0.082 0.0126 3.51 4.3141 0.9891 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 B09 compound treatment 0.093 0.0221 5.69 0.091 0.0216 6.01 8.2711 0.9996 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 B10 compound treatment 0.323 0.252 64.9 0.32 0.251 69.79 95.2404 0.9993 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 B11 compound treatment 0.071 8.25E-5 0.02 0.071 0.00159 0.44 0.3273 0.7402 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 B12 compound treatment 0.081 0.0101 2.6 0.077 0.00759 2.11 3.3294 0.9948 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 B13 compound treatment 0.115 0.0441 11.35 0.111 0.0416 11.58 16.2149 0.9999 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 B14 compound treatment 0.069 -0.00192 -0.49 0.07 5.86E-4 0.16 -0.2337 -0.4495 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 B15 compound treatment 0.072 0.00108 0.28 0.071 0.00159 0.44 0.5094 0.9754 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 B16 compound treatment 0.08 0.00908 2.34 0.079 0.00959 2.67 3.5412 0.9978 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 B17 compound treatment 0.083 0.0121 3.11 0.081 0.0116 3.23 4.4813 0.9998 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 B18 compound treatment 0.084 0.0131 3.37 0.081 0.0116 3.23 4.6633 0.9998 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 B19 compound treatment 0.235 0.164 42.25 0.221 0.152 42.22 59.7237 1.0 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 B20 compound treatment 0.145 0.0741 19.07 0.138 0.0686 19.1 26.9936 1.0 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 B21 compound treatment 0.284 0.213 54.86 0.297 0.228 63.38 83.6108 0.9974 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 B22 mock treatment 0.071 8.25E-5 0.02 0.068 -0.00141 -0.39 -0.2635 -0.668 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 B23 mock treatment 0.071 8.25E-5 0.02 0.07 5.86E-4 0.16 0.1304 0.7925 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 B24 positive control 0.075 0.00408 1.05 0.073 0.00359 1.0 1.4494 0.9997 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 C01 compound treatment 0.124 0.0531 13.67 0.114 0.0446 12.42 18.4442 0.9989 3044493 ChemDiv3_016558 CCc1cccc(NC(=O)CN2C(=O)COc3cc(ccc23)S(=O)(=O)Nc4ccccc4)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 C02 compound treatment 0.121 0.0501 12.89 0.115 0.0456 12.7 18.0949 1.0 3044494 ChemDiv3_016559 CC1CC(C)CN(C1)C(=O)CN(C)S(=O)(=O)c2cc3OCC(=O)Nc3cc2Cl 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 C03 compound treatment 0.072 0.00108 0.28 0.07 5.86E-4 0.16 0.3124 0.9675 3044496 ChemDiv3_016560 Cc1cc(on1)c2ccc(cc2)S(=O)(=O)NC3CCCC3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 C04 compound treatment 0.077 0.00608 1.57 0.074 0.00459 1.28 2.0104 0.9949 3044498 ChemDiv3_016561 Cc1nc2ccc(cc2o1)S(=O)(=O)NC3CCCC3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 C05 compound treatment 0.077 0.00608 1.57 0.074 0.00459 1.28 2.0104 0.9949 3044499 ChemDiv3_016562 CC(C)(C)NC(=O)c1cc(n[nH]1)c2ccco2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 C06 mock treatment 0.074 0.00308 0.79 0.071 0.00159 0.44 0.8735 0.9617 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 C07 compound treatment 0.087 0.0161 4.14 0.091 0.0216 6.01 7.1787 0.9834 3125152 ChemDiv3_016563 COc1ccccc1NC(=O)CN2C=NS(=O)(=O)c3ccccc23 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 C08 mock treatment 0.075 0.00408 1.05 0.072 0.00259 0.72 1.2525 0.983 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 C09 compound treatment 0.161 0.0901 23.19 0.157 0.0876 24.39 33.6481 0.9997 3044501 ChemDiv3_016564 Cc1ccc(cc1)N2C(=O)N(CC(=O)c3ccccc3)c4ccccc4S2(=O)=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 C10 mock treatment 0.07 -9.18E-4 -0.24 0.068 -0.00141 -0.39 -0.4455 -0.9701 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 C11 compound treatment 0.084 0.0131 3.37 0.087 0.0176 4.9 5.8449 0.9833 3125153 ChemDiv3_016565 COc1ccc(CCNC(=O)c2ccc3c(=O)n4nc(C)sc4nc3c2)cc1OC 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 C12 mock treatment 0.071 8.25E-5 0.02 0.071 0.00159 0.44 0.3273 0.7402 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 C13 compound treatment 0.16 0.0891 22.94 0.153 0.0836 23.28 32.6784 1.0 3044503 ChemDiv3_016566 CN1CCSc2ccc(cc12)C(=O)Nc3ccc(Br)c(C)c3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 C14 mock treatment 0.071 8.25E-5 0.02 0.068 -0.00141 -0.39 -0.2635 -0.668 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 C15 compound treatment 0.071 8.25E-5 0.02 0.069 -4.14E-4 -0.12 -0.0665 -0.5674 3125154 ChemDiv3_016567 CC(C)N1C(CCC1=O)C(=O)N2CCC3(CC2)OCCO3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 C16 mock treatment 0.074 0.00308 0.79 0.071 0.00159 0.44 0.8735 0.9617 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 C17 compound treatment 0.073 0.00208 0.54 0.073 0.00359 1.0 1.0853 0.9575 3125155 ChemDiv3_016568 CCOC(=O)N1CCC(CC1)NC(=O)CN2C(=O)C(CC)Oc3ccc(C)cc23 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 C18 mock treatment 0.072 0.00108 0.28 0.07 5.86E-4 0.16 0.3124 0.9675 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 C19 compound treatment 0.073 0.00208 0.54 0.069 -4.14E-4 -0.12 0.2976 0.5426 3044505 ChemDiv3_016569 COc1ccc(CN2CC(CC2=O)C(=O)NCc3ccccn3)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 C20 mock treatment 0.071 8.25E-5 0.02 0.067 -0.00241 -0.67 -0.4604 -0.6844 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 C21 compound treatment 0.071 8.25E-5 0.02 0.068 -0.00141 -0.39 -0.2635 -0.668 3125156 ChemDiv3_016570 COC(CN(C)C(=O)CN1CCN(Cc2ccc(Cl)cc2)C1=O)OC 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 C22 mock treatment 0.069 -0.00192 -0.49 0.067 -0.00241 -0.67 -0.8245 -0.9885 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 C23 mock treatment 0.071 8.25E-5 0.02 0.069 -4.14E-4 -0.12 -0.0665 -0.5674 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 C24 positive control 0.078 0.00708 1.82 0.077 0.00759 2.11 2.7833 0.9973 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 D01 compound treatment 0.115 0.0441 11.35 0.108 0.0386 10.75 15.6241 0.9996 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 D02 compound treatment 0.136 0.0651 16.76 0.128 0.0586 16.32 23.3858 0.9999 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 D03 compound treatment 0.074 0.00308 0.79 0.071 0.00159 0.44 0.8735 0.9617 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 D04 compound treatment 0.077 0.00608 1.57 0.074 0.00459 1.28 2.0104 0.9949 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 D05 compound treatment 0.083 0.0121 3.11 0.081 0.0116 3.23 4.4813 0.9998 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 D06 compound treatment 0.095 0.0241 6.2 0.092 0.0226 6.29 8.8321 1.0 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 D07 compound treatment 0.158 0.0871 22.42 0.154 0.0846 23.56 32.5112 0.9997 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 D08 compound treatment 0.126 0.0551 14.18 0.118 0.0486 13.53 19.596 0.9997 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 D09 compound treatment 0.091 0.0201 5.17 0.087 0.0176 4.9 7.1193 0.9996 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 D10 compound treatment 0.072 0.00108 0.28 0.068 -0.00141 -0.39 -0.0814 -0.1687 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 D11 compound treatment 0.106 0.0351 9.03 0.102 0.0326 9.07 12.804 1.0 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 D12 compound treatment 0.074 0.00308 0.79 0.072 0.00259 0.72 1.0704 0.9988 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 D13 compound treatment 0.106 0.0351 9.03 0.1 0.0306 8.52 12.4102 0.9996 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 D14 compound treatment 0.123 0.0521 13.41 0.129 0.0596 16.59 21.216 0.9944 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 D15 compound treatment 0.148 0.0771 19.85 0.135 0.0656 18.27 26.949 0.9991 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 D16 compound treatment 0.074 0.00308 0.79 0.072 0.00259 0.72 1.0704 0.9988 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 D17 compound treatment 0.235 0.164 42.25 0.258 0.189 52.52 67.0099 0.9942 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 D18 compound treatment 0.071 8.25E-5 0.02 0.071 0.00159 0.44 0.3273 0.7402 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 D19 compound treatment 0.305 0.234 60.27 0.292 0.223 61.99 86.4494 0.9999 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 D20 compound treatment 0.068 -0.00292 -0.75 0.065 -0.00441 -1.23 -1.4004 -0.9721 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 D21 compound treatment 0.113 0.0421 10.83 0.108 0.0386 10.75 15.26 1.0 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 D22 mock treatment 0.069 -0.00192 -0.49 0.067 -0.00241 -0.67 -0.8245 -0.9885 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 D23 mock treatment 0.071 8.25E-5 0.02 0.068 -0.00141 -0.39 -0.2635 -0.668 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 D24 positive control 0.079 0.00808 2.08 0.077 0.00759 2.11 2.9653 1.0 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 E01 compound treatment 0.074 0.00308 0.79 0.084 0.0146 4.06 3.4335 0.8296 3044506 ChemDiv3_016571 O=C(NCc1ccccc1)c2ccc(cc2)n3cnc4cccnc34 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 E02 compound treatment 0.107 0.0361 9.29 0.104 0.0346 9.63 13.3799 0.9998 3125157 ChemDiv3_016572 CN(CC(=O)Nc1ccc(C)c(F)c1)c2cc3OCC(=O)Nc3cc2Cl 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 E03 compound treatment 0.111 0.0401 10.32 0.114 0.0446 12.42 16.0774 0.9958 3044508 ChemDiv3_016573 Cc1cc(on1)c2ccc(cc2)S(=O)(=O)N3CCc4ccccc34 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 E04 compound treatment 0.071 8.25E-5 0.02 0.068 -0.00141 -0.39 -0.2635 -0.668 3125158 ChemDiv3_016574 O=C(NCc1ccc(s1)S(=O)(=O)N2CCOCC2)c3cccnc3C(=O)N4CCOCC4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 E05 compound treatment 0.084 0.0131 3.37 0.081 0.0116 3.23 4.6633 0.9998 3125159 ChemDiv3_016575 CC(CNC(=O)c1cc(n[nH]1)c2ccco2)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 E06 mock treatment 0.074 0.00308 0.79 0.071 0.00159 0.44 0.8735 0.9617 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 E07 compound treatment 0.076 0.00508 1.31 0.073 0.00359 1.0 1.6315 0.9911 3044510 ChemDiv3_016576 CCCCN1C=NS(=O)(=O)c2ccccc12 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 E08 mock treatment 0.076 0.00508 1.31 0.073 0.00359 1.0 1.6315 0.9911 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 E09 compound treatment 0.077 0.00608 1.57 0.074 0.00459 1.28 2.0104 0.9949 3044511 ChemDiv3_016577 Cc1ccc(C)c(c1)N2C(=O)Nc3ccccc3S2(=O)=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 E10 mock treatment 0.072 0.00108 0.28 0.068 -0.00141 -0.39 -0.0814 -0.1687 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 E11 compound treatment 0.172 0.101 26.03 0.093 0.0236 6.57 23.0476 0.8586 3125160 ChemDiv3_016578 Cc1nn2c(=O)c3ccc(cc3nc2s1)C(=O)N4CCN(CC4)c5ccc(F)cc5 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 E12 mock treatment 0.074 0.00308 0.79 0.072 0.00259 0.72 1.0704 0.9988 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 E13 compound treatment 0.145 0.0741 19.07 0.142 0.0726 20.21 27.7813 0.9996 3125161 ChemDiv3_016579 CC(=O)Nc1ccccc1c2nc3ccc(cc3[nH]c2=O)C(=O)NCc4ccccc4Cl 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 E14 mock treatment 0.071 8.25E-5 0.02 0.067 -0.00241 -0.67 -0.4604 -0.6844 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 E15 compound treatment 0.072 0.00108 0.28 0.07 5.86E-4 0.16 0.3124 0.9675 3044513 ChemDiv3_016580 CC(C)N1C(CCC1=O)C(=O)NCCC2=CCCCC2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 E16 mock treatment 0.071 8.25E-5 0.02 0.071 0.00159 0.44 0.3273 0.7402 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 E17 compound treatment 0.073 0.00208 0.54 0.073 0.00359 1.0 1.0853 0.9575 3125162 ChemDiv3_016581 COc1ccc(Br)cc1CNC(=O)C2CCC(=O)N2C(C)C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 E18 mock treatment 0.075 0.00408 1.05 0.071 0.00159 0.44 1.0555 0.9258 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 E19 compound treatment 0.075 0.00408 1.05 0.071 0.00159 0.44 1.0555 0.9258 3044515 ChemDiv3_016582 O=C(C1CN(CCc2ccccc2)C(=O)C1)N3CCC4(CC3)OCCO4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 E20 mock treatment 0.071 8.25E-5 0.02 0.068 -0.00141 -0.39 -0.2635 -0.668 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 E21 compound treatment 0.084 0.0131 3.37 0.08 0.0106 2.95 4.4664 0.9978 3125163 ChemDiv3_016583 Cc1cc(Br)ccc1NC(=O)CCCc2c[nH]c3ccccc23 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 E22 mock treatment 0.07 -9.18E-4 -0.24 0.067 -0.00241 -0.67 -0.6424 -0.9015 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 E23 mock treatment 0.071 8.25E-5 0.02 0.068 -0.00141 -0.39 -0.2635 -0.668 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 E24 positive control 0.08 0.00908 2.34 0.079 0.00959 2.67 3.5412 0.9978 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 F01 compound treatment 0.085 0.0141 3.63 0.084 0.0146 4.06 5.4362 0.9984 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 F02 compound treatment 0.17 0.0991 25.51 0.163 0.0936 26.06 36.4682 0.9999 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 F03 compound treatment 0.146 0.0751 19.33 0.136 0.0666 18.54 26.7818 0.9998 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 F04 compound treatment 0.113 0.0421 10.83 0.109 0.0396 11.02 15.4569 1.0 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 F05 compound treatment 0.076 0.00508 1.31 0.072 0.00259 0.72 1.4345 0.9604 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 F06 compound treatment 0.116 0.0451 11.61 0.115 0.0456 12.7 17.1846 0.999 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 F07 compound treatment 0.078 0.00708 1.82 0.075 0.00559 1.56 2.3894 0.9969 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 F08 compound treatment 0.157 0.0861 22.16 0.147 0.0776 21.61 30.9506 0.9999 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 F09 compound treatment 0.085 0.0141 3.63 0.082 0.0126 3.51 5.0423 0.9999 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 F10 compound treatment 0.091 0.0201 5.17 0.087 0.0176 4.9 7.1193 0.9996 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 F11 compound treatment 0.091 0.0201 5.17 0.085 0.0156 4.34 6.7254 0.9962 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 F12 compound treatment 0.077 0.00608 1.57 0.074 0.00459 1.28 2.0104 0.9949 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 F13 compound treatment 0.077 0.00608 1.57 0.073 0.00359 1.0 1.8135 0.9764 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 F14 compound treatment 0.111 0.0401 10.32 0.111 0.0416 11.58 15.4867 0.9983 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 F15 compound treatment 0.073 0.00208 0.54 0.069 -4.14E-4 -0.12 0.2976 0.5426 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 F16 compound treatment 0.072 0.00108 0.28 0.073 0.00359 1.0 0.9032 0.8712 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 F17 compound treatment 0.166 0.0951 24.48 0.149 0.0796 22.16 32.983 0.9988 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 F18 compound treatment 0.141 0.0701 18.04 0.136 0.0666 18.54 25.8715 0.9999 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 F19 compound treatment 0.242 0.171 44.05 0.236 0.167 46.39 63.9519 0.9997 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 F20 compound treatment 0.093 0.0221 5.69 0.096 0.0266 7.4 9.2557 0.9915 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 F21 compound treatment 0.1 0.0291 7.49 0.096 0.0266 7.4 10.5301 1.0 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 F22 mock treatment 0.071 8.25E-5 0.02 0.067 -0.00241 -0.67 -0.4604 -0.6844 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 F23 mock treatment 0.071 8.25E-5 0.02 0.069 -4.14E-4 -0.12 -0.0665 -0.5674 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 F24 positive control 0.08 0.00908 2.34 0.078 0.00859 2.39 3.3443 0.9999 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 G01 compound treatment 0.076 0.00508 1.31 0.073 0.00359 1.0 1.6315 0.9911 3044566 ChemDiv3_016584 O=C(NC1CCCCCC1)c2ccc(cc2)n3cnc4cccnc34 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 G02 compound treatment 0.112 0.0411 10.58 0.077 0.00759 2.11 8.9733 0.8319 3044567 ChemDiv3_016585 CN(CC(=O)N1CCN(CC1)c2ccccc2F)c3cc4OCC(=O)Nc4cc3Cl 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 G03 compound treatment 0.088 0.0171 4.4 0.084 0.0146 4.06 5.9823 0.9992 3044569 ChemDiv3_016586 Cc1cc(on1)c2ccc(cc2)S(=O)(=O)N3CCCCC3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 G04 compound treatment 0.071 8.25E-5 0.02 0.068 -0.00141 -0.39 -0.2635 -0.668 3044570 ChemDiv3_016587 COC(=O)CN1C(=O)CSc2cc(ccc12)S(=O)(=O)N3CCCC3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 G05 compound treatment 0.074 0.00308 0.79 0.072 0.00259 0.72 1.0704 0.9988 3044572 ChemDiv3_016588 CCOC(=O)C1CCN(CC1)C(=O)c2cc(n[nH]2)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 G06 mock treatment 0.075 0.00408 1.05 0.071 0.00159 0.44 1.0555 0.9258 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 G07 compound treatment 0.15 0.0791 20.36 0.149 0.0796 22.16 30.0701 0.9991 3044573 ChemDiv3_016589 COc1ccc(cc1)N2C(=O)N(Cc3ccccc3)c4ccccc4S2(=O)=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 G08 mock treatment 0.075 0.00408 1.05 0.071 0.00159 0.44 1.0555 0.9258 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 G09 compound treatment 0.15 0.0791 20.36 0.15 0.0806 22.44 30.267 0.9988 3044575 ChemDiv3_016590 Cc1cccc(c1)N2C(=O)N(Cc3ccccc3)c4ccccc4S2(=O)=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 G10 mock treatment 0.07 -9.18E-4 -0.24 0.068 -0.00141 -0.39 -0.4455 -0.9701 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 G11 compound treatment 0.076 0.00508 1.31 0.077 0.00759 2.11 2.4192 0.9735 3125164 ChemDiv3_016591 COc1ccc(Nc2nn3c(=O)c4ccccc4nc3s2)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 G12 mock treatment 0.074 0.00308 0.79 0.072 0.00259 0.72 1.0704 0.9988 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 G13 compound treatment 0.076 0.00508 1.31 0.074 0.00459 1.28 1.8284 0.9999 3125276 ChemDiv3_016592 O=C(NC1CCCC1)C2N(Cc3ccccc3)C(=O)c4ccccc24 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 G14 mock treatment 0.072 0.00108 0.28 0.068 -0.00141 -0.39 -0.0814 -0.1687 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 G15 compound treatment 0.071 8.25E-5 0.02 0.068 -0.00141 -0.39 -0.2635 -0.668 3044577 ChemDiv3_016593 CC(C)N1C(CCC1=O)C(=O)N2CCCc3ccccc23 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 G16 mock treatment 0.073 0.00208 0.54 0.069 -4.14E-4 -0.12 0.2976 0.5426 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 G17 compound treatment 0.074 0.00308 0.79 0.075 0.00559 1.56 1.6612 0.9512 3125277 ChemDiv3_016594 CC(C)N1C(CCC1=O)C(=O)NCc2cccs2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 G18 mock treatment 0.075 0.00408 1.05 0.071 0.00159 0.44 1.0555 0.9258 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 G19 compound treatment 0.076 0.00508 1.31 0.071 0.00159 0.44 1.2376 0.8961 3125278 ChemDiv3_016595 COc1ccc(CCNC(=O)C2CCC(=O)N2CCc3ccccc3)cc1OC 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 G20 mock treatment 0.071 8.25E-5 0.02 0.067 -0.00241 -0.67 -0.4604 -0.6844 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 G21 compound treatment 0.077 0.00608 1.57 0.074 0.00459 1.28 2.0104 0.9949 3044579 ChemDiv3_016596 Fc1cc(Cl)ccc1NC(=O)CCCc2c[nH]c3ccccc23 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 G22 mock treatment 0.069 -0.00192 -0.49 0.068 -0.00141 -0.39 -0.6276 -0.9937 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 G23 mock treatment 0.071 8.25E-5 0.02 0.069 -4.14E-4 -0.12 -0.0665 -0.5674 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 G24 positive control 0.08 0.00908 2.34 0.08 0.0106 2.95 3.7382 0.9934 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 H01 compound treatment 0.073 0.00208 0.54 0.071 0.00159 0.44 0.6914 0.9954 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 H02 compound treatment 0.147 0.0761 19.59 0.139 0.0696 19.38 27.5547 1.0 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 H03 compound treatment 0.075 0.00408 1.05 0.071 0.00159 0.44 1.0555 0.9258 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 H04 compound treatment 0.126 0.0551 14.18 0.121 0.0516 14.37 20.1868 1.0 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 H05 compound treatment 0.073 0.00208 0.54 0.072 0.00259 0.72 0.8884 0.9894 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 H06 compound treatment 0.184 0.113 29.12 0.19 0.121 33.58 44.334 0.9975 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 H07 compound treatment 0.076 0.00508 1.31 0.074 0.00459 1.28 1.8284 0.9999 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 H08 compound treatment 0.115 0.0441 11.35 0.109 0.0396 11.02 15.821 0.9999 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 H09 compound treatment 0.074 0.00308 0.79 0.072 0.00259 0.72 1.0704 0.9988 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 H10 compound treatment 0.069 -0.00192 -0.49 0.068 -0.00141 -0.39 -0.6276 -0.9937 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 H11 compound treatment 0.157 0.0861 22.16 0.132 0.0626 17.43 27.9968 0.9929 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 H12 compound treatment 0.09 0.0191 4.91 0.084 0.0146 4.06 6.3464 0.9955 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 H13 compound treatment 0.113 0.0421 10.83 0.104 0.0346 9.63 14.4723 0.9983 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 H14 compound treatment 0.113 0.0421 10.83 0.11 0.0406 11.3 15.6538 0.9998 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 H15 compound treatment 0.079 0.00808 2.08 0.081 0.0116 3.23 3.753 0.9775 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 H16 compound treatment 0.086 0.0151 3.88 0.07 5.86E-4 0.16 2.8613 0.7362 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 H17 compound treatment 0.668 0.597 153.73 0.647 0.578 160.85 222.4451 0.9997 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 H18 compound treatment 0.1 0.0291 7.49 0.079 0.00959 2.67 7.1824 0.9035 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 H19 compound treatment 0.106 0.0351 9.03 0.101 0.0316 8.8 12.6071 0.9999 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 H20 compound treatment 0.272 0.201 51.77 0.187 0.118 32.75 59.7644 0.9756 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 H21 compound treatment 0.119 0.0481 12.38 0.08 0.0106 2.95 10.8384 0.8517 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 H22 mock treatment 0.069 -0.00192 -0.49 0.067 -0.00241 -0.67 -0.8245 -0.9885 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 H23 mock treatment 0.07 -9.18E-4 -0.24 0.068 -0.00141 -0.39 -0.4455 -0.9701 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 H24 positive control 0.08 0.00908 2.34 0.08 0.0106 2.95 3.7382 0.9934 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 I01 compound treatment 0.073 0.00208 0.54 0.072 0.00259 0.72 0.8884 0.9894 3125279 ChemDiv3_016597 O=C(NCC1CCCO1)c2ccc(cc2)n3cnc4cccnc34 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 I02 compound treatment 0.076 0.00508 1.31 0.074 0.00459 1.28 1.8284 0.9999 3044580 ChemDiv3_016598 CN(CC(=O)N1CCc2ccccc2C1)c3cc4OCC(=O)Nc4cc3Cl 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 I03 compound treatment 0.159 0.0881 22.68 0.153 0.0836 23.28 32.4963 0.9999 3125280 ChemDiv3_016599 Cc1cc(on1)c2ccc(cc2)S(=O)(=O)Nc3ccc(cc3)c4ccno4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 I04 mock treatment 0.067 -0.00392 -1.01 0.068 -0.00141 -0.39 -0.9917 -0.9159 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 I05 compound treatment 0.071 8.25E-5 0.02 0.07 5.86E-4 0.16 0.1304 0.7925 3044582 ChemDiv3_016600 CCCNC(=O)c1cc(n[nH]1)c2ccccc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 I06 mock treatment 0.071 8.25E-5 0.02 0.07 5.86E-4 0.16 0.1304 0.7925 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 I07 compound treatment 0.076 0.00508 1.31 0.073 0.00359 1.0 1.6315 0.9911 3125281 ChemDiv3_016601 COc1ccccc1C(=O)CN2C=NS(=O)(=O)c3ccccc23 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 I08 mock treatment 0.073 0.00208 0.54 0.071 0.00159 0.44 0.6914 0.9954 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 I09 compound treatment 0.106 0.0351 9.03 0.11 0.0406 11.3 14.3794 0.9938 3125282 ChemDiv3_016602 COc1ccc(CNC(=O)c2ccc(CN3C(=NS(=O)(=O)c4ccccc34)C)cc2)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 I10 mock treatment 0.067 -0.00392 -1.01 0.067 -0.00241 -0.67 -1.1886 -0.9806 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 I11 compound treatment 0.182 0.111 28.6 0.186 0.117 32.47 43.1822 0.998 1459368 ChemDiv3_016603 COc1cc2CCN(C(C)c2cc1OC)c3ncnc4n(ncc34)c5cccc(C)c5 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 I12 mock treatment 0.07 -9.18E-4 -0.24 0.071 0.00159 0.44 0.1453 0.29 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 I13 compound treatment 0.073 0.00208 0.54 0.072 0.00259 0.72 0.8884 0.9894 3125283 ChemDiv3_016604 O=C(NC1CCCC1)C2N(C3CCCC3)C(=O)c4ccccc24 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 I14 mock treatment 0.067 -0.00392 -1.01 0.067 -0.00241 -0.67 -1.1886 -0.9806 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 I15 compound treatment 0.068 -0.00292 -0.75 0.067 -0.00241 -0.67 -1.0066 -0.9985 3044585 ChemDiv3_016605 CCOC(=O)N1CCN(CC1)C(=O)C2CCC(=O)N2C(C)C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 I16 mock treatment 0.07 -9.18E-4 -0.24 0.067 -0.00241 -0.67 -0.6424 -0.9015 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 I17 compound treatment 0.075 0.00408 1.05 0.07 5.86E-4 0.16 0.8586 0.8072 3125284 ChemDiv3_016606 O=C(NC1CC1)C2CCC(=O)N2C3CCCC3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 I18 mock treatment 0.076 0.00508 1.31 0.071 0.00159 0.44 1.2376 0.8961 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 I19 compound treatment 0.072 0.00108 0.28 0.067 -0.00241 -0.67 -0.2783 -0.3824 3125285 ChemDiv3_016607 O=C(NCc1cccnc1)C2CCC(=O)N2CCc3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 I20 mock treatment 0.071 8.25E-5 0.02 0.067 -0.00241 -0.67 -0.4604 -0.6844 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 I21 compound treatment 0.082 0.0111 2.85 0.078 0.00859 2.39 3.7084 0.9961 3044587 ChemDiv3_016608 COc1ccc(NC(=O)CCCc2c[nH]c3ccccc23)c(OC)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 I22 mock treatment 0.072 0.00108 0.28 0.068 -0.00141 -0.39 -0.0814 -0.1687 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 I23 mock treatment 0.069 -0.00192 -0.49 0.068 -0.00141 -0.39 -0.6276 -0.9937 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 I24 positive control 0.079 0.00808 2.08 0.077 0.00759 2.11 2.9653 1.0 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 J01 compound treatment 0.077 0.00608 1.57 0.075 0.00559 1.56 2.2074 1.0 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 J02 compound treatment 0.205 0.134 34.52 0.197 0.128 35.53 49.5357 0.9999 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 J03 compound treatment 0.127 0.0561 14.44 0.125 0.0556 15.48 21.1565 0.9994 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 J04 compound treatment 0.083 0.0121 3.11 0.082 0.0126 3.51 4.6782 0.9982 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 J05 compound treatment 0.156 0.0851 21.91 0.152 0.0826 23.0 31.7532 0.9997 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 J06 compound treatment 0.109 0.0381 9.81 0.108 0.0386 10.75 14.5318 0.999 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 J07 compound treatment 0.077 0.00608 1.57 0.076 0.00659 1.83 2.4043 0.9969 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 J08 compound treatment 0.073 0.00208 0.54 0.071 0.00159 0.44 0.6914 0.9954 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 J09 compound treatment 0.076 0.00508 1.31 0.075 0.00559 1.56 2.0253 0.9963 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 J10 compound treatment 0.066 -0.00492 -1.27 0.069 -4.14E-4 -0.12 -0.9768 -0.7683 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 J11 compound treatment 0.074 0.00308 0.79 0.076 0.00659 1.83 1.8581 0.9298 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 J12 compound treatment 0.093 0.0221 5.69 0.092 0.0226 6.29 8.468 0.9987 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 J13 compound treatment 0.107 0.0361 9.29 0.114 0.0446 12.42 15.3492 0.9898 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 J14 compound treatment 0.067 -0.00392 -1.01 0.069 -4.14E-4 -0.12 -0.7948 -0.7829 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 J15 compound treatment 0.076 0.00508 1.31 0.074 0.00459 1.28 1.8284 0.9999 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 J16 compound treatment 0.075 0.00408 1.05 0.075 0.00559 1.56 1.8432 0.9818 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 J17 compound treatment 0.112 0.0411 10.58 0.109 0.0396 11.02 15.2749 0.9998 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 J18 compound treatment 0.075 0.00408 1.05 0.072 0.00259 0.72 1.2525 0.983 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 J19 compound treatment 0.072 0.00108 0.28 0.073 0.00359 1.0 0.9032 0.8712 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 J20 compound treatment 0.15 0.0791 20.36 0.15 0.0806 22.44 30.267 0.9988 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 J21 compound treatment 0.181 0.11 28.34 0.175 0.106 29.41 40.8339 0.9998 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 J22 mock treatment 0.068 -0.00292 -0.75 0.067 -0.00241 -0.67 -1.0066 -0.9985 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 J23 mock treatment 0.07 -9.18E-4 -0.24 0.069 -4.14E-4 -0.12 -0.2486 -0.9456 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 J24 positive control 0.077 0.00608 1.57 0.078 0.00859 2.39 2.7981 0.9789 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 K01 compound treatment 0.168 0.0971 25.0 0.161 0.0916 25.51 35.7102 0.9999 3125286 ChemDiv3_016609 O=C(Nc1ccccc1)N2CCC(=CC2)c3c[nH]c4ccccc34 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 K02 compound treatment 0.08 0.00908 2.34 0.074 0.00459 1.28 2.5566 0.9595 3044589 ChemDiv3_016610 O=C1CN(c2ccccc2N1)S(=O)(=O)c3cccs3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 K03 compound treatment 0.149 0.0781 20.1 0.149 0.0796 22.16 29.888 0.9988 3125287 ChemDiv3_016611 CN(CC(=O)Nc1cccc(C)c1)S(=O)(=O)c2ccc(cc2)c3cc(C)no3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 K04 mock treatment 0.068 -0.00292 -0.75 0.067 -0.00241 -0.67 -1.0066 -0.9985 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 K05 compound treatment 0.096 0.0251 6.46 0.091 0.0216 6.01 8.8173 0.9994 3125288 ChemDiv3_016612 CC1CCC(CC1)NC(=O)c2cc(n[nH]2)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 K06 mock treatment 0.069 -0.00192 -0.49 0.07 5.86E-4 0.16 -0.2337 -0.4495 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 K07 compound treatment 0.07 -9.18E-4 -0.24 0.069 -4.14E-4 -0.12 -0.2486 -0.9456 3125289 ChemDiv3_016613 COc1ccc(CCNC(=O)CN2C=NS(=O)(=O)c3ccccc23)cc1OC 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 K08 mock treatment 0.072 0.00108 0.28 0.07 5.86E-4 0.16 0.3124 0.9675 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 K09 compound treatment 0.072 0.00108 0.28 0.071 0.00159 0.44 0.5094 0.9754 3043570 ChemDiv3_016614 Cc1ccc(CNC(=O)CSC2=NS(=O)(=O)c3ccccc3N2)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 K10 mock treatment 0.065 -0.00592 -1.52 0.068 -0.00141 -0.39 -1.3558 -0.8616 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 K11 compound treatment 0.087 0.0161 4.14 0.09 0.0206 5.73 6.9818 0.9872 3043571 ChemDiv3_016615 COc1cccc2cc(CC(=O)O)oc12 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 K12 mock treatment 0.069 -0.00192 -0.49 0.071 0.00159 0.44 -0.0368 -0.0556 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 K13 compound treatment 0.072 0.00108 0.28 0.071 0.00159 0.44 0.5094 0.9754 3043573 ChemDiv3_016616 CCC(C)NC(=O)C1N(Cc2ccccc2OC)C(=O)c3ccccc13 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 K14 mock treatment 0.067 -0.00392 -1.01 0.067 -0.00241 -0.67 -1.1886 -0.9806 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 K15 compound treatment 0.07 -9.18E-4 -0.24 0.069 -4.14E-4 -0.12 -0.2486 -0.9456 3043575 ChemDiv3_016617 COc1ccc(CCNC(=O)C2N(C3CCCCCC3)C(=O)c4ccccc24)cc1OC 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 K16 mock treatment 0.07 -9.18E-4 -0.24 0.067 -0.00241 -0.67 -0.6424 -0.9015 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 K17 compound treatment 0.073 0.00208 0.54 0.071 0.00159 0.44 0.6914 0.9954 3043576 ChemDiv3_016618 O=C(C1CN(C2CCCC2)C(=O)C1)N3CCC4(CC3)OCCO4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 K18 mock treatment 0.072 0.00108 0.28 0.07 5.86E-4 0.16 0.3124 0.9675 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 K19 compound treatment 0.072 0.00108 0.28 0.071 0.00159 0.44 0.5094 0.9754 3043578 ChemDiv3_016619 O=C(C1CCC(=O)N1C2CCCC2)N3CCN(CC3)c4ccccc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 K20 mock treatment 0.069 -0.00192 -0.49 0.069 -4.14E-4 -0.12 -0.4307 -0.8494 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 K21 compound treatment 0.069 -0.00192 -0.49 0.069 -4.14E-4 -0.12 -0.4307 -0.8494 3043580 ChemDiv3_016620 COc1ccc(cc1)N2CCN(CC2)C(=O)c3ccc(OC)nc3OC 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 K22 mock treatment 0.068 -0.00292 -0.75 0.068 -0.00141 -0.39 -0.8096 -0.9546 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 K23 mock treatment 0.068 -0.00292 -0.75 0.071 0.00159 0.44 -0.2189 -0.2512 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 K24 positive control 0.076 0.00508 1.31 0.078 0.00859 2.39 2.6161 0.9598 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 L01 compound treatment 0.089 0.0181 4.66 0.091 0.0216 6.01 7.5429 0.992 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 L02 compound treatment 0.141 0.0701 18.04 0.126 0.0566 15.76 23.9023 0.9977 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 L03 compound treatment 0.1 0.0291 7.49 0.095 0.0256 7.13 10.3332 0.9997 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 L04 compound treatment 0.089 0.0181 4.66 0.085 0.0156 4.34 6.3613 0.9994 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 L05 compound treatment 0.159 0.0881 22.68 0.158 0.0886 24.67 33.4809 0.9991 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 L06 compound treatment 0.162 0.0911 23.45 0.165 0.0956 26.62 35.4056 0.998 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 L07 compound treatment 0.112 0.0411 10.58 0.118 0.0486 13.53 17.0472 0.9926 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 L08 compound treatment 0.072 0.00108 0.28 0.071 0.00159 0.44 0.5094 0.9754 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 L09 compound treatment 0.125 0.0541 13.92 0.129 0.0596 16.59 21.5801 0.9962 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 L10 compound treatment 0.065 -0.00592 -1.52 0.065 -0.00441 -1.23 -1.9466 -0.9943 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 L11 compound treatment 0.113 0.0421 10.83 0.106 0.0366 10.19 14.8661 0.9995 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 L12 compound treatment 0.153 0.0821 21.13 0.156 0.0866 24.11 31.9947 0.9978 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 L13 compound treatment 0.07 -9.18E-4 -0.24 0.069 -4.14E-4 -0.12 -0.2486 -0.9456 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 L14 compound treatment 0.068 -0.00292 -0.75 0.068 -0.00141 -0.39 -0.8096 -0.9546 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 L15 compound treatment 0.161 0.0901 23.19 0.16 0.0906 25.23 34.2389 0.9991 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 L16 compound treatment 0.069 -0.00192 -0.49 0.069 -4.14E-4 -0.12 -0.4307 -0.8494 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 L17 compound treatment 0.93 0.859 221.19 0.924 0.855 238.0 324.6926 0.9993 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 L18 compound treatment 0.073 0.00208 0.54 0.071 0.00159 0.44 0.6914 0.9954 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 L19 compound treatment 0.07 -9.18E-4 -0.24 0.07 5.86E-4 0.16 -0.0517 -0.18 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 L20 compound treatment 0.071 8.25E-5 0.02 0.068 -0.00141 -0.39 -0.2635 -0.668 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 L21 compound treatment 0.069 -0.00192 -0.49 0.067 -0.00241 -0.67 -0.8245 -0.9885 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 L22 mock treatment 0.068 -0.00292 -0.75 0.068 -0.00141 -0.39 -0.8096 -0.9546 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 L23 mock treatment 0.071 8.25E-5 0.02 0.071 0.00159 0.44 0.3273 0.7402 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 L24 positive control 0.076 0.00508 1.31 0.079 0.00959 2.67 2.813 0.9462 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 M01 compound treatment 0.132 0.0611 15.73 0.126 0.0566 15.76 22.2638 1.0 3125290 ChemDiv3_016621 Cc1ccc(CNC(=O)N2CCC(=CC2)c3c[nH]c4ccccc34)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 M02 compound treatment 0.077 0.00608 1.57 0.074 0.00459 1.28 2.0104 0.9949 3125291 ChemDiv3_016622 CC(CC(=O)N1CCOCC1)S(=O)(=O)c2ccc3NC(=O)CSc3c2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 M03 compound treatment 0.075 0.00408 1.05 0.071 0.00159 0.44 1.0555 0.9258 3043582 ChemDiv3_016623 COc1cccc(NS(=O)(=O)c2ccc(CN3C(=O)c4cccnc4C3=O)s2)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 M04 mock treatment 0.069 -0.00192 -0.49 0.068 -0.00141 -0.39 -0.6276 -0.9937 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 M05 compound treatment 0.114 0.0431 11.09 0.111 0.0416 11.58 16.0328 0.9998 3125292 ChemDiv3_016624 Fc1ccccc1N2CCN(CCNC(=O)c3cc(n[nH]3)c4ccccc4)CC2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 M06 mock treatment 0.071 8.25E-5 0.02 0.07 5.86E-4 0.16 0.1304 0.7925 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 M07 compound treatment 0.122 0.0511 13.15 0.127 0.0576 16.04 20.6401 0.9952 3043584 ChemDiv3_016625 Cc1ccc(cc1)N2C(=O)N(CC(=O)C(C)(C)C)c3ccccc3S2(=O)=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 M08 mock treatment 0.071 8.25E-5 0.02 0.071 0.00159 0.44 0.3273 0.7402 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 M09 compound treatment 0.07 -9.18E-4 -0.24 0.071 0.00159 0.44 0.1453 0.29 3125293 ChemDiv3_016626 CCOC(=O)CN1C(=O)N(c2ccccc2OC)S(=O)(=O)c3ccccc13 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 M10 mock treatment 0.067 -0.00392 -1.01 0.067 -0.00241 -0.67 -1.1886 -0.9806 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 M11 compound treatment 0.065 -0.00592 -1.52 0.068 -0.00141 -0.39 -1.3558 -0.8616 3043586 ChemDiv3_016627 Cc1ccc2OCC(=O)N(CCCC(=O)O)c2c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 M12 mock treatment 0.067 -0.00392 -1.01 0.069 -4.14E-4 -0.12 -0.7948 -0.7829 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 M13 compound treatment 0.076 0.00508 1.31 0.073 0.00359 1.0 1.6315 0.9911 3125294 ChemDiv3_016628 Cc1ccc(CNC(=O)CNc2ccccc2c3nc4ccccc4[nH]c3=O)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 M14 mock treatment 0.067 -0.00392 -1.01 0.067 -0.00241 -0.67 -1.1886 -0.9806 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 M15 compound treatment 0.067 -0.00392 -1.01 0.069 -4.14E-4 -0.12 -0.7948 -0.7829 3125295 ChemDiv3_016629 COc1ccc(CCNC(=O)C2N(CCC(C)C)C(=O)c3ccccc23)cc1OC 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 M16 mock treatment 0.067 -0.00392 -1.01 0.067 -0.00241 -0.67 -1.1886 -0.9806 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 M17 compound treatment 0.091 0.0201 5.17 0.074 0.00459 1.28 4.5593 0.856 3043589 ChemDiv3_016630 Fc1ccc(cc1)N2CCN(CC2)C(=O)C3CN(C4CCCC4)C(=O)C3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 M18 mock treatment 0.068 -0.00292 -0.75 0.07 5.86E-4 0.16 -0.4158 -0.5409 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 M19 compound treatment 0.07 -9.18E-4 -0.24 0.07 5.86E-4 0.16 -0.0517 -0.18 3125296 ChemDiv3_016631 CC(N1CC(CC1=O)C(=O)N2CCN(CC2)c3ccc(F)cc3)c4ccccc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 M20 mock treatment 0.069 -0.00192 -0.49 0.069 -4.14E-4 -0.12 -0.4307 -0.8494 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 M21 compound treatment 0.07 -9.18E-4 -0.24 0.07 5.86E-4 0.16 -0.0517 -0.18 3043590 ChemDiv3_016632 Cc1cccc(n1)N2CCN(CC2)C(=O)c3cccs3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 M22 mock treatment 0.068 -0.00292 -0.75 0.067 -0.00241 -0.67 -1.0066 -0.9985 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 M23 mock treatment 0.073 0.00208 0.54 0.072 0.00259 0.72 0.8884 0.9894 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 M24 positive control 0.078 0.00708 1.82 0.079 0.00959 2.67 3.1771 0.9827 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 N01 compound treatment 0.075 0.00408 1.05 0.073 0.00359 1.0 1.4494 0.9997 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 N02 compound treatment 0.14 0.0691 17.79 0.136 0.0666 18.54 25.6895 0.9998 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 N03 compound treatment 0.107 0.0361 9.29 0.104 0.0346 9.63 13.3799 0.9998 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 N04 compound treatment 0.076 0.00508 1.31 0.074 0.00459 1.28 1.8284 0.9999 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 N05 compound treatment 0.125 0.0541 13.92 0.127 0.0576 16.04 21.1863 0.9975 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 N06 compound treatment 0.085 0.0141 3.63 0.082 0.0126 3.51 5.0423 0.9999 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 N07 compound treatment 0.075 0.00408 1.05 0.078 0.00859 2.39 2.434 0.9319 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 N08 compound treatment 0.118 0.0471 12.12 0.115 0.0456 12.7 17.5488 0.9997 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 N09 compound treatment 0.141 0.0701 18.04 0.147 0.0776 21.61 28.0377 0.996 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 N10 compound treatment 0.069 -0.00192 -0.49 0.069 -4.14E-4 -0.12 -0.4307 -0.8494 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 N11 compound treatment 0.067 -0.00392 -1.01 0.069 -4.14E-4 -0.12 -0.7948 -0.7829 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 N12 compound treatment 0.072 0.00108 0.28 0.074 0.00459 1.28 1.1001 0.8416 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 N13 compound treatment 0.112 0.0411 10.58 0.112 0.0426 11.86 15.8656 0.9984 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 N14 compound treatment 0.069 -0.00192 -0.49 0.071 0.00159 0.44 -0.0368 -0.0556 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 N15 compound treatment 0.073 0.00208 0.54 0.068 -0.00141 -0.39 0.1007 0.1513 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 N16 compound treatment 0.068 -0.00292 -0.75 0.068 -0.00141 -0.39 -0.8096 -0.9546 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 N17 compound treatment 0.099 0.0281 7.23 0.111 0.0416 11.58 13.3019 0.9743 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 N18 compound treatment 0.078 0.00708 1.82 0.075 0.00559 1.56 2.3894 0.9969 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 N19 compound treatment 0.07 -9.18E-4 -0.24 0.072 0.00259 0.72 0.3422 0.4515 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 N20 compound treatment 0.103 0.0321 8.26 0.099 0.0296 8.24 11.6671 1.0 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 N21 compound treatment 0.084 0.0131 3.37 0.083 0.0136 3.78 5.0572 0.9983 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 N22 mock treatment 0.069 -0.00192 -0.49 0.07 5.86E-4 0.16 -0.2337 -0.4495 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 N23 mock treatment 0.071 8.25E-5 0.02 0.071 0.00159 0.44 0.3273 0.7402 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 N24 positive control 0.078 0.00708 1.82 0.078 0.00859 2.39 2.9802 0.9911 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 O01 compound treatment 0.078 0.00708 1.82 0.08 0.0106 2.95 3.374 0.9733 3125297 ChemDiv3_016633 Cc1oc(nc1COc2ccc(C)cc2)c3ccc(cc3)C(=O)NC4CCCC4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 O02 compound treatment 0.075 0.00408 1.05 0.072 0.00259 0.72 1.2525 0.983 3043592 ChemDiv3_016634 COC(=O)Cn1cc(cc1C(=O)OC)S(=O)(=O)N2CCCC2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 O03 compound treatment 0.092 0.0211 5.43 0.098 0.0286 7.96 9.4675 0.9826 3125298 ChemDiv3_016635 O=C1N(Cc2ccc(s2)S(=O)(=O)NCCc3ccccc3)C(=O)c4ncccc14 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 O04 mock treatment 0.07 -9.18E-4 -0.24 0.068 -0.00141 -0.39 -0.4455 -0.9701 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 O05 compound treatment 0.08 0.00908 2.34 0.078 0.00859 2.39 3.3443 0.9999 3125299 ChemDiv3_016636 COc1ccc(NC(=O)CCS(=O)(=O)c2cc3[nH]c(=O)c(=O)[nH]c3cc2C)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 O06 mock treatment 0.07 -9.18E-4 -0.24 0.071 0.00159 0.44 0.1453 0.29 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 O07 compound treatment 0.092 0.0211 5.43 0.101 0.0316 8.8 10.0583 0.9731 3043644 ChemDiv3_016637 CN1C(=O)N(c2ccc(C)cc2)S(=O)(=O)c3ccccc13 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 O08 mock treatment 0.074 0.00308 0.79 0.071 0.00159 0.44 0.8735 0.9617 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 O09 compound treatment 0.088 0.0171 4.4 0.087 0.0176 4.9 6.5731 0.9986 3125300 ChemDiv3_016638 Cc1nn2c(=O)c3ccc(cc3nc2s1)C(=O)NCc4ccc(F)cc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 O10 mock treatment 0.068 -0.00292 -0.75 0.067 -0.00241 -0.67 -1.0066 -0.9985 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 O11 compound treatment 0.129 0.0581 14.95 0.127 0.0576 16.04 21.9145 0.9994 3043646 ChemDiv3_016639 CCOC(=O)CN1C(=O)/C(=C/c2ccc(Cl)cc2)/Oc3ccc(cc13)C(C)(C)C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 O12 mock treatment 0.069 -0.00192 -0.49 0.069 -4.14E-4 -0.12 -0.4307 -0.8494 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 O13 compound treatment 0.071 8.25E-5 0.02 0.069 -4.14E-4 -0.12 -0.0665 -0.5674 3125301 ChemDiv3_016640 CC(C)N1C(CCC1=O)C(=O)N2CCN(C(C)C2)c3cccc(C)c3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 O14 mock treatment 0.067 -0.00392 -1.01 0.067 -0.00241 -0.67 -1.1886 -0.9806 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 O15 compound treatment 0.073 0.00208 0.54 0.07 5.86E-4 0.16 0.4945 0.8823 3125302 ChemDiv3_016641 CC1(CCC(=O)N1CCC2=CCCCC2)C(=O)NC3CCCCCC3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 O16 mock treatment 0.07 -9.18E-4 -0.24 0.068 -0.00141 -0.39 -0.4455 -0.9701 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 O17 compound treatment 0.077 0.00608 1.57 0.075 0.00559 1.56 2.2074 1.0 3043648 ChemDiv3_016642 O=C(NCc1ccccn1)C2CCC(=O)N2C3CCCC3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 O18 mock treatment 0.074 0.00308 0.79 0.071 0.00159 0.44 0.8735 0.9617 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 O19 compound treatment 0.071 8.25E-5 0.02 0.068 -0.00141 -0.39 -0.2635 -0.668 3125303 ChemDiv3_016643 COC(CNC(=O)C1CCC(=O)N1Cc2ccc(F)cc2)OC 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 O20 mock treatment 0.076 0.00508 1.31 0.07 5.86E-4 0.16 1.0407 0.7892 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 O21 compound treatment 0.074 0.00308 0.79 0.075 0.00559 1.56 1.6612 0.9512 3043650 ChemDiv3_016644 CN1C(=O)C(C)(C)c2cc(ccc12)S(=O)(=O)NCc3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 O22 mock treatment 0.068 -0.00292 -0.75 0.068 -0.00141 -0.39 -0.8096 -0.9546 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 O23 mock treatment 0.076 0.00508 1.31 0.073 0.00359 1.0 1.6315 0.9911 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 O24 positive control 0.076 0.00508 1.31 0.078 0.00859 2.39 2.6161 0.9598 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 P01 compound treatment 0.103 0.0321 8.26 0.101 0.0316 8.8 12.0609 0.9995 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 P02 compound treatment 0.076 0.00508 1.31 0.076 0.00659 1.83 2.2222 0.9863 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 P03 compound treatment 0.084 0.0131 3.37 0.081 0.0116 3.23 4.6633 0.9998 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 P04 compound treatment 0.096 0.0251 6.46 0.091 0.0216 6.01 8.8173 0.9994 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 P05 compound treatment 0.105 0.0341 8.78 0.107 0.0376 10.47 13.6066 0.9962 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 P06 compound treatment 0.082 0.0111 2.85 0.085 0.0156 4.34 5.0869 0.9793 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 P07 compound treatment 0.07 -9.18E-4 -0.24 0.071 0.00159 0.44 0.1453 0.29 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 P08 compound treatment 0.085 0.0141 3.63 0.086 0.0166 4.62 5.83 0.9928 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 P09 compound treatment 0.08 0.00908 2.34 0.079 0.00959 2.67 3.5412 0.9978 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 P10 compound treatment 0.083 0.0121 3.11 0.083 0.0136 3.78 4.8751 0.9953 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 P11 compound treatment 0.092 0.0211 5.43 0.096 0.0266 7.4 9.0737 0.9884 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 P12 compound treatment 0.141 0.0701 18.04 0.142 0.0726 20.21 27.0531 0.9984 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 P13 compound treatment 0.075 0.00408 1.05 0.078 0.00859 2.39 2.434 0.9319 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 P14 compound treatment 0.073 0.00208 0.54 0.076 0.00659 1.83 1.6761 0.8771 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 P15 compound treatment 0.075 0.00408 1.05 0.072 0.00259 0.72 1.2525 0.983 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 P16 compound treatment 0.078 0.00708 1.82 0.078 0.00859 2.39 2.9802 0.9911 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 P17 compound treatment 0.178 0.107 27.57 0.178 0.109 30.24 40.8785 0.9989 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 P18 compound treatment 0.076 0.00508 1.31 0.073 0.00359 1.0 1.6315 0.9911 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 P19 compound treatment 0.077 0.00608 1.57 0.074 0.00459 1.28 2.0104 0.9949 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 P20 compound treatment 0.075 0.00408 1.05 0.073 0.00359 1.0 1.4494 0.9997 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 P21 compound treatment 0.109 0.0381 9.81 0.108 0.0386 10.75 14.5318 0.999 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 P22 mock treatment 0.073 0.00208 0.54 0.07 5.86E-4 0.16 0.4945 0.8823 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 P23 mock treatment 0.072 0.00108 0.28 0.073 0.00359 1.0 0.9032 0.8712 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2048 P24 positive control 0.079 0.00808 2.08 0.079 0.00959 2.67 3.3592 0.9924 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 A01 compound treatment 0.083 0.0123 3.17 0.079 0.00519 1.44 3.2631 0.9367 1042961 Maybridge4_000001 Clc1ccc(cc1)N2CCNCC2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 A02 compound treatment 0.076 0.00531 1.37 0.078 0.00419 1.17 1.7918 0.9968 3062731 Maybridge4_000002 CC(=O)NS(=O)(=O)c1ccc(/N=C/c2ccco2)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 A03 compound treatment 0.167 0.0963 24.8 0.167 0.0932 25.95 35.8855 0.9997 3062732 Maybridge4_000003 FC(F)(F)Oc1ccc(NC(=O)Nc2ccc(cc2)C3=NCCO3)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 A04 compound treatment 0.085 0.0143 3.69 0.087 0.0132 3.67 5.2027 1.0 1175682 Maybridge4_000004 COc1cccc2cc(C#N)c(=N)oc12 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 A05 compound treatment 0.074 0.00331 0.85 0.076 0.00219 0.61 1.0338 0.9864 3062733 Maybridge4_000005 Cc1nc(ccc1C(=O)Sc2nnc(o2)c3ccc(nc3C)C(F)(F)F)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 A06 compound treatment 0.077 0.00631 1.63 0.079 0.00519 1.44 2.1708 0.9983 3062734 Maybridge4_000006 COc1cc(/N=C/c2cccs2)c(OC)cc1Cl 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 A07 compound treatment 0.074 0.00331 0.85 0.079 0.00519 1.44 1.6246 0.9684 3062735 Maybridge4_000007 OC1CCN(CC1)C(=O)Nc2ccc(OC(F)(F)F)cc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 A08 compound treatment 0.129 0.0583 15.01 0.135 0.0612 17.04 22.6656 0.998 1676427 Maybridge4_000008 Cc1ccccc1NC(=S)Nc2cc(NS(=O)(=O)C)ccc2C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 A09 compound treatment 0.074 0.00331 0.85 0.077 0.00319 0.89 1.2308 0.9998 3179439 Maybridge4_000009 Cc1nc(ccc1NC(=O)NCCNc2cccc(n2)C(F)(F)F)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 A10 compound treatment 0.073 0.00231 0.6 0.075 0.00119 0.33 0.6549 0.9615 3062736 Maybridge4_000010 Cc1ccc(NC(=S)Nc2cccc(c2)C(F)(F)F)cc1NS(=O)(=O)C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 A11 compound treatment 0.075 0.00431 1.11 0.077 0.00319 0.89 1.4128 0.9938 3179440 Maybridge4_000011 CC(C)(C)NC(=O)N1CCC(CC1)Nc2nccc(n2)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 A12 compound treatment 0.222 0.151 38.96 0.217 0.143 39.88 55.7449 0.9999 3062737 Maybridge4_000012 Fc1cccc(/N=C/c2ccc3OCOc3c2)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 A13 compound treatment 0.074 0.00331 0.85 0.078 0.00419 1.17 1.4277 0.9882 3179441 Maybridge4_000013 OC(=O)c1ccccc1C(=O)NC2CCN(CC2)c3nccc(n3)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 A14 compound treatment 0.177 0.106 27.37 0.157 0.0832 23.17 35.7368 0.9966 3062738 Maybridge4_000014 CCOC(=O)CCN1C(=O)c2ccccc2C1=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 A15 compound treatment 0.11 0.0393 10.12 0.112 0.0382 10.63 14.6772 0.9997 1678888 Maybridge4_000015 C(Cc1ccccc1)Nc2ncnc3scc(c4ccccc4)c23 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 A16 compound treatment 0.071 3.12E-4 0.08 0.073 -8.13E-4 -0.23 -0.1031 -0.4293 1222400 Maybridge4_000016 Oc1ccc(CCc2nnc(S)n2CCc3ccccc3)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 A17 compound treatment 0.073 0.00231 0.6 0.076 0.00219 0.61 0.8518 0.9999 3179442 Maybridge4_000017 OC(=O)/C=C/C(=O)N1CCN(CC1)c2ncnc3scc(c4ccccc4)c23 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 A18 compound treatment 0.074 0.00331 0.85 0.076 0.00219 0.61 1.0338 0.9864 3179443 Maybridge4_000018 CN(C(=O)CSc1ccc(Cl)cc1)c2ccccc2C(=O)NC3CCCCC3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 A19 compound treatment 0.076 0.00531 1.37 0.078 0.00419 1.17 1.7918 0.9968 1712315 Maybridge4_000019 COc1cccc(OC)c1C(=O)N2CCN(CC2)c3ncnc4scc(c5ccccc5)c34 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 A20 compound treatment 0.073 0.00231 0.6 0.077 0.00319 0.89 1.0487 0.9811 3179444 Maybridge4_000020 CC(C)(C)NC(=S)Nc1cc(cc(c1)C(F)(F)F)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 A21 compound treatment 0.073 0.00231 0.6 0.074 1.87E-4 0.05 0.4579 0.7662 3062739 Maybridge4_000021 NC(=O)C1CCN(CC1)c2nccc(n2)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 A22 compound treatment 0.072 0.00131 0.34 0.076 0.00219 0.61 0.6697 0.9613 1149418 Maybridge4_000022 CCCN(CCC)S(=O)(=O)c1ccc(cc1)C(=O)Oc2c(C)cccc2OC 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 A23 mock treatment 0.073 0.00231 0.6 0.076 0.00219 0.61 0.8518 0.9999 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 A24 positive control 0.076 0.00531 1.37 0.078 0.00419 1.17 1.7918 0.9968 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 B01 compound treatment 0.077 0.00631 1.63 0.078 0.00419 1.17 1.9739 0.9867 3062740 Maybridge4_000023 CCSC1=NCN(Cc2cccs2)CN1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 B02 compound treatment 0.095 0.0243 6.26 0.092 0.0182 5.07 8.0079 0.9945 3179445 Maybridge4_000024 Cc1ccc(CNC(=O)c2cccnc2Sc3cccc(c3)C(F)(F)F)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 B03 compound treatment 0.138 0.0673 17.33 0.131 0.0572 15.93 23.5165 0.9991 3062741 Maybridge4_000025 CN(/N=C/c1cc(Cl)cc(Cl)c1O)C(=S)NC(C)(C)C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 B04 compound treatment 0.074 0.00331 0.85 0.078 0.00419 1.17 1.4277 0.9882 3179446 Maybridge4_000026 CC(C)(C)c1ccc(cc1)c2nnc(o2)c3ccccc3NC(=O)/C=C\C(=O)O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 B05 compound treatment 0.125 0.0543 13.98 0.129 0.0552 15.37 20.7559 0.9989 3062742 Maybridge4_000027 Cc1c(C)c(C)c(CS(=O)(=O)CC(=O)Nc2ccc(F)c(Cl)c2)c(C)c1C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 B06 compound treatment 0.075 0.00431 1.11 0.077 0.00319 0.89 1.4128 0.9938 1435448 Maybridge4_000028 Cc1onc(c1NC(=O)Oc2ccc(CC#N)cc2)c3c(Cl)cccc3Cl 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 B07 compound treatment 0.074 0.00331 0.85 0.078 0.00419 1.17 1.4277 0.9882 1192420 Maybridge4_000029 S=C(NCCc1ccccn1)Nc2ccccc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 B08 compound treatment 0.15 0.0793 20.42 0.157 0.0832 23.17 30.8212 0.998 1239033 Maybridge4_000030 CSc1nnc(SC)n1CCNC(=O)Nc2cccc(Cl)c2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 B09 compound treatment 0.241 0.17 43.85 0.223 0.149 41.55 60.3856 0.9996 3179447 Maybridge4_000031 Fc1c(Br)cc(Br)c2nc(oc(=O)c12)c3cccs3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 B10 compound treatment 0.152 0.0813 20.94 0.154 0.0802 22.33 30.5946 0.9995 3062743 Maybridge4_000032 Fc1ccc(Oc2ccc(NC(=O)/C=C/c3ccccc3)cn2)c(F)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 B11 compound treatment 0.091 0.0203 5.23 0.094 0.0202 5.62 7.6735 0.9993 3179448 Maybridge4_000033 FC(F)(F)c1ccc2[nH]c(SCc3ccc(Br)cc3)nc2c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 B12 compound treatment 0.074 0.00331 0.85 0.077 0.00319 0.89 1.2308 0.9998 1161087 Maybridge4_000034 Fc1ccc(cc1)n2nc3NCCCn3c2=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 B13 compound treatment 0.116 0.0453 11.67 0.118 0.0442 12.31 16.9512 0.9996 3062744 Maybridge4_000035 FC(F)(F)c1cccc(c1)C(=O)On2c(nc3ccccc3c2=O)c4ccccc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 B14 compound treatment 0.073 0.00231 0.6 0.078 0.00419 1.17 1.2456 0.9513 1279124 Maybridge4_000036 CCCCn1c(CSc2ccccn2)cn(c3nnc(s3)C(C)(C)C)c1=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 B15 compound treatment 0.081 0.0103 2.66 0.082 0.00819 2.28 3.4898 0.9971 1108923 Maybridge4_000037 CSC1=NC=C(C#N)C2=NC(NN21)c3ccc(Cl)cc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 B16 compound treatment 0.078 0.00731 1.88 0.08 0.00619 1.72 2.5498 0.999 1163777 Maybridge4_000038 CC(C)(C)c1cc(cc(c1)C(=O)Oc2cncc(Cl)c2)C(=O)Oc3cncc(Cl)c3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 B17 compound treatment 0.074 0.00331 0.85 0.075 0.00119 0.33 0.8369 0.9149 1150645 Maybridge4_000039 Cc1cc(NS(=O)(=O)c2ccc(F)c(Cl)c2)no1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 B18 compound treatment 0.139 0.0683 17.59 0.144 0.0702 19.55 26.2585 0.9986 3179449 Maybridge4_000040 CSc1ncccc1C2=N/C(=C\N(C)C)/C(=O)O2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 B19 compound treatment 0.073 0.00231 0.6 0.072 -0.00181 -0.5 0.0641 0.0821 3062745 Maybridge4_000041 CN(C)/C=N/c1nnc(SCC(=O)c2ccc(F)cc2)s1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 B20 compound treatment 0.076 0.00531 1.37 0.077 0.00319 0.89 1.5949 0.9781 3179558 Maybridge4_000042 COC(=O)/C(=C/1\NC(=NC(=C1C#N)SC)C)/C#N 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 B21 compound treatment 0.071 3.12E-4 0.08 0.075 0.00119 0.33 0.2907 0.8542 3179559 Maybridge4_000043 CN(C)/C=N/c1nnc(Sc2cc(C)nc3ccccc23)s1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 B22 compound treatment 0.111 0.0403 10.38 0.112 0.0382 10.63 14.8593 0.9999 3062746 Maybridge4_000044 CCOC(=O)c1c(C)c(C#N)c(/N=C/N(C)C)n1c2ccc(Cl)cc2Cl 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 B23 mock treatment 0.07 -6.87E-4 -0.18 0.074 1.87E-4 0.05 -0.0882 -0.4781 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 B24 positive control 0.075 0.00431 1.11 0.076 0.00219 0.61 1.2159 0.9601 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 C01 compound treatment 0.081 0.0103 2.66 0.079 0.00519 1.44 2.899 0.9591 1040601 Maybridge4_000045 COc1cccc(c1)N2CCNCC2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 C02 compound treatment 0.083 0.0123 3.17 0.087 0.0132 3.67 4.8385 0.9973 3062747 Maybridge4_000046 COc1cc(/C=N/N)cc(OC)c1OC 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 C03 compound treatment 0.071 3.12E-4 0.08 0.073 -8.13E-4 -0.23 -0.1031 -0.4293 3179560 Maybridge4_000047 FC(F)(F)c1cccnc1N2CCNC2=S 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 C04 compound treatment 0.079 0.00831 2.14 0.081 0.00719 2.0 2.9288 0.9994 1723231 Maybridge4_000048 Clc1c(sc2ccccc12)C(=O)N(Cc3ccccc3)C(C#N)c4ccc5OCOc5c4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 C05 compound treatment 0.15 0.0793 20.42 0.151 0.0772 21.5 29.6397 0.9997 3062748 Maybridge4_000049 Cc1ccc(NC(=S)N2CCCN(CC2)c3ncc(cc3Cl)C(F)(F)F)c(C)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 C06 compound treatment 0.073 0.00231 0.6 0.074 1.87E-4 0.05 0.4579 0.7662 1322626 Maybridge4_000050 Fc1ccc(cc1)N(Cc2ccc3OCOc3c2)S(=O)(=O)c4ccc(F)cc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 C07 compound treatment 0.086 0.0153 3.94 0.087 0.0132 3.67 5.3847 0.9994 1288233 Maybridge4_000051 CCOC(=O)c1cc(C(=O)OC)c(C)nc1N2CCCN(Cc3ccc(F)cc3)CC2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 C08 compound treatment 0.084 0.0133 3.43 0.091 0.0172 4.79 5.8083 0.9866 3179561 Maybridge4_000052 CCOC(=O)/C(=C(/C)\N)/C1CC(=O)N(C1=O)c2ccc(cc2)C(=O)OCC 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 C09 compound treatment 0.131 0.0603 15.53 0.138 0.0642 17.88 23.6205 0.9975 1354107 Maybridge4_000053 OC(COc1ccc(Br)cc1)CN2CCCN(CC2)c3nc4ccc(Cl)cc4s3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 C10 compound treatment 0.082 0.0113 2.91 0.084 0.0102 2.84 4.0657 0.9999 1692586 Maybridge4_000054 Cc1ccc(cc1)S(=O)(=O)N(c2nc3ccccc3s2)c4cccc(Cl)c4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 C11 compound treatment 0.069 -0.00169 -0.43 0.071 -0.00281 -0.78 -0.8611 -0.9613 1369581 Maybridge4_000055 CC(C)(C)OC(=O)N1CCCN(CC1)C(=O)Nc2ccc(F)cc2F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 C12 compound treatment 0.076 0.00531 1.37 0.078 0.00419 1.17 1.7918 0.9968 1212228 Maybridge4_000056 Cc1ccc(c(NC(=O)C(C2CCCC2)c3ccccc3)c1)n4cccc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 C13 compound treatment 0.069 -0.00169 -0.43 0.074 1.87E-4 0.05 -0.2703 -0.6177 3179562 Maybridge4_000057 Cc1nc(ccc1C(=O)NCC2CC2)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 C14 compound treatment 0.081 0.0103 2.66 0.078 0.00419 1.17 2.7021 0.9318 1629863 Maybridge4_000058 Oc1c(Cl)cc(Cl)cc1C2Nc3cccc4cccc(N2)c34 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 C15 compound treatment 0.076 0.00531 1.37 0.074 1.87E-4 0.05 1.0041 0.7336 3062749 Maybridge4_000059 CCCNC(=O)NC1CCN(CC1)c2ncc(cc2Cl)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 C16 compound treatment 0.085 0.0143 3.69 0.087 0.0132 3.67 5.2027 1.0 1569566 Maybridge4_000060 CC(c1ccccc1)n2c(S)nnc2CCc3ccc(O)cc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 C17 compound treatment 0.073 0.00231 0.6 0.075 0.00119 0.33 0.6549 0.9615 1204274 Maybridge4_000061 Fc1cccc(Cl)c1CN2CCN(CCCN3C(=O)c4ccccc4C3=O)CC2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 C18 compound treatment 0.076 0.00531 1.37 0.077 0.00319 0.89 1.5949 0.9781 1455358 Maybridge4_000062 O=C(Nc1nccc2ccccc12)c3cccs3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 C19 compound treatment 0.137 0.0663 17.07 0.132 0.0582 16.2 23.5313 0.9997 3179563 Maybridge4_000063 COc1cccc(CC(=O)NC2CCN(CC2)c3ncc(cc3Cl)C(F)(F)F)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 C20 compound treatment 0.148 0.0773 19.91 0.144 0.0702 19.55 27.8971 1.0 3062750 Maybridge4_000064 CC(C)(C)NC(=S)Nc1ccccc1C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 C21 compound treatment 0.072 0.00131 0.34 0.075 0.00119 0.33 0.4728 0.9999 1137780 Maybridge4_000065 CC(C)(C)OC(=O)N1CCN(CC1)C(=O)c2ccc(Oc3cccnc3)o2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 C22 compound treatment 0.09 0.0193 4.97 0.093 0.0192 5.34 7.2945 0.9994 3179564 Maybridge4_000066 FC(F)(F)c1cc(NCC(=O)c2cc3cc(Cl)ccc3o2)cc(c1)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 C23 mock treatment 0.07 -6.87E-4 -0.18 0.072 -0.00181 -0.5 -0.4821 -0.9013 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 C24 positive control 0.076 0.00531 1.37 0.079 0.00519 1.44 1.9887 0.9996 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 D01 compound treatment 0.1 0.0293 7.55 0.099 0.0252 7.01 10.2966 0.9993 3179565 Maybridge4_000067 Cc1nn(nc1C(=O)Oc2c(Cl)cccc2Cl)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 D02 compound treatment 0.083 0.0123 3.17 0.084 0.0102 2.84 4.2478 0.9985 3062751 Maybridge4_000068 COc1cc(cc(Br)c1OC(=O)NC(=O)c2c(F)cccc2F)C3SCCS3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 D03 compound treatment 0.086 0.0153 3.94 0.086 0.0122 3.39 5.1878 0.9972 1545199 Maybridge4_000069 CCOC(=O)c1cnc2cc(Cl)c(F)cc2c1N3CC(C)OC(C)C3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 D04 compound treatment 0.075 0.00431 1.11 0.074 1.87E-4 0.05 0.8221 0.7395 1652603 Maybridge4_000070 CC(C)(C)c1ccc(cc1)c2nnc(o2)c3ccccc3NC(=O)CCC(=O)O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 D05 compound treatment 0.074 0.00331 0.85 0.075 0.00119 0.33 0.8369 0.9149 1338281 Maybridge4_000071 Clc1ccccc1C(=O)NC(=O)NC2CC2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 D06 compound treatment 0.073 0.00231 0.6 0.075 0.00119 0.33 0.6549 0.9615 1457562 Maybridge4_000072 OC(=O)C(CCC(=O)Nc1ccc2OCOCc2c1)N3C(=O)c4ccccc4C3=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 D07 compound treatment 0.074 0.00331 0.85 0.078 0.00419 1.17 1.4277 0.9882 3062752 Maybridge4_000073 CC1CN(CC(C)O1)C2=NCCN2S(=O)(=O)c3cc(cc(c3)C(F)(F)F)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 D08 compound treatment 0.105 0.0343 8.83 0.108 0.0342 9.52 12.9793 0.9993 3179566 Maybridge4_000074 Cc1nn(nc1C(=O)c2c(O)n(nc2C(C)(C)C)c3ccccc3)c4ccccc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 D09 compound treatment 0.07 -6.87E-4 -0.18 0.077 0.00319 0.89 0.5025 0.5552 3062753 Maybridge4_000075 Cc1cc(Br)c(c(Br)c1Cl)n2cccc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 D10 compound treatment 0.11 0.0393 10.12 0.111 0.0372 10.36 14.4803 0.9999 3179567 Maybridge4_000076 Fc1ccc(Oc2ncccc2NC(=O)/C=C/c3ccccc3)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 D11 compound treatment 0.083 0.0123 3.17 0.084 0.0102 2.84 4.2478 0.9985 3062754 Maybridge4_000077 CC(C)(C)c1cs/c(=N/c2ccccn2)/n1c3ccc(Cl)cc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 D12 compound treatment 0.073 0.00231 0.6 0.075 0.00119 0.33 0.6549 0.9615 1415138 Maybridge4_000078 CN1C(C(=O)N(C1=O)c2nnc(s2)C(C)(C)C)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 D13 compound treatment 0.068 -0.00269 -0.69 0.074 1.87E-4 0.05 -0.4524 -0.6519 3063175 Maybridge4_000079 CC(C)(C)c1csc(Cc2ccccc2Cl)n1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 D14 compound treatment 0.092 0.0213 5.49 0.09 0.0162 4.51 7.0678 0.9952 3179568 Maybridge4_000080 Fc1ccc(NC(=O)CSc2nnc(NC(=O)c3ccc(Cl)c(Cl)c3)s2)c(F)c1F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 D15 compound treatment 0.086 0.0153 3.94 0.087 0.0132 3.67 5.3847 0.9994 1691601 Maybridge4_000081 CS(=O)(=O)Nc1ccc2oc3ncccc3c(=O)c2c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 D16 compound treatment 0.166 0.0953 24.54 0.168 0.0942 26.23 35.9003 0.9994 1489888 Maybridge4_000082 CC(C)(C)c1cc(cc(c1)C(=O)NCc2cccs2)C(=O)NCc3cccs3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 D17 compound treatment 0.081 0.0103 2.66 0.087 0.0132 3.67 4.4744 0.9873 3063176 Maybridge4_000083 Clc1ccc(cc1Cl)C(=O)c2nn3c(nc(=O)c4ccccc43)s2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 D18 compound treatment 0.201 0.13 33.55 0.198 0.124 34.59 48.1801 0.9999 3179569 Maybridge4_000084 CN(C)/C=C/1\N=C(OC1=O)c2cccnc2Oc3ccc(Cl)cc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 D19 compound treatment 0.073 0.00231 0.6 0.072 -0.00181 -0.5 0.0641 0.0821 1342823 Maybridge4_000085 Fc1ccc(c(F)c1)S(=O)(=O)Nc2ccccc2C(=O)NCC3CC3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 D20 compound treatment 0.265 0.194 50.03 0.253 0.179 49.9 70.6627 1.0 3063177 Maybridge4_000086 CC(C)(C(=O)Nc1cccc(Cl)c1)S(=O)(=O)c2ccc(cn2)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 D21 compound treatment 0.07 -6.87E-4 -0.18 0.071 -0.00281 -0.78 -0.679 -0.8456 3063178 Maybridge4_000087 CC1=NN(C(=O)CC1)c2cc(Cl)cc(Cl)c2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 D22 compound treatment 0.071 3.12E-4 0.08 0.072 -0.00181 -0.5 -0.3 -0.587 1609394 Maybridge4_000088 CCOC(=O)c1c(C)c(C#N)c(N(C(=O)C)C(=O)C)n1c2ccc(C)cc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 D23 mock treatment 0.069 -0.00169 -0.43 0.071 -0.00281 -0.78 -0.8611 -0.9613 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 D24 positive control 0.076 0.00531 1.37 0.079 0.00519 1.44 1.9887 0.9996 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 E01 compound treatment 0.076 0.00531 1.37 0.075 0.00119 0.33 1.201 0.8535 1042964 Maybridge4_000089 Cc1cccc(c1)N2CCNCC2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 E02 compound treatment 0.105 0.0343 8.83 0.099 0.0252 7.01 11.2069 0.9935 1679137 Maybridge4_000090 NNC(=O)C1CCCNC1=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 E03 compound treatment 0.081 0.0103 2.66 0.08 0.00619 1.72 3.096 0.9781 1296373 Maybridge4_000091 CC(C)(C)OC(=O)N1CCCN(CC1)S(=O)(=O)c2cc(Cl)ccc2Cl 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 E04 compound treatment 0.072 0.00131 0.34 0.072 -0.00181 -0.5 -0.118 -0.1942 1584716 Maybridge4_000092 COc1cc(cc(OC)c1OC)C(=O)NC(=S)NC(=O)N 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 E05 compound treatment 0.072 0.00131 0.34 0.073 -8.13E-4 -0.23 0.079 0.1941 3063179 Maybridge4_000093 CSc1nnc(o1)c2ccc(nc2C)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 E06 compound treatment 0.193 0.122 31.49 0.201 0.127 35.42 47.3144 0.9983 3179570 Maybridge4_000094 Cc1onc(c1C(=O)NC(=S)Nc2ccc(Cl)cc2)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 E07 compound treatment 0.072 0.00131 0.34 0.075 0.00119 0.33 0.4728 0.9999 1200576 Maybridge4_000095 CCOC(=O)c1cc(C(=O)OC)c(C)nc1SCC(=O)OC 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 E08 compound treatment 0.144 0.0733 18.88 0.149 0.0752 20.94 28.1535 0.9987 1402318 Maybridge4_000096 CCOC(=O)C1=C(C)NC(=O)C1CC(=O)Nc2ccc(cc2)C(=O)OCC 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 E09 compound treatment 0.108 0.0373 9.61 0.105 0.0312 8.69 12.9347 0.9987 1736057 Maybridge4_000097 CCOC(=O)c1cc(C#N)c(C)nc1N2CCN(CC2)S(=O)(=O)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 E10 compound treatment 0.068 -0.00269 -0.69 0.071 -0.00281 -0.78 -1.0431 -0.9981 1619754 Maybridge4_000098 CC(=O)Nc1ccc(C)c(NC(=S)Nc2ccc(Cl)c(Cl)c2)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 E11 compound treatment 0.073 0.00231 0.6 0.071 -0.00281 -0.78 -0.1328 -0.135 1175297 Maybridge4_000099 O=C1CC2(CCCC2)C(=O)N1CCc3cccs3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 E12 compound treatment 0.098 0.0273 7.03 0.1 0.0262 7.29 10.1294 0.9998 3179665 Maybridge4_000100 COc1cc(NC(=O)C(C2CCCC2)c3ccccc3)cc(c1)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 E13 compound treatment 0.139 0.0683 17.59 0.145 0.0712 19.83 26.4555 0.9982 1528875 Maybridge4_000101 COc1ccccc1C2CCN(CC2)S(=O)(=O)c3ccc(s3)c4csc(C)n4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 E14 compound treatment 0.074 0.00331 0.85 0.071 -0.00281 -0.78 0.0492 0.0425 1511104 Maybridge4_000102 CN(C)c1ccc(cc1)C2N(Cc3ccccc3)CCC4CCCCN24 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 E15 compound treatment 0.088 0.0173 4.46 0.09 0.0162 4.51 6.3396 1.0 3063180 Maybridge4_000103 FC(F)(F)Oc1ccc(NC(=O)NC2CCN(CC2)c3nccc(n3)C(F)(F)F)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 E16 compound treatment 0.089 0.0183 4.71 0.089 0.0152 4.23 6.3247 0.9985 3179666 Maybridge4_000104 C/C(=N\C(=O)NN)/c1cnn(c1C)c2ccccc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 E17 compound treatment 0.075 0.00431 1.11 0.078 0.00419 1.17 1.6098 0.9997 3179667 Maybridge4_000105 C(CNc1ncnc2scc(c3ccccc3)c12)Cn4ccnc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 E18 compound treatment 0.132 0.0613 15.79 0.132 0.0582 16.2 22.621 0.9999 1369305 Maybridge4_000106 CCN1CCCC1CN2CNC(=S)NC2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 E19 compound treatment 0.073 0.00231 0.6 0.074 1.87E-4 0.05 0.4579 0.7662 3179668 Maybridge4_000107 FC(F)(F)c1ccnc(n1)N2CCN(CCCN3C(=O)c4ccccc4C3=O)CC2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 E20 compound treatment 0.105 0.0343 8.83 0.105 0.0312 8.69 12.3885 1.0 3063181 Maybridge4_000108 CSc1cccc(NC(=S)NC(C)(C)C)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 E21 compound treatment 0.092 0.0213 5.49 0.095 0.0212 5.9 8.0525 0.9993 1338166 Maybridge4_000109 Cc1cnc(N2CCN(CC2)NC(=S)Nc3cccnc3)c(Cl)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 E22 compound treatment 0.147 0.0763 19.65 0.149 0.0752 20.94 28.6996 0.9995 1138152 Maybridge4_000110 COc1ccc(NC(=S)NC(C)(C)C)cc1OC 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 E23 mock treatment 0.07 -6.87E-4 -0.18 0.071 -0.00281 -0.78 -0.679 -0.8456 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 E24 positive control 0.076 0.00531 1.37 0.082 0.00819 2.28 2.5795 0.9701 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 F01 compound treatment 0.073 0.00231 0.6 0.076 0.00219 0.61 0.8518 0.9999 1442676 Maybridge4_000111 Fc1cccc(Cl)c1C(=O)NC(=O)N2CCSC2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 F02 compound treatment 0.103 0.0323 8.32 0.099 0.0252 7.01 10.8428 0.9964 3179669 Maybridge4_000112 CN(C)/C(=N/c1nnc(Sc2nc3cc(Cl)ccc3s2)s1)/C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 F03 compound treatment 0.121 0.0503 12.95 0.112 0.0382 10.63 16.6799 0.9952 3179670 Maybridge4_000113 Fc1ccc(NC(=O)NCSCc2cccc(c2)C(F)(F)F)cc1Cl 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 F04 compound treatment 0.13 0.0593 15.27 0.125 0.0512 14.26 20.8784 0.9994 1189445 Maybridge4_000114 COc1cccc(c1)c2nnc(o2)c3ccccc3NS(=O)(=O)c4ccc(Cl)cc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 F05 compound treatment 0.073 0.00231 0.6 0.077 0.00319 0.89 1.0487 0.9811 3179671 Maybridge4_000115 FC(F)(F)c1cccc(c1)C(=O)NC2CC2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 F06 compound treatment 0.097 0.0263 6.77 0.103 0.0292 8.13 10.5382 0.9959 1529642 Maybridge4_000116 Cc1cc2ncc(nc2cc1C)c3ccn(c3)S(=O)(=O)c4ccc(Cl)cc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 F07 compound treatment 0.073 0.00231 0.6 0.078 0.00419 1.17 1.2456 0.9513 1440337 Maybridge4_000117 Clc1cccc(Cl)c1C(=O)NC2CCS(=O)(=O)C2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 F08 compound treatment 0.074 0.00331 0.85 0.077 0.00319 0.89 1.2308 0.9998 1688196 Maybridge4_000118 COc1ccc(Cl)c(OC)c1C(=O)NC(=O)Nc2c(C)cccc2C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 F09 compound treatment 0.145 0.0743 19.13 0.132 0.0582 16.2 24.9878 0.9966 3063182 Maybridge4_000119 COC(=O)/C=C/1\S/C(=N\c2ccc(C)c(C)c2)/N(C1=O)c3ccc(C)c(C)c3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 F10 compound treatment 0.07 -6.87E-4 -0.18 0.071 -0.00281 -0.78 -0.679 -0.8456 3179672 Maybridge4_000120 NNC(=O)CS(=O)(=O)c1ccc(cn1)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 F11 compound treatment 0.076 0.00531 1.37 0.075 0.00119 0.33 1.201 0.8535 3179673 Maybridge4_000121 Cc1ncc(CSc2nc3cc(ccc3[nH]2)C(F)(F)F)c(CO)c1O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 F12 compound treatment 0.119 0.0483 12.44 0.127 0.0532 14.81 19.2697 0.9962 1621608 Maybridge4_000122 Cc1cc(cc(C)c1O)c2nn(C)c(=O)c3ccccc23 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 F13 compound treatment 0.081 0.0103 2.66 0.087 0.0132 3.67 4.4744 0.9873 1331054 Maybridge4_000123 CC(C)c1cccc(C(C)C)c1OC(=O)NC(=O)c2c(F)cccc2F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 F14 compound treatment 0.104 0.0333 8.58 0.109 0.0352 9.8 12.9941 0.9978 3063183 Maybridge4_000124 FC(F)(F)c1nnc(NC(=O)Nc2ccccc2)s1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 F15 compound treatment 0.094 0.0233 6.0 0.095 0.0212 5.9 8.4166 1.0 3179674 Maybridge4_000125 COc1cc2c(=O)oc(nc2c(OC)c1OC)c3c(C)onc3c4c(F)cccc4Cl 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 F16 compound treatment 0.129 0.0583 15.01 0.124 0.0502 13.98 20.4995 0.9994 3063184 Maybridge4_000126 Brc1ccc(s1)c2cnc3ccccc3n2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 F17 compound treatment 0.172 0.101 26.08 0.159 0.0852 23.72 35.2204 0.9989 1216365 Maybridge4_000127 Clc1ccc(Oc2nc(Oc3ccc(Cl)cc3)nc(n2)N4CCSCC4)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 F18 compound treatment 0.073 0.00231 0.6 0.074 1.87E-4 0.05 0.4579 0.7662 1464435 Maybridge4_000128 CC(C)(C)c1ccc(Oc2ncccc2C(=O)O)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 F19 compound treatment 0.07 -6.87E-4 -0.18 0.075 0.00119 0.33 0.1087 0.2897 1281583 Maybridge4_000129 Cc1nn(nc1C(=O)NC(=O)N2CCSCC2)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 F20 compound treatment 0.069 -0.00169 -0.43 0.07 -0.00381 -1.06 -1.058 -0.9222 3063185 Maybridge4_000130 CC(C)(C(=O)Oc1ccccc1)S(=O)(=O)c2ccc(cn2)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 F21 compound treatment 0.115 0.0443 11.41 0.114 0.0402 11.19 15.9814 1.0 3179675 Maybridge4_000131 CC(C)(C)SCCNc1nc(Sc2ccc(Cl)cc2)nc(n1)N3CCSCC3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 F22 compound treatment 0.074 0.00331 0.85 0.075 0.00119 0.33 0.8369 0.9149 3063186 Maybridge4_000132 CSc1nn(C)c2cnn(C)c(=O)c12 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 F23 mock treatment 0.069 -0.00169 -0.43 0.073 -8.13E-4 -0.23 -0.4672 -0.9538 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 F24 positive control 0.076 0.00531 1.37 0.082 0.00819 2.28 2.5795 0.9701 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 G01 compound treatment 0.08 0.00931 2.4 0.079 0.00519 1.44 2.717 0.9706 3063187 Maybridge4_000133 Cc1ccccc1N2CCNCC2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 G02 compound treatment 0.076 0.00531 1.37 0.078 0.00419 1.17 1.7918 0.9968 3179676 Maybridge4_000134 c1ccc(nc1)c2nnc([nH]2)c3cccnc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 G03 compound treatment 0.115 0.0443 11.41 0.116 0.0422 11.75 16.3752 0.9999 1229940 Maybridge4_000135 OC(CNCc1ccc(Cl)cc1Cl)Cn2c(cc3ccccc23)c4ccc(F)cc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 G04 compound treatment 0.145 0.0743 19.13 0.144 0.0702 19.55 27.3509 0.9999 3063224 Maybridge4_000136 NC(=O)NC(=S)NC(=O)c1ccccc1Cl 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 G05 compound treatment 0.076 0.00531 1.37 0.078 0.00419 1.17 1.7918 0.9968 3063225 Maybridge4_000137 FC(F)(F)c1cccc(NC(=S)NCCNc2nccc(n2)C(F)(F)F)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 G06 compound treatment 0.093 0.0223 5.74 0.099 0.0252 7.01 9.0222 0.9951 1407734 Maybridge4_000138 Cc1cccc(C)c1NC(=S)N2CCCc3cccc(C)c23 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 G07 compound treatment 0.072 0.00131 0.34 0.076 0.00219 0.61 0.6697 0.9613 3063226 Maybridge4_000139 Cc1nc(ccc1C(=O)O)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 G08 compound treatment 0.117 0.0463 11.92 0.124 0.0502 13.98 18.3148 0.9969 3063227 Maybridge4_000140 CC(C)N(Cc1ccc(cc1)N(C)C)S(=O)(=O)c2cccc(c2)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 G09 compound treatment 0.071 3.12E-4 0.08 0.074 1.87E-4 0.05 0.0938 0.9781 1525364 Maybridge4_000141 COc1ccccc1NC(=O)N2CCCN(Cc3ccc(F)cc3)CC2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 G10 compound treatment 0.101 0.0303 7.8 0.108 0.0342 9.52 12.251 0.9951 3179677 Maybridge4_000142 Cc1cccc2c(=O)n(CCNCc3ccccc3)c(C)nc12 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 G11 compound treatment 0.126 0.0553 14.24 0.15 0.0762 21.22 25.0733 0.9812 1397176 Maybridge4_000143 Cc1cc(c(C)cc1Cl)S(=O)(=O)N2CCCN(CC2)c3nc4ccc(Cl)cc4s3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 G12 compound treatment 0.073 0.00231 0.6 0.075 0.00119 0.33 0.6549 0.9615 1223333 Maybridge4_000144 COc1cc2CCN=C(c3c(C)onc3c4ccccc4)c2cc1OC 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 G13 compound treatment 0.108 0.0373 9.61 0.113 0.0392 10.91 14.5101 0.998 3179678 Maybridge4_000145 Clc1ccc(cc1)S(=O)(=O)NCCNc2ncnc3scc(c4ccccc4)c23 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 G14 compound treatment 0.123 0.0523 13.47 0.122 0.0482 13.42 19.0133 1.0 3063228 Maybridge4_000146 FC(F)(F)c1cc(NC(=O)CSC(=O)c2ccco2)cc(c1)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 G15 compound treatment 0.072 0.00131 0.34 0.073 -8.13E-4 -0.23 0.079 0.1941 1479980 Maybridge4_000147 COc1cccc(OC)c1C(=O)N2CCCN(CC2)c3nc4ccc(Cl)cc4s3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 G16 compound treatment 0.19 0.119 30.72 0.19 0.116 32.36 44.6021 0.9997 3063229 Maybridge4_000148 FC(F)(F)c1cccc(c1)N2CCNC2=S 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 G17 compound treatment 0.107 0.0363 9.35 0.109 0.0352 9.8 13.5403 0.9997 1615569 Maybridge4_000149 Ic1ccc(cc1)N2C(=O)CC3(CCCC3)C2=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 G18 compound treatment 0.2 0.129 33.29 0.202 0.128 35.7 48.7858 0.9994 3063230 Maybridge4_000150 FC(F)(F)c1cc(Br)ccc1/N=C/c2ccccc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 G19 compound treatment 0.074 0.00331 0.85 0.075 0.00119 0.33 0.8369 0.9149 3179679 Maybridge4_000151 Fc1cccc(Cl)c1CN2CCN(CCCNC(=O)c3cccc(c3)C(F)(F)F)CC2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 G20 compound treatment 0.16 0.0893 23.0 0.153 0.0792 22.05 31.8541 0.9998 3063231 Maybridge4_000152 Cc1ccc(NC(=S)NC(C)(C)C)c(C)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 G21 compound treatment 0.315 0.244 62.9 0.316 0.242 67.45 92.1719 0.9994 3179680 Maybridge4_000153 CSc1cccc(NC(=O)/C=C/c2ccc(cc2)C(C)C)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 G22 compound treatment 0.251 0.18 46.43 0.238 0.164 45.73 65.1601 1.0 3063232 Maybridge4_000154 S=C1NCN(Cc2cccs2)CN1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 G23 mock treatment 0.071 3.12E-4 0.08 0.072 -0.00181 -0.5 -0.3 -0.587 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 G24 positive control 0.079 0.00831 2.14 0.083 0.00919 2.56 3.3226 0.9961 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 H01 compound treatment 0.085 0.0143 3.69 0.082 0.00819 2.28 4.218 0.9734 3179681 Maybridge4_000155 Cc1ccc(SCc2ccccc2c3nc4ccccc4[nH]3)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 H02 compound treatment 0.108 0.0373 9.61 0.107 0.0332 9.24 13.3285 0.9998 3063233 Maybridge4_000156 CN(C)/C=N/c1nnc(SCC(=O)Nc2cc(Cl)cc(Cl)c2)s1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 H03 compound treatment 0.066 -0.00469 -1.21 0.067 -0.00681 -1.9 -2.195 -0.9762 3179769 Maybridge4_000157 CCC(C)n1c(=O)[nH][nH]c1=S 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 H04 compound treatment 0.07 -6.87E-4 -0.18 0.075 0.00119 0.33 0.1087 0.2897 1039773 Maybridge4_000158 Cc1ccc(=O)n(Cc2ccccc2)n1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 H05 compound treatment 0.073 0.00231 0.6 0.074 1.87E-4 0.05 0.4579 0.7662 3179770 Maybridge4_000159 Fc1cccc(CSC2=NCN(CN2)C3CC3)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 H06 compound treatment 0.086 0.0153 3.94 0.092 0.0182 5.07 6.3693 0.9923 3063234 Maybridge4_000160 FC(F)(F)c1cc(COc2ccc(CC#N)cc2)cc(c1)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 H07 compound treatment 0.073 0.00231 0.6 0.077 0.00319 0.89 1.0487 0.9811 1661120 Maybridge4_000161 COc1ccc(OC)c(c1)S(=O)(=O)NC2CCS(=O)(=O)C2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 H08 compound treatment 0.072 0.00131 0.34 0.075 0.00119 0.33 0.4728 0.9999 3063235 Maybridge4_000162 CN(C)/C=N/c1ccc(Oc2cncc(Cl)c2)nc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 H09 compound treatment 0.102 0.0313 8.06 0.111 0.0372 10.36 13.0239 0.9923 3179771 Maybridge4_000163 Fc1ccc2sc(NC(=O)NC(=O)c3c(Cl)cccc3Cl)nc2c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 H10 compound treatment 0.069 -0.00169 -0.43 0.069 -0.00481 -1.34 -1.2549 -0.8907 3063236 Maybridge4_000164 CC(=C)C(=O)Nc1ccc(Oc2ccccc2F)nc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 H11 compound treatment 0.098 0.0273 7.03 0.1 0.0262 7.29 10.1294 0.9998 3179772 Maybridge4_000165 Cc1cc(ccc1Cl)C2(O)CSc3nc4cc(ccc4n32)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 H12 compound treatment 0.117 0.0463 11.92 0.12 0.0462 12.86 17.5271 0.9993 1316383 Maybridge4_000166 Cc1ccc(cc1)C(=O)Oc2c(C)cc(cc2C)c3nn(C)c(=O)c4ccccc34 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 H13 compound treatment 0.075 0.00431 1.11 0.077 0.00319 0.89 1.4128 0.9938 1008407 Maybridge4_000167 Clc1ccc(OCOc2ccc(Cl)cc2)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 H14 compound treatment 0.105 0.0343 8.83 0.133 0.0592 16.48 17.9024 0.9573 3179773 Maybridge4_000168 CN(C)/C=C(\Sc1nnc(N)s1)/C(=O)Nc2ccc(F)c(F)c2F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 H15 compound treatment 0.07 -6.87E-4 -0.18 0.071 -0.00281 -0.78 -0.679 -0.8456 3063237 Maybridge4_000169 O=c1ncn(Cc2cccs2)cc1c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 H16 compound treatment 0.074 0.00331 0.85 0.071 -0.00281 -0.78 0.0492 0.0425 1639465 Maybridge4_000170 COC(=O)CNC(=O)c1cccnc1Sc2cc(OC)ccc2OC 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 H17 compound treatment 0.309 0.238 61.36 0.3 0.226 62.99 87.9288 0.9999 3063238 Maybridge4_000171 CCOC(=O)c1cc(CC)sc1NC(=S)Nc2ccccc2C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 H18 compound treatment 0.073 0.00231 0.6 0.074 1.87E-4 0.05 0.4579 0.7662 1639248 Maybridge4_000172 CN(N1CC(C)(C)C1=O)c2cnn(c3ccc(C)cc3)c(=O)c2Cl 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 H19 compound treatment 0.073 0.00231 0.6 0.076 0.00219 0.61 0.8518 0.9999 1494290 Maybridge4_000173 CC1CN(CC(C)O1)C(=O)NC(=O)c2nn(nc2C)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 H20 compound treatment 0.213 0.142 36.64 0.229 0.155 43.22 56.4695 0.9966 3179774 Maybridge4_000174 Cc1ccc(/C=C/c2onc3c(=O)[nH]nc(C)c23)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 H21 compound treatment 0.073 0.00231 0.6 0.074 1.87E-4 0.05 0.4579 0.7662 3179775 Maybridge4_000175 Cc1cc(=O)oc2[nH]nc(CSc3ccc(Cl)cc3)c12 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 H22 compound treatment 0.189 0.118 30.46 0.188 0.114 31.8 44.0262 0.9998 1137912 Maybridge4_000176 CCOC(=O)c1c(C)c(C#N)c(NC(=O)c2ccc(Cl)cc2Cl)n1c3ccc(C)cc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 H23 mock treatment 0.072 0.00131 0.34 0.072 -0.00181 -0.5 -0.118 -0.1942 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 H24 positive control 0.078 0.00731 1.88 0.084 0.0102 2.84 3.3375 0.9802 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 I01 compound treatment 0.077 0.00631 1.63 0.075 0.00119 0.33 1.3831 0.8339 3179776 Maybridge4_000177 OC(=O)C1CCc2ccccc2O1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 I02 compound treatment 0.084 0.0133 3.43 0.075 0.00119 0.33 2.6575 0.7717 1265650 Maybridge4_000178 OC(=O)c1ccccc1NC(=O)c2ccccc2NC(=O)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 I03 compound treatment 0.072 0.00131 0.34 0.071 -0.00281 -0.78 -0.3149 -0.3691 3063239 Maybridge4_000179 COc1ccc(CC/N=C/c2ccc(Oc3nccc(n3)C(F)(F)F)cc2)cc1OC 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 I04 compound treatment 0.066 -0.00469 -1.21 0.068 -0.00581 -1.62 -1.998 -0.9895 3179777 Maybridge4_000180 Cc1ccc(Nc2nc3ccccc3s2)cc1Cl 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 I05 compound treatment 0.074 0.00331 0.85 0.075 0.00119 0.33 0.8369 0.9149 3179778 Maybridge4_000181 FC(F)(F)c1ccnc(NCCNC(=S)NCc2ccco2)n1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 I06 compound treatment 0.078 0.00731 1.88 0.079 0.00519 1.44 2.3529 0.9914 3063240 Maybridge4_000182 Cc1ccc2N(CCCc2c1)C(=S)Nc3cccc(c3)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 I07 compound treatment 0.073 0.00231 0.6 0.075 0.00119 0.33 0.6549 0.9615 3179779 Maybridge4_000183 Cc1ccc(cc1)S(=O)(=O)NCCNc2nccc(n2)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 I08 compound treatment 0.072 0.00131 0.34 0.076 0.00219 0.61 0.6697 0.9613 3063241 Maybridge4_000184 Oc1c(Cl)cc(Cl)cc1/C=N/c2ccc3[nH]nnc3c2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 I09 compound treatment 0.068 -0.00269 -0.69 0.074 1.87E-4 0.05 -0.4524 -0.6519 3179780 Maybridge4_000185 Cc1ccc(cc1)S(=O)(=O)NC(=O)N2CCC(CC2)Nc3nccc(n3)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 I10 compound treatment 0.068 -0.00269 -0.69 0.069 -0.00481 -1.34 -1.437 -0.9527 3063242 Maybridge4_000186 Clc1ccc2scc(/C(=C/c3cccs3)/C#N)c2c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 I11 compound treatment 0.076 0.00531 1.37 0.077 0.00319 0.89 1.5949 0.9781 3179781 Maybridge4_000187 CCOC(=O)c1c(sc(C)c1c2ccccc2)N3C(=O)C=CC3=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 I12 compound treatment 0.096 0.0253 6.52 0.099 0.0252 7.01 9.5684 0.9993 3063243 Maybridge4_000188 FC(F)(F)c1cc(NC=C2C(=O)NC(=S)NC2=O)cc(c1)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 I13 compound treatment 0.095 0.0243 6.26 0.098 0.0242 6.74 9.1894 0.9993 3179782 Maybridge4_000189 Cc1nc(ccc1c2nnc(SCCCN3C(=O)c4ccccc4C3=O)o2)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 I14 compound treatment 0.088 0.0173 4.46 0.086 0.0122 3.39 5.5519 0.991 3179783 Maybridge4_000190 Cc1nc2ccc(Br)cc2c(=O)n1c3cc(ccc3N4CCOCC4)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 I15 compound treatment 0.11 0.0393 10.12 0.109 0.0352 9.8 14.0865 0.9999 1704168 Maybridge4_000191 CC1(C)C2CCC1(CS(=O)(=O)N3CCCN(CC3)c4nc5ccc(Cl)cc5s4)C(=O)C2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 I16 compound treatment 0.073 0.00231 0.6 0.07 -0.00381 -1.06 -0.3298 -0.2709 3179784 Maybridge4_000192 COc1ccccc1NC(=O)CSc2cc(cc(c2)C(F)(F)F)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 I17 compound treatment 0.128 0.0573 14.76 0.13 0.0562 15.65 21.499 0.9996 1335897 Maybridge4_000193 Clc1cc(ccc1N2C(=O)CC3(CCCC3)C2=O)S(=O)(=O)N4CCc5ccccc5C4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 I18 compound treatment 0.129 0.0583 15.01 0.132 0.0582 16.2 22.0749 0.9993 3063244 Maybridge4_000194 Cc1cccc(C)c1NC(=O)CSC(=O)c2sc3ccccc3c2Cl 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 I19 compound treatment 0.076 0.00531 1.37 0.075 0.00119 0.33 1.201 0.8535 3179785 Maybridge4_000195 FC(F)(F)c1cc(Cl)c2nc(cn2c1)C(=O)NCCCN3CCN(Cc4ccccc4)CC3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 I20 compound treatment 0.081 0.0103 2.66 0.082 0.00819 2.28 3.4898 0.9971 3063245 Maybridge4_000196 Cc1ccc2ncc(nc2c1)c3ccc(Cl)c(C)c3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 I21 compound treatment 0.109 0.0383 9.86 0.112 0.0382 10.63 14.4952 0.9993 3063246 Maybridge4_000197 CN(C)/N=C(\C)/c1cc(Cl)cc(Cl)c1O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 I22 compound treatment 0.201 0.13 33.55 0.193 0.119 33.19 47.1955 1.0 3179786 Maybridge4_000198 Cc1nc2c(Br)cc(Br)cc2c(=O)n1Cc3cccs3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 I23 mock treatment 0.071 3.12E-4 0.08 0.073 -8.13E-4 -0.23 -0.1031 -0.4293 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 I24 positive control 0.077 0.00631 1.63 0.082 0.00819 2.28 2.7616 0.9862 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 J01 compound treatment 0.079 0.00831 2.14 0.082 0.00819 2.28 3.1257 0.9995 3063247 Maybridge4_000199 CSC1=NCCCN1C(=O)c2c(C)onc2c3ccccc3Cl 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 J02 compound treatment 0.072 0.00131 0.34 0.074 1.87E-4 0.05 0.2759 0.8068 3179787 Maybridge4_000200 FC(F)(F)C1=NN(C(=O)C1)c2ccccc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 J03 compound treatment 0.148 0.0773 19.91 0.166 0.0922 25.67 32.2294 0.9921 3063248 Maybridge4_000201 Cc1cc(ccc1Cl)C2=Nc3ccccc3SC2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 J04 compound treatment 0.075 0.00431 1.11 0.074 1.87E-4 0.05 0.8221 0.7395 3179788 Maybridge4_000202 Cc1ccc(=O)n(n1)S(=O)(=O)c2ccc(F)cc2F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 J05 compound treatment 0.075 0.00431 1.11 0.076 0.00219 0.61 1.2159 0.9601 3063249 Maybridge4_000203 CC(C)(C)NC(=S)NC1CC1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 J06 compound treatment 0.082 0.0113 2.91 0.084 0.0102 2.84 4.0657 0.9999 1412882 Maybridge4_000204 CN(NS(=O)(=O)c1ccc(Cl)cc1)c2cnn(C)c(=O)c2Cl 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 J07 compound treatment 0.071 3.12E-4 0.08 0.075 0.00119 0.33 0.2907 0.8542 3179789 Maybridge4_000205 CC1CN(CC(C)O1)C2=NCCN2S(=O)(=O)c3ccc(Cl)cc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 J08 compound treatment 0.074 0.00331 0.85 0.079 0.00519 1.44 1.6246 0.9684 3063250 Maybridge4_000206 COC(=O)c1cc(OC(=O)c2nn(nc2C)c3ccccc3)n(n1)c4ccccc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 J09 compound treatment 0.069 -0.00169 -0.43 0.075 0.00119 0.33 -0.0734 -0.1344 3179790 Maybridge4_000207 FC(F)(F)c1ccc(OC(=O)NC(=O)c2c(Cl)cccc2Cl)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 J10 compound treatment 0.167 0.0963 24.8 0.163 0.0892 24.84 35.0978 1.0 1174991 Maybridge4_000208 Clc1ccc(NC(=O)N2CCC(CC2)C(c3ccccc3)c4ccccc4)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 J11 compound treatment 0.128 0.0573 14.76 0.126 0.0522 14.53 20.7113 1.0 1235401 Maybridge4_000209 Cc1cc(Oc2ccnc3cc(Cl)ccc23)ccc1Cl 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 J12 compound treatment 0.093 0.0223 5.74 0.096 0.0222 6.18 8.4315 0.9993 1558885 Maybridge4_000210 Cc1cc(cc(C)c1OC(=O)Nc2ccc(Cl)cc2)c3nn(C)c(=O)c4ccccc34 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 J13 compound treatment 0.117 0.0463 11.92 0.12 0.0462 12.86 17.5271 0.9993 1586134 Maybridge4_000211 Clc1cccc(Cl)c1C(=O)NC(=O)N(Cc2ccccc2)C3CC4CCC3C4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 J14 compound treatment 0.072 0.00131 0.34 0.07 -0.00381 -1.06 -0.5118 -0.4593 3178204 Maybridge4_000212 CN(C)/C=C(\C(=O)Nc1ccc(F)c(F)c1F)/S(=O)(=O)c2ccccc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 J15 compound treatment 0.072 0.00131 0.34 0.071 -0.00281 -0.78 -0.3149 -0.3691 1175614 Maybridge4_000213 O=c1ncn(Cc2ccccn2)cc1c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 J16 compound treatment 0.073 0.00231 0.6 0.071 -0.00281 -0.78 -0.1328 -0.135 1210252 Maybridge4_000214 Cc1ccc(cc1)C(=O)COc2cc(C)nc3nncn23 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 J17 compound treatment 0.074 0.00331 0.85 0.075 0.00119 0.33 0.8369 0.9149 1235603 Maybridge4_000215 Fc1ccc(NC(=O)Cc2nn[nH]n2)cc1Cl 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 J18 compound treatment 0.075 0.00431 1.11 0.076 0.00219 0.61 1.2159 0.9601 1578276 Maybridge4_000216 CN(c1cnn(c2ccc(C)cc2)c(=O)c1Cl)n3cccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 J19 compound treatment 0.074 0.00331 0.85 0.075 0.00119 0.33 0.8369 0.9149 1321013 Maybridge4_000217 COC(=O)c1sccc1OC(=O)c2nn(nc2C)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 J20 compound treatment 0.106 0.0353 9.09 0.106 0.0322 8.96 12.7675 1.0 3063294 Maybridge4_000218 Cc1ccc(/C=C/c2onc3c(=O)n(C)nc(C)c23)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 J21 compound treatment 0.125 0.0543 13.98 0.123 0.0492 13.7 19.5743 0.9999 3063295 Maybridge4_000219 CCCC/1=NN(C(=O)\C1=C\c2ccc(Cl)cc2)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 J22 compound treatment 0.071 3.12E-4 0.08 0.073 -8.13E-4 -0.23 -0.1031 -0.4293 3063296 Maybridge4_000220 CN(C(=O)CSc1ccc(cn1)C(F)(F)F)c2c3CCCCc3nn2C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 J23 mock treatment 0.07 -6.87E-4 -0.18 0.073 -8.13E-4 -0.23 -0.2852 -0.9926 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 J24 positive control 0.077 0.00631 1.63 0.08 0.00619 1.72 2.3677 0.9996 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 K01 compound treatment 0.127 0.0563 14.5 0.131 0.0572 15.93 21.5138 0.9989 1220864 Maybridge4_000221 CC(C)(C)c1cc(CN2C(=O)c3ccccc3C2=O)cc(c1O)C(C)(C)C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 K02 compound treatment 0.068 -0.00269 -0.69 0.074 1.87E-4 0.05 -0.4524 -0.6519 3063297 Maybridge4_000222 Cc1cc2CSC(SCc2cc1C)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 K03 compound treatment 0.082 0.0113 2.91 0.085 0.0112 3.12 4.2626 0.9994 3178205 Maybridge4_000223 FC(F)(F)Oc1ccc(cc1)N2C(=O)CC3(CCCC3)C2=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 K04 compound treatment 0.093 0.0223 5.74 0.093 0.0192 5.34 7.8407 0.9993 3063298 Maybridge4_000224 Oc1c(Cl)cc(Cl)cc1/C=N/c2ccc3oc(=O)ccc3c2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 K05 compound treatment 0.124 0.0533 13.73 0.122 0.0482 13.42 19.1953 0.9999 3178206 Maybridge4_000225 FC(F)(F)c1ccc(/C=C(\C#N)/c2cccc(c2)C(F)(F)F)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 K06 compound treatment 0.098 0.0273 7.03 0.098 0.0242 6.74 9.7356 0.9998 1672405 Maybridge4_000226 Clc1cccc(NC(=S)N2CCc3ccccc3C2)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 K07 compound treatment 0.072 0.00131 0.34 0.072 -0.00181 -0.5 -0.118 -0.1942 1231870 Maybridge4_000227 Fc1ccc(CN2CCCN(CC2)C(=O)Nc3cccc(Cl)c3Cl)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 K08 compound treatment 0.07 -6.87E-4 -0.18 0.073 -8.13E-4 -0.23 -0.2852 -0.9926 1729950 Maybridge4_000228 CC(C)N(Cc1ccc(cc1)N(C)C)C(=O)c2sc3ccccc3c2Cl 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 K09 compound treatment 0.081 0.0103 2.66 0.09 0.0162 4.51 5.0652 0.9681 3178207 Maybridge4_000229 Cc1nc(ccc1C(=O)N2CCN(CC2)c3nc4ccc(Cl)cc4s3)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 K10 compound treatment 0.067 -0.00369 -0.95 0.069 -0.00481 -1.34 -1.619 -0.9857 1285643 Maybridge4_000230 Clc1ccc(cc1)N(CCc2ccccn2)S(=O)(=O)c3ccc(Cl)cc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 K11 compound treatment 0.089 0.0183 4.71 0.09 0.0162 4.51 6.5217 0.9997 3063299 Maybridge4_000231 Clc1ccc(Cl)c(c1)n2ccnc2SCCCN3C(=O)c4ccccc4C3=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 K12 compound treatment 0.076 0.00531 1.37 0.074 1.87E-4 0.05 1.0041 0.7336 1594434 Maybridge4_000232 COc1ccc(cc1)C(=O)CC2(O)C(=O)N(CN3CCOCC3)c4ccc(Br)cc42 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 K13 compound treatment 0.074 0.00331 0.85 0.074 1.87E-4 0.05 0.64 0.749 3063300 Maybridge4_000233 Cc1ccc(cc1)S(=O)(=O)NC(=O)NC2CCN(CC2)c3nccc(n3)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 K14 compound treatment 0.124 0.0533 13.73 0.131 0.0572 15.93 20.9676 0.9973 1540061 Maybridge4_000234 CN1C(NC(=O)c2ccccc12)C3CCC=CC3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 K15 compound treatment 0.087 0.0163 4.2 0.09 0.0162 4.51 6.1576 0.9994 3178208 Maybridge4_000235 CC(C)Nc1ncnc2scc(c3ccccc3)c12 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 K16 compound treatment 0.128 0.0573 14.76 0.122 0.0482 13.42 19.9236 0.9989 3063301 Maybridge4_000236 S=C(NCCCN1CCOCC1)N2CC3CCC(CC3)C2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 K17 compound treatment 0.11 0.0393 10.12 0.109 0.0352 9.8 14.0865 0.9999 1631820 Maybridge4_000237 COc1ccc(NS(=O)(=O)c2ccc(N3C(=O)CC4(CCCC4)C3=O)c(Cl)c2)c(OC)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 K18 compound treatment 0.087 0.0163 4.2 0.088 0.0142 3.95 5.7637 0.9995 3063302 Maybridge4_000238 Cc1cc(Oc2ccc(cc2n3cccc3)C(F)(F)F)cc(C)c1Cl 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 K19 compound treatment 0.09 0.0193 4.97 0.106 0.0322 8.96 9.8545 0.9613 3178209 Maybridge4_000239 FC(F)(F)c1cnc(N2CCC(CC2)N3C(=O)CC4(CCCC4)C3=O)c(Cl)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 K20 compound treatment 0.206 0.135 34.84 0.211 0.137 38.21 51.6504 0.9989 3063303 Maybridge4_000240 Clc1ccc(SC(=O)c2cccnc2Oc3ccccc3)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 K21 compound treatment 0.072 0.00131 0.34 0.073 -8.13E-4 -0.23 0.079 0.1941 1673449 Maybridge4_000241 O=C1CCCCCCCCCCC1CN2CCOCC2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 K22 compound treatment 0.069 -0.00169 -0.43 0.071 -0.00281 -0.78 -0.8611 -0.9613 1443277 Maybridge4_000242 Nc1ccccc1C(=O)NCCc2ccncc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 K23 mock treatment 0.071 3.12E-4 0.08 0.074 1.87E-4 0.05 0.0938 0.9781 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 K24 positive control 0.078 0.00731 1.88 0.08 0.00619 1.72 2.5498 0.999 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 L01 compound treatment 0.08 0.00931 2.4 0.075 0.00119 0.33 1.9293 0.7971 1275035 Maybridge4_000243 COC(=O)c1ccc(C)c(NC(=O)c2ccncc2)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 L02 compound treatment 0.081 0.0103 2.66 0.08 0.00619 1.72 3.096 0.9781 3178210 Maybridge4_000244 CN(C)/C=N/S(=O)(=O)c1ccc(cc1)n2nc(cc2c3cccs3)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 L03 compound treatment 0.161 0.0903 23.25 0.143 0.0692 19.27 30.0669 0.9956 1520487 Maybridge4_000245 Clc1ccc(cc1)C(=O)CNC(=O)c2ccc(Cl)cc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 L04 compound treatment 0.071 3.12E-4 0.08 0.074 1.87E-4 0.05 0.0938 0.9781 3063304 Maybridge4_000246 Fc1ccc(cc1F)C2=CSC3=NCCCN23 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 L05 compound treatment 0.105 0.0343 8.83 0.109 0.0352 9.8 13.1762 0.9987 3178211 Maybridge4_000247 CCC1(CC)N/C(=N/c2ccc(F)cc2F)/SC1=C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 L06 compound treatment 0.071 3.12E-4 0.08 0.076 0.00219 0.61 0.4877 0.7936 3063305 Maybridge4_000248 Cn1ncc(SCc2ccccc2)c(Cl)c1=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 L07 compound treatment 0.08 0.00931 2.4 0.083 0.00919 2.56 3.5047 0.9995 3178212 Maybridge4_000249 Cc1ccc(/N=C\2/NC(C)(C)C(=C)S2)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 L08 compound treatment 0.071 3.12E-4 0.08 0.075 0.00119 0.33 0.2907 0.8542 3178213 Maybridge4_000250 CC(=O)Nc1ccc(Oc2cncc(Cl)c2)nc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 L09 compound treatment 0.112 0.0413 10.64 0.117 0.0432 12.03 16.026 0.9981 3063306 Maybridge4_000251 CCOC(=S)SCc1ccc(cc1)C(=O)Oc2ccc(F)cc2F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 L10 compound treatment 0.069 -0.00169 -0.43 0.071 -0.00281 -0.78 -0.8611 -0.9613 3178214 Maybridge4_000252 CC1(C)CN(C(=S)Nc2cccc(Cl)c2)C1=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 L11 compound treatment 0.07 -6.87E-4 -0.18 0.073 -8.13E-4 -0.23 -0.2852 -0.9926 3063307 Maybridge4_000253 COC(=O)/C=C/1\S/C(=N\c2ccccn2)/N(C1=O)c3ccc(Cl)cc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 L12 compound treatment 0.075 0.00431 1.11 0.075 0.00119 0.33 1.019 0.8795 1389325 Maybridge4_000254 Cc1cc(cc(C)c1OCC(=O)NN)c2nn(C)c(=O)c3ccccc23 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 L13 compound treatment 0.075 0.00431 1.11 0.077 0.00319 0.89 1.4128 0.9938 3063308 Maybridge4_000255 CSc1ccc(OCOc2ccc(SC)cc2)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 L14 compound treatment 0.072 0.00131 0.34 0.07 -0.00381 -1.06 -0.5118 -0.4593 3178215 Maybridge4_000256 CCOC(=O)c1c(F)c(F)c(c(F)c1F)S(=O)(=O)C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 L15 compound treatment 0.075 0.00431 1.11 0.076 0.00219 0.61 1.2159 0.9601 3178216 Maybridge4_000257 CN1C(NC(=O)c2cc(Cl)ccc12)c3ccc(C#N)cc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 L16 compound treatment 0.073 0.00231 0.6 0.07 -0.00381 -1.06 -0.3298 -0.2709 1354966 Maybridge4_000258 Cc1ccc(Oc2ncccc2C(=O)NCC(=O)O)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 L17 compound treatment 0.08 0.00931 2.4 0.081 0.00719 2.0 3.1108 0.996 3178217 Maybridge4_000259 NC(=O)Nc1ccc2[nH]ncc2c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 L18 compound treatment 0.073 0.00231 0.6 0.072 -0.00181 -0.5 0.0641 0.0821 3063309 Maybridge4_000260 COc1cc(C)nc2nc(nn12)S(=O)(=O)C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 L19 compound treatment 0.117 0.0463 11.92 0.122 0.0482 13.42 17.9209 0.9983 3178218 Maybridge4_000261 CSc1nncc(n1)c2ccc(Cl)cc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 L20 compound treatment 0.073 0.00231 0.6 0.075 0.00119 0.33 0.6549 0.9615 1483914 Maybridge4_000262 Cc1ccc(cc1)c2cc(n[nH]2)c3c(C)nn(C)c(=O)c3N 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 L21 compound treatment 0.07 -6.87E-4 -0.18 0.071 -0.00281 -0.78 -0.679 -0.8456 1521640 Maybridge4_000263 Nc1ccccc1C(=O)NC2CCCCNC2=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 L22 compound treatment 0.139 0.0683 17.59 0.148 0.0742 20.66 27.0462 0.9968 3178219 Maybridge4_000264 Cc1nc(cs1)c2cc(C#N)c(Sc3cccc(c3)C(F)(F)F)nc2C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 L23 mock treatment 0.07 -6.87E-4 -0.18 0.074 1.87E-4 0.05 -0.0882 -0.4781 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 L24 positive control 0.077 0.00631 1.63 0.079 0.00519 1.44 2.1708 0.9983 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 M01 compound treatment 0.101 0.0303 7.8 0.099 0.0252 7.01 10.4787 0.9986 3063310 Maybridge4_000265 Oc1ccccc1/N=C/C=N/c2ccccc2O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 M02 compound treatment 0.076 0.00531 1.37 0.078 0.00419 1.17 1.7918 0.9968 3178220 Maybridge4_000266 CN(CCC#N)c1ccc(cc1)C2SCc3cc(C)c(C)cc3CS2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 M03 compound treatment 0.07 -6.87E-4 -0.18 0.072 -0.00181 -0.5 -0.4821 -0.9013 3063311 Maybridge4_000267 Cc1ccc(cc1)S(=O)(=O)NC(=O)N2CCCN(CC2)c3ccc(cn3)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 M04 compound treatment 0.112 0.0413 10.64 0.126 0.0522 14.53 17.7983 0.9882 3178221 Maybridge4_000268 Cc1onc(c1C(=O)N2CCCc3cccc(C)c23)c4c(Cl)cccc4Cl 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 M05 compound treatment 0.19 0.119 30.72 0.189 0.115 32.08 44.4052 0.9998 1280324 Maybridge4_000269 Cc1c(Cl)cccc1NC(=S)N2CCCN(CC2)c3nc4ccc(Cl)cc4s3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 M06 compound treatment 0.104 0.0333 8.58 0.103 0.0292 8.13 11.8126 0.9996 1592820 Maybridge4_000270 Cc1ccccc1NC(=S)Nc2ccccc2C(=O)Nc3ccc(F)cc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 M07 compound treatment 0.077 0.00631 1.63 0.072 -0.00181 -0.5 0.7923 0.4656 3178222 Maybridge4_000271 Cc1nc(ccc1C(=O)Oc2ccc(OC(F)(F)F)cc2)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 M08 compound treatment 0.114 0.0433 11.15 0.115 0.0412 11.47 15.9963 0.9999 1647940 Maybridge4_000272 Cc1cc(OCc2c(C)c(C)c(C)c(C)c2C)c3cc(Cl)ccc3n1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 M09 compound treatment 0.075 0.00431 1.11 0.081 0.00719 2.0 2.2005 0.9613 3178223 Maybridge4_000273 Cc1ccc(NC(=S)N2CCC(CC2)Nc3nccc(n3)C(F)(F)F)c(C)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 M10 compound treatment 0.071 3.12E-4 0.08 0.07 -0.00381 -1.06 -0.6939 -0.6517 1291651 Maybridge4_000274 CC(C)c1ccc(cc1)N(CCc2ccccn2)S(=O)(=O)c3ccc(C)cc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 M11 compound treatment 0.098 0.0273 7.03 0.094 0.0202 5.62 8.9479 0.9938 3178308 Maybridge4_000275 FC(F)(F)c1cccnc1NCCNc2ncnc3scc(c4ccccc4)c23 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 M12 compound treatment 0.115 0.0443 11.41 0.12 0.0462 12.86 17.1629 0.9982 3178309 Maybridge4_000276 Fc1ccc(cc1)C2CN3C(=N2)C=Cc4ccccc34 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 M13 compound treatment 0.1 0.0293 7.55 0.1 0.0262 7.29 10.4936 0.9999 1327290 Maybridge4_000277 COC(=O)c1cc(C#N)c(C)nc1Sc2nccn2c3cc(Cl)ccc3Cl 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 M14 compound treatment 0.111 0.0403 10.38 0.112 0.0382 10.63 14.8593 0.9999 1331303 Maybridge4_000278 O=C1NC(Nc2ccccc12)C3CCC=CC3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 M15 compound treatment 0.07 -6.87E-4 -0.18 0.071 -0.00281 -0.78 -0.679 -0.8456 1371250 Maybridge4_000279 CC(C)NS(=O)(=O)c1ccc(N2C(=O)CC3(CCCC3)C2=O)c(Cl)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 M16 compound treatment 0.164 0.0933 24.03 0.161 0.0872 24.28 34.1577 1.0 1643068 Maybridge4_000280 CCCN(CCC)S(=O)(=O)c1ccc(cc1)C(=O)N2CC3CCC(CC3)C2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 M17 compound treatment 0.091 0.0203 5.23 0.092 0.0182 5.07 7.2796 0.9999 1732462 Maybridge4_000281 CCOC(=O)C1CCN(CC1)S(=O)(=O)c2ccc(N3C(=O)CC4(CCCC4)C3=O)c(Cl)c2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 M18 compound treatment 0.075 0.00431 1.11 0.076 0.00219 0.61 1.2159 0.9601 1423781 Maybridge4_000282 Cc1cc(ccc1Cl)C(=O)c2cc3cc(Cl)ccc3o2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 M19 compound treatment 0.08 0.00931 2.4 0.082 0.00819 2.28 3.3077 0.9997 3178310 Maybridge4_000283 Fc1cccc(Cl)c1CN2CCN(CCCNc3ncnc4scc(c5ccccc5)c34)CC2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 M20 compound treatment 0.119 0.0483 12.44 0.122 0.0482 13.42 18.285 0.9993 3063131 Maybridge4_000284 NNC(=O)c1cccnc1Oc2ccccc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 M21 compound treatment 0.07 -6.87E-4 -0.18 0.072 -0.00181 -0.5 -0.4821 -0.9013 3063132 Maybridge4_000285 Fc1ccc(/C=C/c2cccc3ccccc23)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 M22 compound treatment 0.222 0.151 38.96 0.202 0.128 35.7 52.7911 0.999 3178311 Maybridge4_000286 Cc1ccc(SCCNC(=O)c2cccnc2Oc3ccccc3)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 M23 mock treatment 0.07 -6.87E-4 -0.18 0.076 0.00219 0.61 0.3056 0.4817 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 M24 positive control 0.077 0.00631 1.63 0.08 0.00619 1.72 2.3677 0.9996 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 N01 compound treatment 0.099 0.0283 7.29 0.092 0.0182 5.07 8.7361 0.9842 1041669 Maybridge4_000287 O=C(CSCC(=O)c1ccccc1)c2ccccc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 N02 compound treatment 0.072 0.00131 0.34 0.076 0.00219 0.61 0.6697 0.9613 3178312 Maybridge4_000288 COC(=O)c1cccnc1SC 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 N03 compound treatment 0.081 0.0103 2.66 0.083 0.00919 2.56 3.6867 0.9998 3063133 Maybridge4_000289 Cc1ccccc1c2ncc(o2)c3ccc(Br)cc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 N04 compound treatment 0.078 0.00731 1.88 0.078 0.00419 1.17 2.1559 0.9735 3178313 Maybridge4_000290 Fc1ccc(cc1F)C2=NNC3=NCCN3C2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 N05 compound treatment 0.074 0.00331 0.85 0.078 0.00419 1.17 1.4277 0.9882 3178314 Maybridge4_000291 Clc1ccc(NC(=N)c2ccccc2)cc1Cl 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 N06 compound treatment 0.144 0.0733 18.88 0.15 0.0762 21.22 28.3504 0.9983 1155893 Maybridge4_000292 CSc1nnc(SC)n1CCNC(=O)c2c(Cl)cccc2Cl 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 N07 compound treatment 0.08 0.00931 2.4 0.081 0.00719 2.0 3.1108 0.996 3178315 Maybridge4_000293 CCc1cccc(CC)c1/N=C\2/NC(C)(C)C(=C)S2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 N08 compound treatment 0.079 0.00831 2.14 0.082 0.00819 2.28 3.1257 0.9995 3178316 Maybridge4_000294 FC(F)(F)c1ccc(nc1)S(=O)(=O)CC2=NN(C(=O)C2)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 N09 compound treatment 0.076 0.00531 1.37 0.081 0.00719 2.0 2.3826 0.9828 1286323 Maybridge4_000295 COC(=O)c1sc2ccccc2c1O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 N10 compound treatment 0.076 0.00531 1.37 0.078 0.00419 1.17 1.7918 0.9968 1418804 Maybridge4_000296 Nc1ccccc1Nc2nc(=O)n(Cc3ccc(Cl)cc3)cc2C#N 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 N11 compound treatment 0.07 -6.87E-4 -0.18 0.072 -0.00181 -0.5 -0.4821 -0.9013 1326126 Maybridge4_000297 Cc1ccc(COn2c(nc3ccccc3c2=O)c4ccccc4)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 N12 compound treatment 0.074 0.00331 0.85 0.073 -8.13E-4 -0.23 0.4431 0.5021 1242548 Maybridge4_000298 Cc1ccn2c(=O)c(cnc2c1)C(=O)O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 N13 compound treatment 0.107 0.0363 9.35 0.11 0.0362 10.08 13.7372 0.9993 3178317 Maybridge4_000299 N#Cc1ccc(OCOc2ccc(C#N)cc2)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 N14 compound treatment 0.069 -0.00169 -0.43 0.068 -0.00581 -1.62 -1.4519 -0.8662 3063134 Maybridge4_000300 CC(C)Sc1nnc(S)n1C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 N15 compound treatment 0.106 0.0353 9.09 0.109 0.0352 9.8 13.3582 0.9993 3178318 Maybridge4_000301 Cn1c(nc(=O)c2cc(Cl)ccc12)c3cc(Br)cs3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 N16 compound treatment 0.378 0.307 79.12 0.352 0.278 77.47 110.7309 0.9999 3178319 Maybridge4_000302 Cc1ccc(/C=C/2\N=C(OC2=O)c3ccccc3N(CC=C)S(=O)(=O)c4ccc(C)cc4)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 N17 compound treatment 0.135 0.0643 16.56 0.132 0.0582 16.2 23.1672 0.9999 3063135 Maybridge4_000303 Cc1onc(NC(=O)NC(=O)c2ccccc2F)c1Br 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 N18 compound treatment 0.075 0.00431 1.11 0.074 1.87E-4 0.05 0.8221 0.7395 3063136 Maybridge4_000304 CC(C)(C)OC(=O)C(C)(C)S(=O)(=O)c1ccc(cn1)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 N19 compound treatment 0.15 0.0793 20.42 0.176 0.102 28.46 34.5628 0.9867 3178320 Maybridge4_000305 Clc1cc(Cl)c2nc(Oc3cccc(c3)N4CCOCC4)sc2c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 N20 compound treatment 0.201 0.13 33.55 0.204 0.13 36.26 49.3617 0.9993 3063137 Maybridge4_000306 CCOC(=O)c1nn(c2ccccc2)c(=N)c(C#N)c1C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 N21 compound treatment 0.072 0.00131 0.34 0.072 -0.00181 -0.5 -0.118 -0.1942 3178321 Maybridge4_000307 Cc1nn(nc1c2nnc(o2)c3ccc(Cl)c(Cl)c3)c4ccccc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 N22 compound treatment 0.119 0.0483 12.44 0.117 0.0432 12.03 17.3004 0.9999 3178322 Maybridge4_000308 Cc1nc(cs1)c2cc(C#N)c(Oc3ccc(cc3)C(F)(F)F)nc2C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 N23 mock treatment 0.07 -6.87E-4 -0.18 0.076 0.00219 0.61 0.3056 0.4817 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 N24 positive control 0.076 0.00531 1.37 0.079 0.00519 1.44 1.9887 0.9996 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 O01 compound treatment 0.082 0.0113 2.91 0.076 0.00219 0.61 2.4903 0.8369 3063138 Maybridge4_000309 Cn1cc(c(n1)C(F)(F)F)S(=O)(=O)NCc2ccc3OCOc3c2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 O02 compound treatment 0.075 0.00431 1.11 0.077 0.00319 0.89 1.4128 0.9938 1336600 Maybridge4_000310 Clc1ccccc1n2c(n[nH]c2=S)C3CCCNC3=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 O03 compound treatment 0.113 0.0423 10.89 0.114 0.0402 11.19 15.6173 0.9999 3063139 Maybridge4_000311 Cc1cccc(Cl)c1NC(=O)N2CCCN(CC2)c3ncccc3C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 O04 compound treatment 0.141 0.0703 18.1 0.151 0.0772 21.5 28.0011 0.9963 3178323 Maybridge4_000312 CCOC(=O)c1c(C)onc1c2c(Cl)cccc2Cl 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 O05 compound treatment 0.075 0.00431 1.11 0.075 0.00119 0.33 1.019 0.8795 1600108 Maybridge4_000313 OC1CCN(CC1)C(=O)Nc2ccc(Cl)c(Cl)c2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 O06 compound treatment 0.124 0.0533 13.73 0.118 0.0442 12.31 18.4076 0.9985 1675860 Maybridge4_000314 CCN(Cc1cc(OC)c(OC)c(OC)c1)C(=S)Nc2cccc(SC)c2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 O07 compound treatment 0.071 3.12E-4 0.08 0.073 -8.13E-4 -0.23 -0.1031 -0.4293 3063188 Maybridge4_000315 Cc1nc(ccc1C(=O)NCC=C)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 O08 compound treatment 0.072 0.00131 0.34 0.075 0.00119 0.33 0.4728 0.9999 1638858 Maybridge4_000316 Cc1nc2cc(Cl)ccc2c(=O)n1CC3CCCO3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 O09 compound treatment 0.074 0.00331 0.85 0.078 0.00419 1.17 1.4277 0.9882 1730664 Maybridge4_000317 CCOC(=O)c1cc(C(=O)OC)c(C)nc1N2CCC(CC2)NC3CCCCC3O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 O10 compound treatment 0.07 -6.87E-4 -0.18 0.074 1.87E-4 0.05 -0.0882 -0.4781 1134448 Maybridge4_000318 Fc1ccc(NC(=S)N2CCCCC2CCN3CCOCC3)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 O11 compound treatment 0.071 3.12E-4 0.08 0.071 -0.00281 -0.78 -0.497 -0.6311 3063189 Maybridge4_000319 OC(=O)/C=C/C(=O)NC1CCN(CC1)c2nccc(n2)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 O12 compound treatment 0.071 3.12E-4 0.08 0.073 -8.13E-4 -0.23 -0.1031 -0.4293 3178324 Maybridge4_000320 C1C(N=C2C=Cc3ccccc3N12)c4ccc5ccccc5c4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 O13 compound treatment 0.077 0.00631 1.63 0.084 0.0102 2.84 3.1554 0.965 1152090 Maybridge4_000321 CC1CN(CC(C)O1)S(=O)(=O)c2ccc(N3C(=O)CC4(CCCC4)C3=O)c(Cl)c2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 O14 compound treatment 0.072 0.00131 0.34 0.071 -0.00281 -0.78 -0.3149 -0.3691 1502131 Maybridge4_000322 Nc1n(nc2cc(O)nc(O)c12)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 O15 compound treatment 0.071 3.12E-4 0.08 0.072 -0.00181 -0.5 -0.3 -0.587 1406030 Maybridge4_000323 CC(C)(C)OC(=O)N1CCN(CC1)C(=O)c2ccccc2C(=O)O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 O16 compound treatment 0.13 0.0593 15.27 0.124 0.0502 13.98 20.6815 0.999 1015155 Maybridge4_000324 O=c1ccc(=O)n([nH]1)c2ccccc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 O17 compound treatment 0.1 0.0293 7.55 0.102 0.0282 7.85 10.8874 0.9998 3178325 Maybridge4_000325 Cc1nc(nc(NC2CCN(CC2)c3ncc(cc3Cl)C(F)(F)F)c1Cl)c4ccccn4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 O18 compound treatment 0.114 0.0433 11.15 0.115 0.0412 11.47 15.9963 0.9999 3063190 Maybridge4_000326 Cc1cc(NC(=S)NC(C)(C)C)ccc1Br 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 O19 compound treatment 0.07 -6.87E-4 -0.18 0.071 -0.00281 -0.78 -0.679 -0.8456 1373262 Maybridge4_000327 S=C(NC1CC1)N2CCCN(Cc3cccc4ccccc34)CC2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 O20 compound treatment 0.09 0.0193 4.97 0.091 0.0172 4.79 6.9007 0.9998 3178326 Maybridge4_000328 N#Cc1cccnc1Oc2ccccc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 O21 compound treatment 0.073 0.00231 0.6 0.074 1.87E-4 0.05 0.4579 0.7662 3178327 Maybridge4_000329 Cc1cc(C(=O)NN)c2cc(Br)ccc2n1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 O22 compound treatment 0.086 0.0153 3.94 0.088 0.0142 3.95 5.5816 1.0 3063191 Maybridge4_000330 CC(C)(C)NC(=S)Nc1cc(ccc1N2CCCCC2)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 O23 mock treatment 0.072 0.00131 0.34 0.076 0.00219 0.61 0.6697 0.9613 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 O24 positive control 0.077 0.00631 1.63 0.08 0.00619 1.72 2.3677 0.9996 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 P01 compound treatment 0.086 0.0153 3.94 0.084 0.0102 2.84 4.7939 0.987 3178328 Maybridge4_000331 Fc1ccc(cc1Cl)C(=O)NC(=O)Nc2nnc(s2)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 P02 compound treatment 0.087 0.0163 4.2 0.084 0.0102 2.84 4.976 0.9818 3178329 Maybridge4_000332 CN(C)/C=C/1\C(=O)c2ccc(Cl)cc2N(Cc3c(F)cccc3Cl)S1(=O)=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 P03 compound treatment 0.092 0.0213 5.49 0.086 0.0122 3.39 6.2801 0.9733 3063192 Maybridge4_000333 Fc1ccccc1C(=O)NC(=O)OCc2ccc(Cl)cc2Cl 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 P04 compound treatment 0.09 0.0193 4.97 0.086 0.0122 3.39 5.916 0.9827 3063193 Maybridge4_000334 CN1N=C(CC1=O)C(C)(C)C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 P05 compound treatment 0.081 0.0103 2.66 0.088 0.0142 3.95 4.6714 0.9813 3178330 Maybridge4_000335 Clc1ccc(cc1)S(=O)(=O)Nc2ccccc2C(=O)NCCCn3ccnc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 P06 compound treatment 0.114 0.0433 11.15 0.111 0.0372 10.36 15.2086 0.9993 3063194 Maybridge4_000336 CN(C)/C=N/c1cc(Cl)c(cc1Oc2ccc(Cl)cc2)n3cccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 P07 compound treatment 0.079 0.00831 2.14 0.08 0.00619 1.72 2.7318 0.9942 3178331 Maybridge4_000337 CSC1=NCCN1CC(=O)c2ccc(F)cc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 P08 compound treatment 0.117 0.0463 11.92 0.121 0.0472 13.14 17.724 0.9988 3178429 Maybridge4_000338 Oc1c(C(=O)c2ccccc2)c(CS(=O)(=O)c3ccc(cn3)C(F)(F)F)nn1c4ccccc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 P09 compound treatment 0.081 0.0103 2.66 0.083 0.00919 2.56 3.6867 0.9998 3063195 Maybridge4_000339 FC(F)(F)c1ccc2[nH]c(SCc3cccc(C#N)c3)nc2c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 P10 compound treatment 0.093 0.0223 5.74 0.093 0.0192 5.34 7.8407 0.9993 3178430 Maybridge4_000340 COc1ccccc1N2CC(C)(C)C(=O)N(C(=O)c3ccc(C)cc3)C2=S 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 P11 compound treatment 0.096 0.0253 6.52 0.1 0.0262 7.29 9.7653 0.9984 1567114 Maybridge4_000341 Brc1ccc(COn2c(nc3ccccc3c2=O)c4ccccc4)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 P12 compound treatment 0.138 0.0673 17.33 0.14 0.0662 18.43 25.2888 0.9995 1250229 Maybridge4_000342 CCCCN1C(C(=O)N(C1=O)c2nnc(s2)C(C)(C)C)c3ccc(Cl)c(Cl)c3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 P13 compound treatment 0.079 0.00831 2.14 0.077 0.00319 0.89 2.1411 0.9241 3063196 Maybridge4_000343 COC(=O)/C=c/1\sc2nc3cc(Cl)c(Cl)cc3n2c1=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 P14 compound treatment 0.071 3.12E-4 0.08 0.073 -8.13E-4 -0.23 -0.1031 -0.4293 3178431 Maybridge4_000344 FC(F)(F)c1ccc(nc1)S(=O)(=O)CCOC(=O)c2ccc(Cl)c(Cl)c2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 P15 compound treatment 0.118 0.0473 12.18 0.123 0.0492 13.7 18.2999 0.9983 3063197 Maybridge4_000345 CC(C)(C)SCCNc1nc(Oc2ccc(F)cc2)nc(Oc3ccc(F)cc3)n1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 P16 compound treatment 0.085 0.0143 3.69 0.086 0.0122 3.39 5.0057 0.9992 3178432 Maybridge4_000346 N=C1CC(=O)N=C2SC(=NN21)C3CC3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 P17 compound treatment 0.074 0.00331 0.85 0.078 0.00419 1.17 1.4277 0.9882 3063198 Maybridge4_000347 COC(=O)/C(=C/N(C)C)/Sc1cc(C)c(Cl)cc1Cl 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 P18 compound treatment 0.166 0.0953 24.54 0.17 0.0962 26.79 36.2942 0.999 3178433 Maybridge4_000348 CSc1nc(C)nc(Sc2ccccc2)c1C#N 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 P19 compound treatment 0.073 0.00231 0.6 0.075 0.00119 0.33 0.6549 0.9615 3178434 Maybridge4_000349 Cc1cc(Oc2nc3cc(Cl)ccc3s2)c4cc(Cl)ccc4n1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 P20 compound treatment 0.127 0.0563 14.5 0.127 0.0532 14.81 20.7261 0.9999 1222979 Maybridge4_000350 CSC1=NN(C)c2cnn(C)c(=O)c2S1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 P21 compound treatment 0.074 0.00331 0.85 0.077 0.00319 0.89 1.2308 0.9998 1579106 Maybridge4_000351 O=C(CC#N)NCc1ccccn1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 P22 compound treatment 0.133 0.0623 16.04 0.132 0.0582 16.2 22.8031 1.0 1689187 Maybridge4_000352 Clc1ccc(SCC(=O)c2ccc3NC(=O)CCc3c2)c(Cl)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 P23 mock treatment 0.073 0.00231 0.6 0.078 0.00419 1.17 1.2456 0.9513 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2049 P24 positive control 0.077 0.00631 1.63 0.082 0.00819 2.28 2.7616 0.9862 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 A01 compound treatment 0.085 0.0158 4.07 0.078 0.00781 2.18 4.4173 0.9569 3063199 Maybridge4_000353 O=C1CCc2cc(ccc2N1)C3=CSC4=NCCN34 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 A02 compound treatment 0.077 0.00781 2.01 0.077 0.00681 1.9 2.7639 0.9996 3178435 Maybridge4_000354 CC1(C)OC(=O)C(C2C3CC4CC(C3)CC2C4)C(=O)O1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 A03 compound treatment 0.094 0.0248 6.39 0.094 0.0238 6.63 9.2066 0.9998 3178436 Maybridge4_000355 Cc1nc(cs1)c2cc(C#N)c(SCCNC(=O)c3ccc(Cl)cc3Cl)nc2C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 A04 compound treatment 0.186 0.117 30.08 0.197 0.127 35.32 46.2393 0.9968 1602887 Maybridge4_000356 CC1(C)Oc2c(C=C1)c3c(=O)cc(oc3c4ccoc24)c5ccccc5 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 A05 compound treatment 0.074 0.00481 1.24 0.074 0.00381 1.06 1.6269 0.997 3063200 Maybridge4_000357 COc1cc(OC)nc(/N=C/N(C)C)n1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 A06 compound treatment 0.075 0.00581 1.5 0.076 0.00581 1.62 2.2028 0.9992 3178437 Maybridge4_000358 CC1(C)CN=C(NC2CCCCC2)S1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 A07 compound treatment 0.075 0.00581 1.5 0.076 0.00581 1.62 2.2028 0.9992 3178438 Maybridge4_000359 COc1ccc(CCC(=O)CCc2ccc(OC)cc2)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 A08 compound treatment 0.075 0.00581 1.5 0.074 0.00381 1.06 1.809 0.9859 3063201 Maybridge4_000360 COc1ccccc1OC(=O)NC(C)C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 A09 compound treatment 0.077 0.00781 2.01 0.079 0.00881 2.45 3.1577 0.9951 3178439 Maybridge4_000361 CCOC(=O)c1ccc(cc1)C(=S)N2CCCC2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 A10 compound treatment 0.083 0.0138 3.56 0.083 0.0128 3.57 5.0378 1.0 1174208 Maybridge4_000362 CCC1(CCCCN(C)C1=O)c2cccc(OC(=O)C3CCCCC3)c2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 A11 compound treatment 0.074 0.00481 1.24 0.075 0.00481 1.34 1.8239 0.9992 3063202 Maybridge4_000363 CN(C)Cc1c(C)cc(C)cc1O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 A12 compound treatment 0.156 0.0868 22.35 0.154 0.0838 23.34 32.3097 0.9998 1469863 Maybridge4_000364 O=C(Nc1nc(cs1)c2ccccc2)C3(CC4CC5CC(C4)C3)C5 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 A13 compound treatment 0.09 0.0208 5.36 0.087 0.0168 4.68 7.0999 0.9977 1002608 Maybridge4_000365 CCOC(=O)c1cnc(S)nc1O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 A14 compound treatment 0.072 0.00281 0.72 0.072 0.00181 0.5 0.869 0.9844 1583969 Maybridge4_000366 Clc1cccc(c1)C(=O)NC2CN3CCC2CC3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 A15 compound treatment 0.163 0.0938 24.15 0.165 0.0948 26.4 35.7503 0.999 3063203 Maybridge4_000367 COc1cc(C#N)c2ccc3ccccc3c2c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 A16 compound treatment 0.068 -0.00119 -0.31 0.072 0.00181 0.5 0.1407 0.2385 3178440 Maybridge4_000368 CCNC(=Nc1ccc(Cl)cc1)NCC 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 A17 compound treatment 0.097 0.0278 7.16 0.094 0.0238 6.63 9.7528 0.9993 1368926 Maybridge4_000369 CC(=O)OCc1ccccc1Sc2ccccc2C(=O)Nc3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 A18 compound treatment 0.086 0.0168 4.33 0.088 0.0178 4.96 6.5686 0.9977 1219932 Maybridge4_000370 C1C=C(Nc2nnnn12)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 A19 compound treatment 0.086 0.0168 4.33 0.099 0.0288 8.02 8.7348 0.958 1528436 Maybridge4_000371 Cn1c(nc2ccccc12)N3C(=O)c4cccc5cccc(C3=O)c45 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 A20 compound treatment 0.071 0.00181 0.47 0.071 8.12E-4 0.23 0.49 0.9448 1375750 Maybridge4_000372 CC1(CC2CC3(C)C1)CC(C2)(C3)C(=O)NN 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 A21 compound treatment 0.088 0.0188 4.84 0.089 0.0188 5.24 7.1296 0.9992 1405005 Maybridge4_000373 O=c1nc2sc3ccccc3n2c(=O)n1c4ccccc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 A22 compound treatment 0.071 0.00181 0.47 0.072 0.00181 0.5 0.6869 0.9992 3063251 Maybridge4_000374 C/S(=N\S(=O)(=O)c1ccc(Cl)cc1)/c2ccccc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 A23 mock treatment 0.072 0.00281 0.72 0.072 0.00181 0.5 0.869 0.9844 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 A24 positive control 0.074 0.00481 1.24 0.075 0.00481 1.34 1.8239 0.9992 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 B01 compound treatment 0.076 0.00681 1.75 0.074 0.00381 1.06 1.9911 0.9711 3063252 Maybridge4_000375 C1CN(C1)C(c2ccccc2)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 B02 compound treatment 0.079 0.00981 2.53 0.08 0.00981 2.73 3.7188 0.9992 3063253 Maybridge4_000376 CC1CCC(C)N1c2cc(cc(c2)C(F)(F)F)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 B03 compound treatment 0.074 0.00481 1.24 0.074 0.00381 1.06 1.6269 0.997 3063254 Maybridge4_000377 Cc1ccc(cc1)S(=O)(=O)C[C@H]2O[C@H](C[C@@H]2O)n3cc(I)c(=O)[nH]c3=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 B04 compound treatment 0.074 0.00481 1.24 0.078 0.00781 2.18 2.4146 0.9644 3063255 Maybridge4_000378 C/C(=N\O)/c1cc(Cl)cc(Cl)c1O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 B05 compound treatment 0.069 -1.87E-4 -0.05 0.071 8.12E-4 0.23 0.1259 0.544 3063256 Maybridge4_000379 CCN(CC)Cc1c(C)c(C)c(C)c(C)c1C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 B06 compound treatment 0.136 0.0668 17.2 0.134 0.0638 17.77 24.7301 0.9999 3178441 Maybridge4_000380 Oc1c(Cl)cc(Cl)cc1C2Nc3cc(ccc3-n4cccc24)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 B07 compound treatment 0.096 0.0268 6.9 0.094 0.0238 6.63 9.5707 0.9998 1227211 Maybridge4_000381 CCC(C)(C)NC(=S)Nc1cccc(OC)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 B08 compound treatment 0.181 0.112 28.79 0.212 0.142 39.49 48.2828 0.9879 3178442 Maybridge4_000382 Cc1c(C)c(C)c2[nH]c(SCc3nc(no3)c4ccc(Cl)cc4)nc2c1C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 B09 compound treatment 0.135 0.0658 16.94 0.148 0.0778 21.67 27.305 0.9926 3063257 Maybridge4_000383 CSC1=C(C#N)C(=O)NC(S1)c2ccc(Cl)cc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 B10 compound treatment 0.074 0.00481 1.24 0.074 0.00381 1.06 1.6269 0.997 3178443 Maybridge4_000384 C/C(=N\Cc1ccccc1)/c2c(C)cc(C)cc2O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 B11 compound treatment 0.084 0.0148 3.81 0.076 0.00581 1.62 3.8414 0.9272 1417340 Maybridge4_000385 COc1cc(cc(OC)c1OC)C2Nc3ccccc3S2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 B12 compound treatment 0.072 0.00281 0.72 0.073 0.00281 0.78 1.0659 0.9992 1464378 Maybridge4_000386 N#CC1CN(CCc2ccccc2)CN(CCc3ccccc3)C1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 B13 compound treatment 0.07 8.13E-4 0.21 0.074 0.00381 1.06 0.8987 0.8305 1213608 Maybridge4_000387 COc1cc(CO)c(CC(=O)NN)cc1OC 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 B14 compound treatment 1.247 1.18 303.25 1.248 1.18 328.01 446.3715 0.9992 1103050 Maybridge4_000388 CC1(C)OC(=O)C(=Cc2ccc[nH]2)C(=O)O1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 B15 compound treatment 0.217 0.148 38.06 0.208 0.138 38.38 54.0493 1.0 1559616 Maybridge4_000389 COc1cc(OC)cc(c1)c2nc(N)c3c(C)c(sc3n2)c4ccc(OC)c(OC)c4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 B16 compound treatment 0.069 -1.87E-4 -0.05 0.072 0.00181 0.5 0.3228 0.6366 1513039 Maybridge4_000390 Cc1onc(c1NC(=O)N2CCCC2=O)c3c(Cl)cccc3Cl 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 B17 compound treatment 0.069 -1.87E-4 -0.05 0.073 0.00281 0.78 0.5197 0.6623 1918178 Maybridge4_000391 Cc1ccc(NC(=O)C2C(C3CC2C=C3)C(=O)O)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 B18 compound treatment 0.068 -0.00119 -0.31 0.071 8.12E-4 0.23 -0.0562 -0.1477 3178444 Maybridge4_000392 CS/C(=N\c1ccccc1C(F)(F)F)/N2CCCC2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 B19 compound treatment 0.168 0.0988 25.44 0.17 0.0998 27.8 37.6452 0.999 3178445 Maybridge4_000393 CCOC(=O)c1nc2ccccc2c(=O)n1/N=C/c3cc(Cl)cc(Cl)c3O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 B20 compound treatment 0.105 0.0358 9.22 0.083 0.0128 3.57 9.0431 0.9146 3063259 Maybridge4_000394 Cc1c(C)c(C)c(c(C)c1C)S(=O)(=O)N2CCCC2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 B21 compound treatment 0.069 -1.87E-4 -0.05 0.07 -1.87E-4 -0.05 -0.0711 -0.9992 3063260 Maybridge4_000395 CSC(=NS(=O)(=O)c1ccccc1)SC 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 B22 compound treatment 0.068 -0.00119 -0.31 0.069 -0.00119 -0.33 -0.45 -0.9992 1232359 Maybridge4_000396 Cc1onc(c1C(=O)ON2C(=O)CCC2=O)c3c(Cl)cccc3Cl 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 B23 mock treatment 0.069 -1.87E-4 -0.05 0.07 -1.87E-4 -0.05 -0.0711 -0.9992 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 B24 positive control 0.073 0.00381 0.98 0.073 0.00281 0.78 1.2479 0.9937 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 C01 compound treatment 0.076 0.00681 1.75 0.073 0.00281 0.78 1.7941 0.934 3063261 Maybridge4_000397 CN(C(=O)COc1cc(n(C)n1)C(F)(F)F)c2ccccc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 C02 compound treatment 0.086 0.0168 4.33 0.091 0.0208 5.8 7.1594 0.9897 1015362 Maybridge4_000398 CCOC(=O)c1cccc2C(=O)c3ccccc3-c21 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 C03 compound treatment 0.188 0.119 30.59 0.19 0.12 33.37 45.2249 0.9991 1410184 Maybridge4_000399 Cc1ccc(Oc2ncccc2NC(=O)c3ccc(Cl)cc3Cl)c4CCCc41 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 C04 compound treatment 0.069 -1.87E-4 -0.05 0.071 8.12E-4 0.23 0.1259 0.544 1430911 Maybridge4_000400 OC(=O)CCC(=O)c1ccc2OCCCOc2c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 C05 compound treatment 0.071 0.00181 0.47 0.071 8.12E-4 0.23 0.49 0.9448 3063262 Maybridge4_000401 COc1cc(OC)nc(N/C=N/O)n1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 C06 compound treatment 0.095 0.0258 6.65 0.094 0.0238 6.63 9.3887 1.0 1594886 Maybridge4_000402 Cn1c(=O)cc(Nc2ccccc2)c3c(=O)n(c4ccccc4)c(=O)n(c5ccccc5)c13 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 C07 compound treatment 0.092 0.0228 5.87 0.092 0.0218 6.07 8.4486 0.9999 3063263 Maybridge4_000403 OC(=O)c1cc(=O)c2c(O)cccc2o1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 C08 compound treatment 0.073 0.00381 0.98 0.073 0.00281 0.78 1.2479 0.9937 3063264 Maybridge4_000404 CC(C)NC(=O)Oc1cccc(Cl)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 C09 compound treatment 0.07 8.13E-4 0.21 0.072 0.00181 0.5 0.5048 0.924 3178446 Maybridge4_000405 COC(=O)c1ccc(cc1)C(=O)NN 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 C10 compound treatment 0.095 0.0258 6.65 0.101 0.0308 8.58 10.7671 0.992 1676301 Maybridge4_000406 COC(=O)C1C(NC(C(C(=O)OC)S1(=O)=O)c2ccccc2)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 C11 compound treatment 0.094 0.0248 6.39 0.093 0.0228 6.35 9.0097 1.0 3063265 Maybridge4_000407 O=C1CC(=NN1)c2ccccc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 C12 compound treatment 0.102 0.0328 8.45 0.104 0.0338 9.42 12.6323 0.9985 1343081 Maybridge4_000408 CC(C1CC1)N(C(=O)c2cc(C)c(Cl)cc2Cl)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 C13 compound treatment 0.243 0.174 44.75 0.242 0.172 47.85 65.4782 0.9994 1138226 Maybridge4_000409 COc1ccc2c(c1)nnc3n[nH]c(=O)n32 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 C14 compound treatment 0.07 8.13E-4 0.21 0.067 -0.00319 -0.89 -0.4798 -0.5261 1419670 Maybridge4_000410 OC(=O)CNC(=O)CSc1ccc(Cl)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 C15 compound treatment 0.072 0.00281 0.72 0.072 0.00181 0.5 0.869 0.9844 3063266 Maybridge4_000411 CC1=C(C#N)C(C(=C(C)N1)C#N)c2ccccc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 C16 compound treatment 0.086 0.0168 4.33 0.084 0.0138 3.85 5.7809 0.9983 3178530 Maybridge4_000412 CCC1(CCCCN(C)C1=O)c2cccc(OC(=O)Nc3ccc(OC(F)(F)F)cc3)c2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 C17 compound treatment 0.114 0.0448 11.54 0.117 0.0468 13.04 17.377 0.9981 1346230 Maybridge4_000413 N#Cc1cccc2cccc(Sc3ccccc3)c12 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 C18 compound treatment 0.07 8.13E-4 0.21 0.075 0.00481 1.34 1.0956 0.8077 1555561 Maybridge4_000414 COc1ccc(OC)c(CCCc2cc(OC)ccc2OC)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 C19 compound treatment 0.065 -0.00419 -1.08 0.068 -0.00219 -0.61 -1.1931 -0.9635 3063267 Maybridge4_000415 CCN(CC)C(=O)Nc1ccc(OC)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 C20 compound treatment 0.472 0.403 103.71 0.492 0.422 117.47 156.4009 0.9981 1920088 Maybridge4_000416 S=c1nc(c2ccco2)n(Cc3ccccc3)c(=S)n1/C(=N/Cc4ccccc4)/c5ccco5 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 C21 compound treatment 0.092 0.0228 5.87 0.091 0.0208 5.8 8.2517 1.0 3178531 Maybridge4_000417 FC(F)(F)c1cccc(c1)c2nc3ccccn3n2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 C22 compound treatment 0.183 0.114 29.3 0.187 0.117 32.53 43.7238 0.9986 3178532 Maybridge4_000418 O=C(/C=C\1/NN=C(NC1=O)c2ccccc2)c3cccs3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 C23 mock treatment 0.068 -0.00119 -0.31 0.069 -0.00119 -0.33 -0.45 -0.9992 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 C24 positive control 0.075 0.00581 1.5 0.076 0.00581 1.62 2.2028 0.9992 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 D01 compound treatment 0.074 0.00481 1.24 0.075 0.00481 1.34 1.8239 0.9992 3178533 Maybridge4_000419 CC1(C)C2(C)CCC1(OC2=O)C(=O)N3NC(=O)[C@H]([C@@H]3c4ccccc4)c5ccccc5 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 D02 compound treatment 0.088 0.0188 4.84 0.09 0.0198 5.52 7.3266 0.9979 3063268 Maybridge4_000420 FC(F)(F)c1cc(c(Br)c(c1Br)n2cccc2)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 D03 compound treatment 0.121 0.0518 13.34 0.11 0.0398 11.09 17.273 0.9958 1316662 Maybridge4_000421 Clc1ccc(NC(=S)NC(Cn2ccnc2)c3ccccc3)c(Cl)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 D04 compound treatment 0.074 0.00481 1.24 0.071 8.12E-4 0.23 1.0362 0.8226 1725083 Maybridge4_000422 Cc1c(N)c2c(cc1N3CCCC3)C(C)(C)CC2(C)C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 D05 compound treatment 0.161 0.0918 23.64 0.158 0.0878 24.46 34.0077 0.9999 1718122 Maybridge4_000423 C1c2sc(Nc3ccccc3)nc2-c4ccccc14 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 D06 compound treatment 0.078 0.00881 2.27 0.08 0.00981 2.73 3.5367 0.9957 3178534 Maybridge4_000424 FC(F)(F)c1cc(cc(c1)S(=O)(=O)N=C2NCCCN2)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 D07 compound treatment 0.072 0.00281 0.72 0.073 0.00281 0.78 1.0659 0.9992 1138900 Maybridge4_000425 CC(C)(C)NC(=O)NCc1ccncc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 D08 compound treatment 0.07 8.13E-4 0.21 0.071 8.12E-4 0.23 0.3079 0.9992 3178535 Maybridge4_000426 FC(F)(F)c1cc(NCN2C(=O)CCC2=O)cc(c1)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 D09 compound treatment 0.083 0.0138 3.56 0.087 0.0168 4.68 5.8255 0.9908 3178536 Maybridge4_000427 COc1cccc(NC2=C(C#N)C(=O)NC(S2)c3cccc(OC)c3O)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 D10 compound treatment 0.07 8.13E-4 0.21 0.07 -1.87E-4 -0.05 0.111 0.5148 3063269 Maybridge4_000428 Clc1ccc(cc1)S(=O)(=O)CS(=O)(=O)c2ccc(Cl)cc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 D11 compound treatment 0.178 0.109 28.02 0.182 0.112 31.14 41.8289 0.9986 1023491 Maybridge4_000429 Oc1ccc(Br)cc1C2Nc3ccccc3S2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 D12 compound treatment 0.071 0.00181 0.47 0.072 0.00181 0.5 0.6869 0.9992 3178537 Maybridge4_000430 C/C(=N\O)/c1nnn(c1C)c2cc(cc(c2)C(F)(F)F)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 D13 compound treatment 0.068 -0.00119 -0.31 0.071 8.12E-4 0.23 -0.0562 -0.1477 1381610 Maybridge4_000431 CC1(C)C2CCC(C2)C1(C)NC(=S)NCC3CCCO3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 D14 compound treatment 0.09 0.0208 5.36 0.09 0.0198 5.52 7.6907 0.9999 3178538 Maybridge4_000432 FC(F)(F)c1cccc(CS(=O)(=O)Cc2cccc(c2)C(F)(F)F)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 D15 compound treatment 0.068 -0.00119 -0.31 0.069 -0.00119 -0.33 -0.45 -0.9992 1650135 Maybridge4_000433 Cc1c(C)c(C)c(C(=O)c2ccccc2C(=O)NCc3cccnc3)c(C)c1C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 D16 compound treatment 0.08 0.0108 2.78 0.078 0.00781 2.18 3.507 0.9926 1002759 Maybridge4_000434 OC(C(O)C(O)c1nc2ccccc2[nH]1)C(O)c3nc4ccccc4[nH]3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 D17 compound treatment 0.117 0.0478 12.31 0.11 0.0398 11.09 16.5448 0.9986 1658002 Maybridge4_000435 Cc1c(C)c(C)c(CSC2CC(=O)N(C2=O)c3ccccc3)c(C)c1C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 D18 compound treatment 0.08 0.0108 2.78 0.086 0.0158 4.4 5.0824 0.9755 3062531 Maybridge4_000436 Clc1ccc(cc1Cl)S(=O)(=O)NC(=N)c2ccccn2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 D19 compound treatment 0.067 -0.00219 -0.56 0.072 0.00181 0.5 -0.0413 -0.0546 2117992 Maybridge4_000437 COc1cccc(/C=N/O)c1O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 D20 compound treatment 0.083 0.0138 3.56 0.088 0.0178 4.96 6.0224 0.9867 1204180 Maybridge4_000438 Clc1ccc(cc1Cl)S(=O)(=O)NCCc2c[nH]c3ccccc23 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 D21 compound treatment 0.067 -0.00219 -0.56 0.067 -0.00319 -0.89 -1.026 -0.9759 3062533 Maybridge4_000439 CS/C(=N\S(=O)(=O)c1ccccc1)/N2CCCC2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 D22 compound treatment 0.067 -0.00219 -0.56 0.068 -0.00219 -0.61 -0.829 -0.9992 1417838 Maybridge4_000440 COC(=O)CC1(Oc2ccc(Br)cc2C(=O)N1c3ccc(F)cc3F)C(=O)OC 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 D23 mock treatment 0.068 -0.00119 -0.31 0.071 8.12E-4 0.23 -0.0562 -0.1477 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 D24 positive control 0.075 0.00581 1.5 0.076 0.00581 1.62 2.2028 0.9992 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 E01 compound treatment 0.102 0.0328 8.45 0.101 0.0308 8.58 12.0415 1.0 3062534 Maybridge4_000441 Cn1nc(OC(C)(C)C(=O)Oc2ccc(Cl)cc2Cl)cc1C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 E02 compound treatment 0.069 -1.87E-4 -0.05 0.069 -0.00119 -0.33 -0.268 -0.8018 1024184 Maybridge4_000442 CCC(=O)c1ccc(OC)cc1OC 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 E03 compound treatment 0.074 0.00481 1.24 0.076 0.00581 1.62 2.0208 0.9913 1519339 Maybridge4_000443 Cc1ccc(Oc2ncccc2NC(=O)CSc3ccccn3)c4CCCc41 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 E04 compound treatment 0.068 -0.00119 -0.31 0.068 -0.00219 -0.61 -0.647 -0.9492 3062535 Maybridge4_000444 Cc1cc(=O)n(CCO)c(=O)[nH]1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 E05 compound treatment 0.071 0.00181 0.47 0.071 8.12E-4 0.23 0.49 0.9448 3178539 Maybridge4_000445 OC(=O)CC(C(=O)Nc1cc(cc(c1)C(F)(F)F)C(F)(F)F)C2=CCCCC2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 E06 compound treatment 0.07 8.13E-4 0.21 0.071 8.12E-4 0.23 0.3079 0.9992 1643916 Maybridge4_000446 O=C(N1CCCCC1)c2cccc3Cc4ccccc4-c32 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 E07 compound treatment 0.073 0.00381 0.98 0.075 0.00481 1.34 1.6418 0.9883 3178540 Maybridge4_000447 OC(=O)c1oc(C(=O)O)c(OCc2ccccc2)c1OCc3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 E08 compound treatment 0.071 0.00181 0.47 0.074 0.00381 1.06 1.0808 0.9319 3062536 Maybridge4_000448 O=C(Oc1ccccc1)N2CCCC2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 E09 compound treatment 0.071 0.00181 0.47 0.074 0.00381 1.06 1.0808 0.9319 1039079 Maybridge4_000449 OC(=O)c1cccc(Cl)c1C(=O)O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 E10 compound treatment 0.067 -0.00219 -0.56 0.068 -0.00219 -0.61 -0.829 -0.9992 1423015 Maybridge4_000450 CC(=O)N[C@@H](Cc1ccccc1)C(=O)NN 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 E11 compound treatment 0.07 8.13E-4 0.21 0.067 -0.00319 -0.89 -0.4798 -0.5261 3178542 Maybridge4_000451 OC(Cn1ccccc1=N)c2ccccc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 E12 compound treatment 0.07 8.13E-4 0.21 0.071 8.12E-4 0.23 0.3079 0.9992 3062537 Maybridge4_000452 CC(C1CC1)N(C(=O)C)c2ccccc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 E13 compound treatment 0.072 0.00281 0.72 0.074 0.00381 1.06 1.2628 0.9826 1704451 Maybridge4_000453 CN(C)C(=O)c1cccc2C(=O)c3ccccc3-c21 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 E14 compound treatment 0.071 0.00181 0.47 0.068 -0.00219 -0.61 -0.1008 -0.1313 3178543 Maybridge4_000454 CC(C)(C)C(=O)Nc1ccn([C@H]2C[C@H](O)[C@@H](COC(=O)C(C)(C)C)O2)c(=O)n1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 E15 compound treatment 0.26 0.191 49.13 0.267 0.197 54.81 73.4963 0.9985 3062540 Maybridge4_000455 COc1ccc2c(OC)ccc3C(=O)C=Cc1c32 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 E16 compound treatment 0.075 0.00581 1.5 0.073 0.00281 0.78 1.6121 0.9544 1289531 Maybridge4_000456 Clc1ccc(cc1)C(=O)OC2CN3CCC2CC3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 E17 compound treatment 0.072 0.00281 0.72 0.071 8.12E-4 0.23 0.672 0.8858 1672892 Maybridge4_000457 CNC(=O)c1ccccc1S(=O)c2cccc3cccc(C(=O)O)c23 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 E18 compound treatment 0.083 0.0138 3.56 0.094 0.0238 6.63 7.204 0.9573 3062541 Maybridge4_000458 COc1ccc(OC)c(CCCCc2cc(OC)ccc2OC)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 E19 compound treatment 0.1 0.0308 7.93 0.099 0.0288 8.02 11.2836 1.0 3178544 Maybridge4_000459 Clc1ccc(S/C=C/C(=O)c2ccccc2)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 E20 compound treatment 0.091 0.0218 5.62 0.09 0.0198 5.52 7.8727 1.0 3062542 Maybridge4_000460 C/C(=N\O)/C1(CC2(C)CC3(C)CC(C)(C2)C1)C3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 E21 compound treatment 0.068 -0.00119 -0.31 0.068 -0.00219 -0.61 -0.647 -0.9492 3178545 Maybridge4_000461 CC(=O)OC[C@H]1O[C@@H](Nc2ccc(C)cc2)[C@H](OC(=O)C)[C@@H](OC(=O)C)[C@@H]1OC(=O)C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 E22 compound treatment 0.068 -0.00119 -0.31 0.071 8.12E-4 0.23 -0.0562 -0.1477 3062543 Maybridge4_000462 CC1(C)N(O)C(NC1=S)c2ccccc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 E23 mock treatment 0.068 -0.00119 -0.31 0.068 -0.00219 -0.61 -0.647 -0.9492 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 E24 positive control 0.076 0.00681 1.75 0.078 0.00781 2.18 2.7788 0.9943 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 F01 compound treatment 0.138 0.0688 17.72 0.14 0.0698 19.44 26.2757 0.9989 3178546 Maybridge4_000463 Fc1ccc2CC(=O)C(Cc2c1)C3=Cc4ccc(F)cc4CC3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 F02 compound treatment 0.071 0.00181 0.47 0.073 0.00281 0.78 0.8838 0.9694 1526672 Maybridge4_000464 COc1ccc(CCNC(=O)c2nc3ccccc3c(=O)n2n4cccc4)cc1OC 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 F03 compound treatment 0.076 0.00681 1.75 0.071 8.12E-4 0.23 1.4003 0.7918 3062544 Maybridge4_000465 CC(OC(=O)c1cccc(Cl)c1)c2ccc[n+](C)c2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 F04 compound treatment 0.144 0.0748 19.26 0.155 0.0848 23.62 30.322 0.9949 1352177 Maybridge4_000466 CSc1cccc(NC(=S)Nc2cc3c(c(N)c2C)C(C)(C)CC3(C)C)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 F05 compound treatment 0.107 0.0378 9.74 0.107 0.0368 10.25 14.1334 0.9997 3062545 Maybridge4_000467 CC(C=C1C(=O)NC(=O)NC1=O)c2ccccc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 F06 compound treatment 0.071 0.00181 0.47 0.075 0.00481 1.34 1.2777 0.9003 3062546 Maybridge4_000468 SC1=NC2(CCCC2)NN1c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 F07 compound treatment 0.073 0.00381 0.98 0.075 0.00481 1.34 1.6418 0.9883 3178547 Maybridge4_000469 C(c1ccc(/N=C/c2ccccn2)cc1)c3ccc(/N=C/c4ccccn4)cc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 F08 compound treatment 0.071 0.00181 0.47 0.073 0.00281 0.78 0.8838 0.9694 1528873 Maybridge4_000470 O=C1CCC(=O)N1CNc2ccccn2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 F09 compound treatment 0.072 0.00281 0.72 0.073 0.00281 0.78 1.0659 0.9992 1318293 Maybridge4_000471 CC(C)(C)C(=O)Nc1ccccc1C(=O)NCc2cccnc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 F10 compound treatment 0.135 0.0658 16.94 0.137 0.0668 18.61 25.1388 0.9989 3178548 Maybridge4_000472 Clc1ccc(SCc2ccc(NC(=O)Nc3cccc(Cl)c3)o2)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 F11 compound treatment 0.155 0.0858 22.09 0.158 0.0878 24.46 32.9154 0.9987 3062547 Maybridge4_000473 NC(=N)Nc1nc(cs1)c2ccc(cc2)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 F12 compound treatment 0.193 0.124 31.88 0.187 0.117 32.53 45.5444 0.9999 3178625 Maybridge4_000474 CS/C(=C(/C#N)\C(=O)c1cccs1)/Nc2cccc(Cl)c2Cl 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 F13 compound treatment 0.068 -0.00119 -0.31 0.073 0.00281 0.78 0.3377 0.4016 3178626 Maybridge4_000475 OC(Cc1ccccc1)(c2ccccc2)c3ccccc3NC(=S)NC4CC5CC4C=C5 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 F14 compound treatment 0.071 0.00181 0.47 0.067 -0.00319 -0.89 -0.2977 -0.2969 3062548 Maybridge4_000476 Cc1nnsc1C(=O)Nc2cccnc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 F15 compound treatment 0.068 -0.00119 -0.31 0.068 -0.00219 -0.61 -0.647 -0.9492 1004988 Maybridge4_000477 ON=C(Cc1ccccc1)Cc2ccccc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 F16 compound treatment 0.075 0.00581 1.5 0.074 0.00381 1.06 1.809 0.9859 3178627 Maybridge4_000478 Cc1onc(c1C(=O)NC(=S)N2CCOCC2)c3c(Cl)cccc3Cl 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 F17 compound treatment 0.123 0.0538 13.86 0.11 0.0398 11.09 17.6371 0.9939 3062549 Maybridge4_000479 NC(=O)Nc1ccc(cc1)/C(=C/c2ccncc2)/C#N 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 F18 compound treatment 0.15 0.0808 20.81 0.159 0.0888 24.73 32.202 0.9963 3062550 Maybridge4_000480 CN(C)C(=S)SCc1c(C)c(C)c(C)c(C)c1C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 F19 compound treatment 0.115 0.0458 11.8 0.126 0.0558 15.54 19.3314 0.9907 3178628 Maybridge4_000481 COc1ccc(cc1)n2c(CC#N)nnc2SCc3c(C)c(C)c(C)c(C)c3C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 F20 compound treatment 0.153 0.0838 21.58 0.16 0.0898 25.01 32.9451 0.9973 3178629 Maybridge4_000482 CC1(C)ON(C(=N1)NC(=O)NC(=O)c2ccccc2Cl)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 F21 compound treatment 0.067 -0.00219 -0.56 0.067 -0.00319 -0.89 -1.026 -0.9759 3062551 Maybridge4_000483 O=S(=O)(/N=C/1\NCC2CCCC2N1)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 F22 compound treatment 0.113 0.0438 11.28 0.111 0.0408 11.37 16.0134 1.0 3178630 Maybridge4_000484 CC(CO)(CO)NC(=S)Nc1ccc(F)c(Cl)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 F23 mock treatment 0.068 -0.00119 -0.31 0.068 -0.00219 -0.61 -0.647 -0.9492 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 F24 positive control 0.075 0.00581 1.5 0.078 0.00781 2.18 2.5967 0.9833 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 G01 compound treatment 0.077 0.00781 2.01 0.072 0.00181 0.5 1.7793 0.8579 1441207 Maybridge4_000485 CC(C)(C)c1cc2[nH]c(=N)[nH]c(=N)n2n1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 G02 compound treatment 0.139 0.0698 17.97 0.141 0.0708 19.72 26.6547 0.9989 1390371 Maybridge4_000486 O=c1c(Cc2ccccc2OCc3ccccc3)coc4ccccc14 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 G03 compound treatment 0.072 0.00281 0.72 0.068 -0.00219 -0.61 0.0813 0.0859 3062552 Maybridge4_000487 COc1ccccc1C2OC(=O)C[C@H]2C(=O)NN 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 G04 compound treatment 0.118 0.0488 12.57 0.132 0.0618 17.21 21.0592 0.988 1630105 Maybridge4_000488 Brc1ccc(cc1)C(=O)c2cc3OCCCOc3cc2Br 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 G05 compound treatment 0.072 0.00281 0.72 0.07 -1.87E-4 -0.05 0.4751 0.6544 1255736 Maybridge4_000489 COc1cc(OC)nc(NCC(NC(=O)c2ccccc2)C(=O)N)n1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 G06 compound treatment 0.07 8.13E-4 0.21 0.07 -1.87E-4 -0.05 0.111 0.5148 1191076 Maybridge4_000490 CNc1cc(=O)n(c2ccccc2)c(=O)n1c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 G07 compound treatment 0.074 0.00481 1.24 0.076 0.00581 1.62 2.0208 0.9913 1024944 Maybridge4_000491 CCOC(=O)c1oc(C(=O)OCC)c(O)c1O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 G08 compound treatment 0.121 0.0518 13.34 0.124 0.0538 14.99 20.0299 0.9983 3062592 Maybridge4_000492 CC(C)(C)c1ccc2cc(C#N)c(C#N)cc2c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 G09 compound treatment 0.077 0.00781 2.01 0.081 0.0108 3.01 3.5516 0.9808 3062593 Maybridge4_000493 O=C1N(CCCCN2C(=O)c3ccccc3S2(=O)=O)S(=O)(=O)c4ccccc14 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 G10 compound treatment 0.1 0.0308 7.93 0.105 0.0348 9.7 12.4651 0.995 3062594 Maybridge4_000494 Cc1ccc(NC(=O)N(C2=NCC(C)(C)S2)c3ccc(F)c(Cl)c3)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 G11 compound treatment 0.069 -1.87E-4 -0.05 0.067 -0.00319 -0.89 -0.6618 -0.7445 1051499 Maybridge4_000495 CC(O)c1ccc2ccccc2c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 G12 compound treatment 0.086 0.0168 4.33 0.089 0.0188 5.24 6.7655 0.9955 1332464 Maybridge4_000496 OCCOC(=O)c1cccc2C(=O)c3ccccc3-c21 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 G13 compound treatment 0.075 0.00581 1.5 0.078 0.00781 2.18 2.5967 0.9833 1397918 Maybridge4_000497 CCCN(CCC)C(=O)c1cccc2C(=O)c3ccccc3-c21 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 G14 compound treatment 0.072 0.00281 0.72 0.069 -0.00119 -0.33 0.2782 0.3495 3178631 Maybridge4_000498 CC(C)(C)C(=O)OC[C@H]1O[C@H](C[C@@H]1OC(=O)C(C)(C)C)n2cnc3c(N)ncnc23 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 G15 compound treatment 0.245 0.176 45.27 0.248 0.178 49.52 67.0239 0.999 3062595 Maybridge4_000499 O=C(OC1=CC(=O)c2cccc3cccc1c23)c4ccccc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 G16 compound treatment 0.071 0.00181 0.47 0.07 -1.87E-4 -0.05 0.2931 0.6241 1645132 Maybridge4_000500 O=C(NC1CCN(Cc2cccc3ccccc23)CC1)c4ccccc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 G17 compound treatment 0.071 0.00181 0.47 0.071 8.12E-4 0.23 0.49 0.9448 1430296 Maybridge4_000501 OCc1cccc2cccc(S(=O)c3cccc4cccc(C(=O)O)c34)c12 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 G18 compound treatment 0.135 0.0658 16.94 0.128 0.0578 16.1 23.3665 0.9997 1284168 Maybridge4_000502 Brc1ccc(Cc2csc3ccccc3c2=O)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 G19 compound treatment 0.104 0.0348 8.96 0.104 0.0338 9.42 12.9964 0.9997 3178632 Maybridge4_000503 FC(F)(F)Oc1ccccc1NC(=O)CC(=O)Nc2ccccc2OC(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 G20 compound treatment 0.068 -0.00119 -0.31 0.067 -0.00319 -0.89 -0.8439 -0.8988 1186920 Maybridge4_000504 NNC(=O)C1(CCCC2CCC1)C2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 G21 compound treatment 0.075 0.00581 1.5 0.076 0.00581 1.62 2.2028 0.9992 3062596 Maybridge4_000505 FC1(C(=O)Nc2c(Cl)c(Cl)ccc2C1=O)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 G22 compound treatment 0.067 -0.00219 -0.56 0.067 -0.00319 -0.89 -1.026 -0.9759 3178633 Maybridge4_000506 CC(C)(C)OC(=O)Cn1ccc(=O)[nH]c1=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 G23 mock treatment 0.069 -1.87E-4 -0.05 0.069 -0.00119 -0.33 -0.268 -0.8018 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 G24 positive control 0.076 0.00681 1.75 0.079 0.00881 2.45 2.9757 0.9864 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 H01 compound treatment 0.076 0.00681 1.75 0.071 8.12E-4 0.23 1.4003 0.7918 3178634 Maybridge4_000507 O/N=C(/C1CC2CCC1CC2)\c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 H02 compound treatment 0.088 0.0188 4.84 0.087 0.0168 4.68 6.7358 0.9999 1138209 Maybridge4_000508 N1C(c2cccn2-c3ccccc13)c4cccnc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 H03 compound treatment 0.119 0.0498 12.83 0.119 0.0488 13.59 18.6812 0.9996 1326325 Maybridge4_000509 Cc1c(C)c(C)c(CN2C(=O)c3ccccc3C2=O)c(C)c1C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 H04 compound treatment 0.078 0.00881 2.27 0.078 0.00781 2.18 3.1429 0.9998 3062597 Maybridge4_000510 Cc1c(cc2c(c1n3cccc3)C(C)(C)CC2(C)C)N4CCCC4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 H05 compound treatment 0.162 0.0928 23.9 0.173 0.103 28.63 37.1437 0.996 3178635 Maybridge4_000511 Fc1ccc(cc1)C(=O)CSc2nsc(SCC(=O)c3ccc(F)cc3)c2C#N 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 H06 compound treatment 0.135 0.0658 16.94 0.147 0.0768 21.39 27.108 0.9933 3178636 Maybridge4_000512 CC(C)C1CCC(C)CC1NC(=S)Nc2cccc(F)c2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 H07 compound treatment 0.078 0.00881 2.27 0.076 0.00581 1.62 2.749 0.9863 1248377 Maybridge4_000513 CC1CCCCN1C(=S)Nc2ccc(cc2)S(=O)(=O)N3CCCCC3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 H08 compound treatment 0.1 0.0308 7.93 0.099 0.0288 8.02 11.2836 1.0 3178637 Maybridge4_000514 COc1cccc(OC)c1C(=O)Nc2cc(c(Cl)cc2OC)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 H09 compound treatment 0.07 8.13E-4 0.21 0.071 8.12E-4 0.23 0.3079 0.9992 1054040 Maybridge4_000515 CC(C)C1=NNC(=O)C1(C)C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 H10 compound treatment 0.067 -0.00219 -0.56 0.068 -0.00219 -0.61 -0.829 -0.9992 1253333 Maybridge4_000516 Nc1nc2c(nnn2c3ccccc13)C(=O)N4CCOCC4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 H11 compound treatment 0.069 -1.87E-4 -0.05 0.067 -0.00319 -0.89 -0.6618 -0.7445 1700266 Maybridge4_000517 COc1ccc(CCNC(=S)NCCc2ccccc2)cc1OC 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 H12 compound treatment 0.075 0.00581 1.5 0.075 0.00481 1.34 2.0059 0.9985 3178638 Maybridge4_000518 O/N=C(\C#N)/C(=O)c1ccco1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 H13 compound treatment 0.067 -0.00219 -0.56 0.072 0.00181 0.5 -0.0413 -0.0546 1672819 Maybridge4_000519 CCCN(CCC)S(=O)(=O)c1ccc(cc1)C(=O)NN 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 H14 compound treatment 0.069 -1.87E-4 -0.05 0.068 -0.00219 -0.61 -0.4649 -0.7608 3178639 Maybridge4_000520 Fc1cc(F)c(NC(=S)N2CCOCC2)c(F)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 H15 compound treatment 0.07 8.13E-4 0.21 0.07 -1.87E-4 -0.05 0.111 0.5148 1546700 Maybridge4_000521 Cc1c(C)c(C)c(C(=O)c2ccccc2C(=O)NN)c(C)c1C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 H16 compound treatment 0.098 0.0288 7.42 0.097 0.0268 7.47 10.5256 1.0 3062598 Maybridge4_000522 Fc1cccc(NCc2cccs2)c1C#N 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 H17 compound treatment 0.077 0.00781 2.01 0.083 0.0128 3.57 3.9454 0.9632 3178640 Maybridge4_000523 NC(=O)Nc1ccc(cc1)/C(=C/c2ccc(Cl)c(Cl)c2)/C#N 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 H18 compound treatment 0.072 0.00281 0.72 0.074 0.00381 1.06 1.2628 0.9826 3062599 Maybridge4_000524 CN(C)C(=S)SCC(=O)c1ccc(Cl)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 H19 compound treatment 0.152 0.0828 21.32 0.153 0.0828 23.06 31.3846 0.9992 1221296 Maybridge4_000525 Cc1cc(C)c2-c3[nH]c(nc3C(C)(C)Cc2c1)c4ccccc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 H20 compound treatment 0.114 0.0448 11.54 0.116 0.0458 12.76 17.1801 0.9987 1556252 Maybridge4_000526 Cc1c(C)c(C)c(c(C)c1C)S(=O)(=O)NC(C)(C)C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 H21 compound treatment 0.067 -0.00219 -0.56 0.068 -0.00219 -0.61 -0.829 -0.9992 3062600 Maybridge4_000527 CC1CN/C(=N/S(=O)(=O)c2ccccc2)/N1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 H22 compound treatment 0.07 8.13E-4 0.21 0.071 8.12E-4 0.23 0.3079 0.9992 1621149 Maybridge4_000528 CC1CC(C)CN(C1)c2ccc(NS(=O)(=O)c3ccccc3)cc2C(=O)O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 H23 mock treatment 0.068 -0.00119 -0.31 0.068 -0.00219 -0.61 -0.647 -0.9492 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 H24 positive control 0.075 0.00581 1.5 0.079 0.00881 2.45 2.7936 0.9719 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 I01 compound treatment 0.116 0.0468 12.05 0.119 0.0488 13.59 18.135 0.9982 3062601 Maybridge4_000529 Cc1ccc(Oc2ncc(cc2Cl)C(F)(F)F)c3CCCc31 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 I02 compound treatment 0.065 -0.00419 -1.08 0.065 -0.00519 -1.44 -1.7839 -0.9896 3178641 Maybridge4_000530 CCOC(=O)CSc1nnc(S)s1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 I03 compound treatment 0.151 0.0818 21.06 0.159 0.0888 24.73 32.3841 0.9968 3178642 Maybridge4_000531 Cc1nc(cs1)c2cc(C#N)c(SCCNS(=O)(=O)c3ccc(cc3)C(C)(C)C)nc2C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 I04 compound treatment 0.076 0.00681 1.75 0.072 0.00181 0.5 1.5972 0.8751 1202864 Maybridge4_000532 Cc1ccc(cc1)C(=O)C2C(=O)N(C(=O)N(C2=O)c3ccccc3)c4ccccc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 I05 compound treatment 0.071 0.00181 0.47 0.071 8.12E-4 0.23 0.49 0.9448 1219965 Maybridge4_000533 Cc1nn(nc1C(=O)ON2C(=O)C3C4OC(C=C4)C3C2=O)c5ccccc5 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 I06 compound treatment 0.203 0.134 34.45 0.208 0.138 38.38 51.5004 0.9985 3062602 Maybridge4_000534 COc1ccc(/C=C\2/C(Oc3ccccc3C2=O)c4ccccc4)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 I07 compound treatment 0.111 0.0418 10.77 0.114 0.0438 12.2 16.2401 0.9981 1277364 Maybridge4_000535 CCOC(=O)c1c(O)c(O)c(C(=O)OCC)n1c2ccc(OC)cc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 I08 compound treatment 0.075 0.00581 1.5 0.076 0.00581 1.62 2.2028 0.9992 1178381 Maybridge4_000536 Fc1ccc2[nH]c3CCN(Cc3c2c1)C(=O)NCC=C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 I09 compound treatment 0.13 0.0608 15.66 0.136 0.0658 18.33 24.0316 0.9969 1497959 Maybridge4_000537 CC(C)C1CCC(C)CC1NC(=O)c2cccc3ccccc23 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 I10 compound treatment 0.144 0.0748 19.26 0.138 0.0678 18.89 26.9742 1.0 1039563 Maybridge4_000538 Clc1ccc2oc(cc(=O)c2c1)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 I11 compound treatment 0.113 0.0438 11.28 0.123 0.0528 14.71 18.3765 0.9914 1035419 Maybridge4_000539 O=C(c1ccccc1)c2ccc(cc2)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 I12 compound treatment 0.072 0.00281 0.72 0.074 0.00381 1.06 1.2628 0.9826 3178724 Maybridge4_000540 Sc1nn(c2ccc(Cl)cc2)c(=S)s1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 I13 compound treatment 0.083 0.0138 3.56 0.085 0.0148 4.13 5.4316 0.9973 1060199 Maybridge4_000541 CNC(=O)c1cccc2C(=O)c3ccccc3-c21 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 I14 compound treatment 0.069 -1.87E-4 -0.05 0.067 -0.00319 -0.89 -0.6618 -0.7445 3178725 Maybridge4_000542 NNC(=O)c1cc(n[nH]1)c2ccccc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 I15 compound treatment 0.068 -0.00119 -0.31 0.067 -0.00319 -0.89 -0.8439 -0.8988 1005720 Maybridge4_000543 CN(C)c1ccc(Cc2ccc(cc2)N(C)C)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 I16 compound treatment 0.106 0.0368 9.48 0.107 0.0368 10.25 13.9513 0.9992 1587057 Maybridge4_000544 COc1ccccc1C2CCN(Cc3cccc4ccccc34)CC2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 I17 compound treatment 0.076 0.00681 1.75 0.075 0.00481 1.34 2.188 0.9912 2075442 Maybridge4_000545 CN1[S+](c2ccccc2C(=O)O)c3cccc4cccc(C1=O)c34 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 I18 compound treatment 0.17 0.101 25.96 0.176 0.106 29.47 39.1909 0.998 3178726 Maybridge4_000546 Nc1ccccc1SC(CC(=O)c2ccc(Br)cc2)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 I19 compound treatment 0.101 0.0318 8.19 0.1 0.0298 8.3 11.6626 1.0 1287387 Maybridge4_000547 OCC(O)Cn1c2ccc(Br)cc2c3cc(Br)ccc13 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 I20 compound treatment 0.067 -0.00219 -0.56 0.068 -0.00219 -0.61 -0.829 -0.9992 1441014 Maybridge4_000548 OC(=O)C1(CCCC2(CCC1)C(=O)O)C2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 I21 compound treatment 0.113 0.0438 11.28 0.112 0.0418 11.64 16.2104 0.9999 1343250 Maybridge4_000549 O=C1C(C2c3ccccc3Oc4ccccc24)C(=O)c5ccccc15 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 I22 compound treatment 0.086 0.0168 4.33 0.086 0.0158 4.4 6.1747 1.0 3062641 Maybridge4_000550 OC[C@H]1O[C@@H](Oc2c[nH]c3ccc(Br)c(Cl)c23)[C@H](O)[C@@H](O)[C@H]1O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 I23 mock treatment 0.069 -1.87E-4 -0.05 0.069 -0.00119 -0.33 -0.268 -0.8018 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 I24 positive control 0.076 0.00681 1.75 0.078 0.00781 2.18 2.7788 0.9943 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 J01 compound treatment 0.077 0.00781 2.01 0.075 0.00481 1.34 2.37 0.9805 3062642 Maybridge4_000551 COC(=O)C1CCC(=O)C(C1)C(=O)OC 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 J02 compound treatment 0.202 0.133 34.2 0.198 0.128 35.6 49.3491 0.9998 1601179 Maybridge4_000552 Oc1ccc2ccccc2c1C3Nc4ccccc4-n5cccc35 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 J03 compound treatment 0.069 -1.87E-4 -0.05 0.071 8.12E-4 0.23 0.1259 0.544 3062643 Maybridge4_000553 Cc1c(C)c(C)c(CN2CCCCC2)c(C)c1C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 J04 compound treatment 0.093 0.0238 6.13 0.097 0.0268 7.47 9.6153 0.9952 3062644 Maybridge4_000554 CC(=O)Nc1s/c(=N\c2ccc(C)c(C)c2)/n(C(=O)C)c1c3ccc4OCOc4c3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 J05 compound treatment 0.121 0.0518 13.34 0.127 0.0568 15.82 20.6207 0.9964 1342204 Maybridge4_000555 O=S(=O)(N1CCCCC1)c2ccc(NC(=S)Nc3ccc4OCOc4c3)cc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 J06 compound treatment 0.239 0.17 43.72 0.262 0.192 53.42 68.6885 0.9951 3062645 Maybridge4_000556 Clc1ccc(Cl)c(NC(=S)NC(=N)c2ccccc2)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 J07 compound treatment 0.219 0.15 38.57 0.238 0.168 46.73 60.3211 0.9955 3178727 Maybridge4_000557 Oc1c(Cl)cc(Cl)cc1/C=N/c2ccc(CC3C(=O)Nc4ccccc34)cc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 J08 compound treatment 0.074 0.00481 1.24 0.074 0.00381 1.06 1.6269 0.997 3178728 Maybridge4_000558 CN1CCC2(C(C1)N=NN2c3cc(cc(c3)C(F)(F)F)C(F)(F)F)N4CCOCC4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 J09 compound treatment 0.117 0.0478 12.31 0.121 0.0508 14.15 18.7109 0.9976 3062646 Maybridge4_000559 Cc1cc(C)c(C(=O)Nc2cccc(c2)C(F)(F)F)c3CC(C)(C)C(=O)c31 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 J10 compound treatment 0.135 0.0658 16.94 0.125 0.0548 15.26 22.7757 0.9986 1734956 Maybridge4_000560 Nc1nc2c(nnn2c3ccccc13)c4ccc(Br)cc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 J11 compound treatment 0.095 0.0258 6.65 0.086 0.0158 4.4 7.8133 0.98 3178729 Maybridge4_000561 Cc1c(C)c(C)c(C(O)c2ccccc2)c(C)c1C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 J12 compound treatment 0.082 0.0128 3.3 0.082 0.0118 3.29 4.6588 1.0 3178730 Maybridge4_000562 COc1ccc(cc1)c2c(C#N)nnn2c3cc(cc(c3)C(F)(F)F)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 J13 compound treatment 0.07 8.13E-4 0.21 0.07 -1.87E-4 -0.05 0.111 0.5148 1646858 Maybridge4_000563 CCN1C(C(CCC1=O)C(=O)O)c2ccc(OC)cc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 J14 compound treatment 0.069 -1.87E-4 -0.05 0.069 -0.00119 -0.33 -0.268 -0.8018 1299644 Maybridge4_000564 Fc1cccc(NCCc2ccccn2)c1C#N 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 J15 compound treatment 0.114 0.0448 11.54 0.125 0.0548 15.26 18.9524 0.9905 3062647 Maybridge4_000565 CCOC(=S)SCc1c(C)c(C)c(C)c(C)c1C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 J16 compound treatment 0.072 0.00281 0.72 0.07 -1.87E-4 -0.05 0.4751 0.6544 1536926 Maybridge4_000566 O=C(CC#N)NCc1cccs1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 J17 compound treatment 0.104 0.0348 8.96 0.106 0.0358 9.97 13.3903 0.9986 3178731 Maybridge4_000567 Cc1onc(c1NC(=O)Nc2cccc(c2)C(F)(F)F)c3ccccc3Cl 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 J18 compound treatment 0.078 0.00881 2.27 0.075 0.00481 1.34 2.5521 0.9685 1727398 Maybridge4_000568 CCc1cccc(C(C)C)c1NS(=O)(=O)c2ccc(C)cc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 J19 compound treatment 0.07 8.13E-4 0.21 0.073 0.00281 0.78 0.7018 0.8656 3062649 Maybridge4_000569 Nn1c(nc2ccccc2c1=O)C(=O)NCc3cccnc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 J20 compound treatment 0.07 8.13E-4 0.21 0.072 0.00181 0.5 0.5048 0.924 3178732 Maybridge4_000570 CC1CCCCN1CCCNC(=O)Nc2ccc(Cl)cc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 J21 compound treatment 0.068 -0.00119 -0.31 0.068 -0.00219 -0.61 -0.647 -0.9492 3062650 Maybridge4_000571 Clc1ccc(SCc2ccc(C#N)cc2)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 J22 compound treatment 0.069 -1.87E-4 -0.05 0.069 -0.00119 -0.33 -0.268 -0.8018 3178733 Maybridge4_000572 CC1CN(CC(C)O1)c2ccc(NC(=O)c3ccco3)cc2C(=O)O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 J23 mock treatment 0.068 -0.00119 -0.31 0.069 -0.00119 -0.33 -0.45 -0.9992 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 J24 positive control 0.076 0.00681 1.75 0.076 0.00581 1.62 2.3849 0.9992 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 K01 compound treatment 0.079 0.00981 2.53 0.073 0.00281 0.78 2.3403 0.8848 1258100 Maybridge4_000573 OC(=O)C1CC1C(=O)Nc2ccc(Oc3ccc(Cl)cc3C4CCCCC4)nc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 K02 compound treatment 0.067 -0.00219 -0.56 0.065 -0.00519 -1.44 -1.4198 -0.9157 3062651 Maybridge4_000574 CCOC(=O)CCSc1nnc(S)s1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 K03 compound treatment 0.13 0.0608 15.66 0.141 0.0708 19.72 25.0162 0.9935 1465836 Maybridge4_000575 Fc1ccc(COc2ccc(cc2)C(=O)CSc3ccccn3)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 K04 compound treatment 0.068 -0.00119 -0.31 0.068 -0.00219 -0.61 -0.647 -0.9492 1182542 Maybridge4_000576 CC1(CC2(C)CC3(C)C1)CC(C2)(C3)C(=O)O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 K05 compound treatment 0.072 0.00281 0.72 0.071 8.12E-4 0.23 0.672 0.8858 3178734 Maybridge4_000577 OC1CCCCCCCCCCC1CCC#N 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 K06 compound treatment 0.074 0.00481 1.24 0.07 -1.87E-4 -0.05 0.8392 0.6767 3062652 Maybridge4_000578 CC(C)CCNC(=O)Oc1ccccc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 K07 compound treatment 0.112 0.0428 11.02 0.107 0.0368 10.25 15.0437 0.9993 3178735 Maybridge4_000579 COc1ccc(OC)c2c(=O)cc(oc12)C(=O)O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 K08 compound treatment 0.071 0.00181 0.47 0.071 8.12E-4 0.23 0.49 0.9448 1674875 Maybridge4_000580 COc1ccccc1C2CCN(CC2)C(=O)c3ccco3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 K09 compound treatment 0.092 0.0228 5.87 0.094 0.0238 6.63 8.8425 0.9982 3178736 Maybridge4_000581 CC1(C)C2CCC1(C)C(C2)NC(=O)c3cccc(c3)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 K10 compound treatment 0.104 0.0348 8.96 0.1 0.0298 8.3 12.2087 0.9993 1672849 Maybridge4_000582 Cc1onc(c1C(=O)N2CC(C2)Oc3ccc(Cl)cc3)c4c(F)cccc4Cl 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 K11 compound treatment 0.068 -0.00119 -0.31 0.068 -0.00219 -0.61 -0.647 -0.9492 3062653 Maybridge4_000583 Cc1cc(n[nH]c1=O)c2ccccn2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 K12 compound treatment 0.071 0.00181 0.47 0.071 8.12E-4 0.23 0.49 0.9448 3062654 Maybridge4_000584 Sc1nc(c2ccccc2)n(n1)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 K13 compound treatment 0.111 0.0418 10.77 0.109 0.0388 10.81 15.2555 1.0 1267527 Maybridge4_000585 CC(C)CCNC(=O)c1cccc2C(=O)c3ccccc3-c21 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 K14 compound treatment 0.08 0.0108 2.78 0.08 0.00981 2.73 3.9008 1.0 3062655 Maybridge4_000586 O=C1C(CCCC1c2ccccc2)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 K15 compound treatment 0.074 0.00481 1.24 0.076 0.00581 1.62 2.0208 0.9913 3178737 Maybridge4_000587 Cc1c(cnc2ccccc12)c3nnnn3c4ccccc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 K16 compound treatment 0.071 0.00181 0.47 0.068 -0.00219 -0.61 -0.1008 -0.1313 1175626 Maybridge4_000588 Cc1ccc(cc1)C(=O)OC2CN3CCC2CC3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 K17 compound treatment 0.071 0.00181 0.47 0.07 -1.87E-4 -0.05 0.2931 0.6241 3178738 Maybridge4_000589 CN1[S+](c2ccccc2C1=O)c3cccc4cccc(C(=O)O)c34 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 K18 compound treatment 0.083 0.0138 3.56 0.083 0.0128 3.57 5.0378 1.0 3178739 Maybridge4_000590 CC1(C)C2CCC1(C)c3nn(c(c23)C(F)(F)F)c4ccccc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 K19 compound treatment 0.069 -1.87E-4 -0.05 0.071 8.12E-4 0.23 0.1259 0.544 1361703 Maybridge4_000591 CCOC(Cn1c2ccccc2c3ccccc13)OCC 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 K20 compound treatment 0.068 -0.00119 -0.31 0.07 -1.87E-4 -0.05 -0.2531 -0.8161 1031191 Maybridge4_000592 OC(=O)C1C(C2CCC1C2)C(=O)O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 K21 compound treatment 0.141 0.0718 18.49 0.153 0.0828 23.06 29.3819 0.994 1224135 Maybridge4_000593 Cn1c(nc2ccccc12)C(C#N)C(=O)c3ccccc3I 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 K22 compound treatment 0.106 0.0368 9.48 0.11 0.0398 11.09 14.5421 0.997 1062658 Maybridge4_000594 CCOC(=O)C1C(C2c3ccccc3C1c4ccccc24)C(=O)OCC 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 K23 mock treatment 0.069 -1.87E-4 -0.05 0.07 -1.87E-4 -0.05 -0.0711 -0.9992 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 K24 positive control 0.077 0.00781 2.01 0.076 0.00581 1.62 2.567 0.9942 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 L01 compound treatment 0.076 0.00681 1.75 0.07 -1.87E-4 -0.05 1.2034 0.6858 3062656 Maybridge4_000595 CCCCN(C(C)C)S(=O)(=O)c1ccc(C)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 L02 compound treatment 0.227 0.158 40.63 0.214 0.144 40.05 57.0514 1.0 3178740 Maybridge4_000596 FC(F)(F)c1cccc(c1)/C(=C/C=C/c2ccccc2)/C#N 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 L03 compound treatment 0.084 0.0148 3.81 0.082 0.0118 3.29 5.0229 0.9973 3062657 Maybridge4_000597 O=C1NC(=O)C(=CC2CCC=CC2)C(=O)N1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 L04 compound treatment 0.075 0.00581 1.5 0.076 0.00581 1.62 2.2028 0.9992 1174872 Maybridge4_000598 Fc1cccc(F)c1C(=O)Nc2cccc(NC(=O)c3c(F)cccc3F)n2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 L05 compound treatment 0.075 0.00581 1.5 0.073 0.00281 0.78 1.6121 0.9544 3178741 Maybridge4_000599 COc1ccc(CC/N=C/c2ccc3OCOc3c2)cc1OC 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 L06 compound treatment 0.07 8.13E-4 0.21 0.073 0.00281 0.78 0.7018 0.8656 3062658 Maybridge4_000600 FC(F)(F)c1cc(C#CCN2CCCCC2)cc(c1)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 L07 compound treatment 0.072 0.00281 0.72 0.07 -1.87E-4 -0.05 0.4751 0.6544 3178820 Maybridge4_000601 CC(C)NC(=S)N1CCCN2C1c3ccccc3C2=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 L08 compound treatment 0.108 0.0388 9.99 0.112 0.0418 11.64 15.3001 0.9971 3062659 Maybridge4_000602 FC(F)(F)c1cccc(c1C(=O)OCC(=O)c2ccc(Cl)cc2)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 L09 compound treatment 0.13 0.0608 15.66 0.133 0.0628 17.49 23.4408 0.9985 1236762 Maybridge4_000603 S=C(Nc1ccccc1)Nc2ccccc2n3cccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 L10 compound treatment 0.076 0.00681 1.75 0.076 0.00581 1.62 2.3849 0.9992 3062660 Maybridge4_000604 COc1ccc(OC)c(c1)S(=O)(=O)c2ccc(Br)cc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 L11 compound treatment 0.068 -0.00119 -0.31 0.071 8.12E-4 0.23 -0.0562 -0.1477 1138158 Maybridge4_000605 COc1ccc(OCCC(=O)NN)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 L12 compound treatment 0.069 -1.87E-4 -0.05 0.07 -1.87E-4 -0.05 -0.0711 -0.9992 3062661 Maybridge4_000606 CN(C)C(=O)c1c(C)onc1c2c(Cl)cccc2Cl 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 L13 compound treatment 0.174 0.105 26.99 0.188 0.118 32.81 42.2822 0.9953 3178821 Maybridge4_000607 OC(Cc1ccccc1)(c2ccccc2)c3ccccc3/N=C/c4ccc5OCOc5c4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 L14 compound treatment 0.104 0.0348 8.96 0.103 0.0328 9.14 12.7995 1.0 3178822 Maybridge4_000608 Fc1cccc(N(Cc2cccnc2)C(=S)Nc3ccc(Cl)c(Cl)c3)c1C#N 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 L15 compound treatment 0.102 0.0328 8.45 0.102 0.0318 8.86 12.2385 0.9997 3062708 Maybridge4_000609 Cc1c(C)c(C)c(CSc2ccccn2)c(C)c1C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 L16 compound treatment 0.069 -1.87E-4 -0.05 0.068 -0.00219 -0.61 -0.4649 -0.7608 3062709 Maybridge4_000610 CC(C)NC(=O)NCc1c(F)cccc1Cl 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 L17 compound treatment 0.073 0.00381 0.98 0.078 0.00781 2.18 2.2326 0.9353 3062710 Maybridge4_000611 Cc1c(C)c(C)c(C(=O)/C=N/N)c(C)c1C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 L18 compound treatment 0.138 0.0688 17.72 0.136 0.0658 18.33 25.488 0.9999 3062711 Maybridge4_000612 CCc1cccc(C(C)C)c1NC(=O)Nc2ccccc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 L19 compound treatment 0.075 0.00581 1.5 0.074 0.00381 1.06 1.809 0.9859 3062712 Maybridge4_000613 COc1ccc(NC(=S)NCCCC2C=NN=C2O)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 L20 compound treatment 0.087 0.0178 4.59 0.095 0.0248 6.91 8.1291 0.9802 3062713 Maybridge4_000614 CC(C)(C)C1=C(C#N)C(C(=C(NC(=O)NC(=O)c2c(F)cccc2Cl)O1)C#N)c3cccs3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 L21 compound treatment 0.069 -1.87E-4 -0.05 0.068 -0.00219 -0.61 -0.4649 -0.7608 1309274 Maybridge4_000615 Cc1cc(C)c(C(=O)Nc2ccc(C)c(C)c2)c(CC(C)(C)C(=O)O)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 L22 compound treatment 0.162 0.0928 23.9 0.156 0.0858 23.9 33.7959 1.0 3178823 Maybridge4_000616 OCC(CO)(CO)NC(=S)Nc1cc(Cl)cc(Cl)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 L23 mock treatment 0.069 -1.87E-4 -0.05 0.071 8.12E-4 0.23 0.1259 0.544 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 L24 positive control 0.076 0.00681 1.75 0.076 0.00581 1.62 2.3849 0.9992 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 M01 compound treatment 0.076 0.00681 1.75 0.076 0.00581 1.62 2.3849 0.9992 1443995 Maybridge4_000617 CCCc1ccc(Oc2ccc(NC(=O)C3CC3C(=O)O)cn2)c(OC)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 M02 compound treatment 0.095 0.0258 6.65 0.098 0.0278 7.75 10.1764 0.9971 2105374 Maybridge4_000618 Oc1ccc(cc1)C(C#N)N2CCN(CC2)C(C#N)c3ccc(O)cc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 M03 compound treatment 0.165 0.0958 24.67 0.15 0.0798 22.23 33.1606 0.9986 1235908 Maybridge4_000619 Cc1nc(cs1)c2cc(C#N)c(SCCC(=O)OC(C)(C)C)nc2C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 M04 compound treatment 0.094 0.0248 6.39 0.092 0.0218 6.07 8.8128 0.9997 1332220 Maybridge4_000620 COc1ccc(cc1)C(=O)NC2(CC3CC4CC(C3)C2)C4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 M05 compound treatment 0.071 0.00181 0.47 0.071 8.12E-4 0.23 0.49 0.9448 3178824 Maybridge4_000621 CN1C2CCC1CC(C2)NC(=O)Cc3ccccc3F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 M06 compound treatment 0.069 -1.87E-4 -0.05 0.07 -1.87E-4 -0.05 -0.0711 -0.9992 3062715 Maybridge4_000622 CCNC(=O)Oc1ccccc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 M07 compound treatment 0.117 0.0478 12.31 0.113 0.0428 11.92 17.1355 0.9999 3062716 Maybridge4_000623 CN(C)/C=C/C(=O)c1c(O)cc(C)oc1=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 M08 compound treatment 0.07 8.13E-4 0.21 0.071 8.12E-4 0.23 0.3079 0.9992 1250275 Maybridge4_000624 COc1ccccc1C2CCN(CC2)C(=O)C3CCCCC3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 M09 compound treatment 0.153 0.0838 21.58 0.158 0.0878 24.46 32.5513 0.9981 1731106 Maybridge4_000625 COc1ccc(Br)cc1COC(=O)C2c3ccccc3Oc4ccccc24 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 M10 compound treatment 0.078 0.00881 2.27 0.083 0.0128 3.57 4.1275 0.9761 1917572 Maybridge4_000626 CCOc1ccc2[nH]c(SCc3c(F)c(F)c(F)c(F)c3F)nc2c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 M11 compound treatment 0.082 0.0128 3.3 0.082 0.0118 3.29 4.6588 1.0 1003070 Maybridge4_000627 Cc1ccc(cc1)S(=O)(=O)c2ccc(C)cc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 M12 compound treatment 0.341 0.272 69.98 0.338 0.268 74.58 102.2248 0.9995 3062717 Maybridge4_000628 CSc1nc2c(=S)[nH]c(=S)[nH]c2s1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 M13 compound treatment 0.101 0.0318 8.19 0.102 0.0318 8.86 12.0564 0.9992 3062718 Maybridge4_000629 O/N=C(/C(=N/O)/c1ccccc1)\c2ccccc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 M14 compound treatment 0.068 -0.00119 -0.31 0.067 -0.00319 -0.89 -0.8439 -0.8988 1781230 Maybridge4_000630 CCOC(=O)CNc1n[nH]c(=O)[nH]c1=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 M15 compound treatment 0.073 0.00381 0.98 0.074 0.00381 1.06 1.4449 0.9992 3062719 Maybridge4_000631 Cc1cc(C)nc(S/C=C/C(=O)c2ccc(Cl)cc2)n1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 M16 compound treatment 0.075 0.00581 1.5 0.07 -1.87E-4 -0.05 1.0213 0.682 1718236 Maybridge4_000632 Cn1c(=O)cc(N2CCOCC2)c3c(=O)n(c4ccccc4)c(=O)n(c5ccccc5)c13 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 M17 compound treatment 0.073 0.00381 0.98 0.071 8.12E-4 0.23 0.8541 0.8479 3178825 Maybridge4_000633 CC(=O)NC1=NN(C(N1C(=O)C)c2cccc3ccccc23)C(=O)C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 M18 compound treatment 0.068 -0.00119 -0.31 0.069 -0.00119 -0.33 -0.45 -0.9992 1286292 Maybridge4_000634 O=C(NC(C(=O)c1ccccc1)n2cnccc2=O)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 M19 compound treatment 0.103 0.0338 8.71 0.106 0.0358 9.97 13.2082 0.9977 1171458 Maybridge4_000635 OC(COCc1ccccc1)Cn2c3ccccc3c4ccccc24 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 M20 compound treatment 0.07 8.13E-4 0.21 0.07 -1.87E-4 -0.05 0.111 0.5148 3062720 Maybridge4_000636 C/S(=N\S(=O)(=O)c1ccc(C)cc1)/c2ccccc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 M21 compound treatment 0.167 0.0978 25.18 0.168 0.0978 27.24 37.0693 0.9992 1311339 Maybridge4_000637 O=C(C(C#N)c1nc2ccccc2[nH]1)c3ccco3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 M22 compound treatment 0.068 -0.00119 -0.31 0.068 -0.00219 -0.61 -0.647 -0.9492 1645478 Maybridge4_000638 COC(=O)C1C([C@H]2c3ccccc3[C@@H]1c4ccccc24)C(=O)OC 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 M23 mock treatment 0.069 -1.87E-4 -0.05 0.071 8.12E-4 0.23 0.1259 0.544 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 M24 positive control 0.077 0.00781 2.01 0.078 0.00781 2.18 2.9608 0.9992 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 N01 compound treatment 0.086 0.0168 4.33 0.076 0.00581 1.62 4.2055 0.91 1273203 Maybridge4_000639 CN(C)CC1(CC(=O)O)CCCCC1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 N02 compound treatment 0.072 0.00281 0.72 0.072 0.00181 0.5 0.869 0.9844 3178826 Maybridge4_000640 NN/C(=N/S(=O)(=O)c1ccccc1)/N2CCCC2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 N03 compound treatment 0.263 0.194 49.9 0.272 0.202 56.2 75.0271 0.9982 3062722 Maybridge4_000641 O=C1NC(=O)C(=C/C=C/c2ccccc2)C(=O)N1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 N04 compound treatment 0.071 0.00181 0.47 0.076 0.00581 1.62 1.4746 0.8753 1678177 Maybridge4_000642 COc1cccc(OC)c1C(=O)Nc2ccccc2NC(=O)c3c(OC)cccc3OC 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 N05 compound treatment 0.074 0.00481 1.24 0.072 0.00181 0.5 1.2331 0.9216 1073885 Maybridge4_000643 CCOc1ccc(CCC(=O)O)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 N06 compound treatment 0.075 0.00581 1.5 0.075 0.00481 1.34 2.0059 0.9985 3178827 Maybridge4_000644 CS/C(=N\S(=O)(=O)c1cc(cc(c1)C(F)(F)F)C(F)(F)F)/N2CCOCC2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 N07 compound treatment 0.079 0.00981 2.53 0.076 0.00581 1.62 2.9311 0.9769 3062723 Maybridge4_000645 Oc1noc(O)c1c2ccccc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 N08 compound treatment 0.071 0.00181 0.47 0.071 8.12E-4 0.23 0.49 0.9448 3062724 Maybridge4_000646 NC(=S)NC1CC2CC1C=C2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 N09 compound treatment 0.072 0.00281 0.72 0.072 0.00181 0.5 0.869 0.9844 3178828 Maybridge4_000647 CCNc1cc(N)[n+](CC)c2[nH]nc(N)c12 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 N10 compound treatment 0.072 0.00281 0.72 0.071 8.12E-4 0.23 0.672 0.8858 1512370 Maybridge4_000648 COc1ccc(cc1CN2CCOCC2)c3cc(c4ccccc4)c(nn3)c5ccccc5 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 N11 compound treatment 0.067 -0.00219 -0.56 0.068 -0.00219 -0.61 -0.829 -0.9992 1288584 Maybridge4_000649 S=C(NC1CC2CC1C=C2)N(CCC#N)Cc3cccnc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 N12 compound treatment 0.072 0.00281 0.72 0.071 8.12E-4 0.23 0.672 0.8858 3178829 Maybridge4_000650 CC(=O)NCc1c(F)cccc1Cl 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 N13 compound treatment 0.108 0.0388 9.99 0.107 0.0368 10.25 14.3154 0.9999 1566685 Maybridge4_000651 CCCN(CCC)S(=O)(=O)c1ccc(cc1)C(=O)Nc2cccc(SC)c2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 N14 compound treatment 0.069 -1.87E-4 -0.05 0.069 -0.00119 -0.33 -0.268 -0.8018 3062725 Maybridge4_000652 Fc1cccc(Cl)c1CSc2ccccc2C3=NCCCN3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 N15 compound treatment 0.079 0.00981 2.53 0.078 0.00781 2.18 3.3249 0.9972 3178830 Maybridge4_000653 Cc1c(C)c(C)c(CSC2=NCCS2)c(C)c1C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 N16 compound treatment 0.071 0.00181 0.47 0.069 -0.00119 -0.33 0.0961 0.1681 3062726 Maybridge4_000654 Clc1cc(C[n+]2ccccc2)c3OCOCc3c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 N17 compound treatment 0.073 0.00381 0.98 0.072 0.00181 0.5 1.051 0.9522 3062727 Maybridge4_000655 Cn1c(S)nnc1CC#N 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 N18 compound treatment 0.082 0.0128 3.3 0.083 0.0128 3.57 4.8557 0.9992 3178831 Maybridge4_000656 CC1CC(C)CN(C1)S(=O)(=O)c2c(C)c(C)c(C)c(C)c2C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 N19 compound treatment 0.131 0.0618 15.91 0.141 0.0708 19.72 25.1982 0.9943 3178832 Maybridge4_000657 N#Cc1cccc(CSc2nnc(SCc3cccc(C#N)c3)s2)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 N20 compound treatment 0.115 0.0458 11.8 0.114 0.0438 12.2 16.9683 0.9999 3062728 Maybridge4_000658 CC1(C)ON(C(=N1)NS(=O)(=O)c2cc(cc(c2)C(F)(F)F)C(F)(F)F)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 N21 compound treatment 0.076 0.00681 1.75 0.075 0.00481 1.34 2.188 0.9912 3178833 Maybridge4_000659 CC1N=C(SCC#N)N2C(C)N=C(SCC#N)N12 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 N22 compound treatment 0.068 -0.00119 -0.31 0.069 -0.00119 -0.33 -0.45 -0.9992 1490971 Maybridge4_000660 Nc1ccccc1C(=O)NCc2c(F)cccc2Cl 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 N23 mock treatment 0.069 -1.87E-4 -0.05 0.071 8.12E-4 0.23 0.1259 0.544 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 N24 positive control 0.076 0.00681 1.75 0.077 0.00681 1.9 2.5818 0.9992 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 O01 compound treatment 0.096 0.0268 6.9 0.091 0.0208 5.8 8.9799 0.9962 3178834 Maybridge4_000661 COc1ccccc1C2OC(=O)C[C@H]2C(=O)Oc3cccc(c3)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 O02 compound treatment 0.082 0.0128 3.3 0.082 0.0118 3.29 4.6588 1.0 3178835 Maybridge4_000662 FC(F)(F)c1cc(NC(=S)NCCN2CCNC2=O)cc(c1)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 O03 compound treatment 0.113 0.0438 11.28 0.109 0.0388 10.81 15.6196 0.9998 1251917 Maybridge4_000663 Cc1ccc(OC(C)(C)C(=O)Nc2ccc(Oc3ccc(F)cc3F)nc2)c4CCCc41 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 O04 compound treatment 0.076 0.00681 1.75 0.078 0.00781 2.18 2.7788 0.9943 3178836 Maybridge4_000664 Cc1ccccc1NC2=NCC(C)(C)S2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 O05 compound treatment 0.103 0.0338 8.71 0.109 0.0388 10.81 13.799 0.9942 1342095 Maybridge4_000665 NC(=O)C1c2ccccc2Oc3ccccc13 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 O06 compound treatment 0.078 0.00881 2.27 0.081 0.0108 3.01 3.7336 0.9903 3178916 Maybridge4_000666 CC(C)(C)NC(=O)Oc1ccc(Cl)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 O07 compound treatment 0.073 0.00381 0.98 0.071 8.12E-4 0.23 0.8541 0.8479 1101019 Maybridge4_000667 CC(C)(C)c1cc(c2oc(cc(=O)c2c1)C(=O)O)C(C)(C)C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 O08 compound treatment 0.069 -1.87E-4 -0.05 0.072 0.00181 0.5 0.3228 0.6366 1485865 Maybridge4_000668 Clc1ccc(OC2CN(C2)C(=O)NCC=C)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 O09 compound treatment 0.109 0.0398 10.25 0.116 0.0458 12.76 16.2698 0.9941 3178917 Maybridge4_000669 O=C(Oc1ccc2ccccc2c1)C3c4ccccc4Oc5ccccc35 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 O10 compound treatment 0.068 -0.00119 -0.31 0.068 -0.00219 -0.61 -0.647 -0.9492 1074403 Maybridge4_000670 C1CCC(CC1)Nc2ccccn2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 O11 compound treatment 0.068 -0.00119 -0.31 0.068 -0.00219 -0.61 -0.647 -0.9492 1171317 Maybridge4_000671 COc1cc(OC)cc(c1)C(C)(C)OC(=O)NN 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 O12 compound treatment 0.079 0.00981 2.53 0.077 0.00681 1.9 3.128 0.99 1302360 Maybridge4_000672 OC(=O)Cc1cncc(Br)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 O13 compound treatment 0.077 0.00781 2.01 0.073 0.00281 0.78 1.9762 0.9155 3063089 Maybridge4_000673 C/C(=N\O)/c1c(O)c2ccccc2n(C)c1=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 O14 compound treatment 0.067 -0.00219 -0.56 0.068 -0.00219 -0.61 -0.829 -0.9992 1915396 Maybridge4_000674 CC1(C)OC2C(CO)OC(C2O1)n3cnc4c(=O)[nH]cnc34 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 O15 compound treatment 0.08 0.0108 2.78 0.078 0.00781 2.18 3.507 0.9926 1665055 Maybridge4_000675 CC(=O)OCc1ccccc1Sc2ccccc2C(=O)NCc3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 O16 compound treatment 0.068 -0.00119 -0.31 0.068 -0.00219 -0.61 -0.647 -0.9492 3063091 Maybridge4_000676 CN1C(=O)/C(=C\NCc2ccccc2)/C(=O)c3c1n(C)c(=O)n(C)c3=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 O17 compound treatment 0.065 -0.00419 -1.08 0.075 0.00481 1.34 0.1853 0.1077 3178918 Maybridge4_000677 COC(=O)c1cc(=O)nc2O[C@@H]3C(O)[C@@H](CO)OC3n21 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 O18 compound treatment 0.063 -0.00619 -1.59 0.071 8.12E-4 0.23 -0.9665 -0.6006 1458724 Maybridge4_000678 OC(=O)CCC1(CC2CC3CC(O)(C2)C1)C3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 O19 compound treatment 0.139 0.0698 17.97 0.139 0.0688 19.16 26.2609 0.9995 3178919 Maybridge4_000679 CCn1c2ccc(Cl)cc2c3cc(Cl)ccc13 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 O20 compound treatment 0.079 0.00981 2.53 0.085 0.0148 4.13 4.7034 0.9723 1547077 Maybridge4_000680 Cc1ccc(cc1)S(=O)(=O)N=S(Cc2ccccc2)Cc3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 O21 compound treatment 0.068 -0.00119 -0.31 0.069 -0.00119 -0.33 -0.45 -0.9992 3063093 Maybridge4_000681 CC(C)(C)c1ccc(=O)[nH]n1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 O22 compound treatment 0.072 0.00281 0.72 0.07 -1.87E-4 -0.05 0.4751 0.6544 3178920 Maybridge4_000682 Brc1ccc(NC(=O)N2NC(=O)[C@H]([C@@H]2c3ccccc3)c4ccccc4)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 O23 mock treatment 0.07 8.13E-4 0.21 0.073 0.00281 0.78 0.7018 0.8656 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 O24 positive control 0.077 0.00781 2.01 0.078 0.00781 2.18 2.9608 0.9992 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 P01 compound treatment 0.083 0.0138 3.56 0.082 0.0118 3.29 4.8409 0.9992 3063094 Maybridge4_000683 COC(=O)/C=C/c1cn(C2OCC(CO)C2O)c(=O)[nH]c1=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 P02 compound treatment 0.08 0.0108 2.78 0.077 0.00681 1.9 3.3101 0.9825 3178921 Maybridge4_000684 NNC(=O)CS(=O)Cc1cccc(c1)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 P03 compound treatment 0.09 0.0208 5.36 0.082 0.0118 3.29 6.1153 0.9726 3063095 Maybridge4_000685 O=C1NC(=O)C(=Cc2cccc3ccccc23)C(=O)N1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 P04 compound treatment 0.094 0.0248 6.39 0.098 0.0278 7.75 9.9943 0.9954 3178922 Maybridge4_000686 O/N=C/c1ccc(o1)c2cc(cc(c2)C(F)(F)F)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 P05 compound treatment 0.138 0.0688 17.72 0.141 0.0708 19.72 26.4727 0.9986 1352669 Maybridge4_000687 COc1cccc(NC(=S)NC(Cc2ccccc2)c3ccccc3)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 P06 compound treatment 0.145 0.0758 19.52 0.145 0.0748 20.83 28.5348 0.9995 1145524 Maybridge4_000688 Clc1ccc(Cl)c(NC(=S)Nc2ccc(nc2)N3CCOCC3)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 P07 compound treatment 0.102 0.0328 8.45 0.098 0.0278 7.75 11.4508 0.9991 1152510 Maybridge4_000689 COc1ccc(CSC2=C(C#N)C(=O)NC3(CCCCC3)S2)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 P08 compound treatment 0.082 0.0128 3.3 0.08 0.00981 2.73 4.265 0.9956 3063149 Maybridge4_000690 Clc1ccccc1NC(=O)CC2SC(=NC2=O)NC3CC4CC3C=C4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 P09 compound treatment 0.192 0.123 31.62 0.197 0.127 35.32 47.3316 0.9985 3178923 Maybridge4_000691 CCNc1cc(N)[n+](CC)c2[nH]nc(/N=C/c3cc(Cl)cc(Cl)c3O)c12 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 P10 compound treatment 0.071 0.00181 0.47 0.071 8.12E-4 0.23 0.49 0.9448 3063150 Maybridge4_000692 N/C(=N\O)/CN1CCCCC1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 P11 compound treatment 0.072 0.00281 0.72 0.072 0.00181 0.5 0.869 0.9844 1138088 Maybridge4_000693 S=C(NC1CC2CC1C=C2)N(CCC#N)CC3CCCO3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 P12 compound treatment 0.081 0.0118 3.04 0.077 0.00681 1.9 3.4921 0.9742 3063152 Maybridge4_000694 Fc1cccc(Cl)c1CSC2=NCCN2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 P13 compound treatment 0.075 0.00581 1.5 0.072 0.00181 0.5 1.4151 0.896 1637772 Maybridge4_000695 Cc1onc(c1C(=O)N2CCCN3C2c4ccccc4C3=O)c5ccccc5 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 P14 compound treatment 0.073 0.00381 0.98 0.074 0.00381 1.06 1.4449 0.9992 3063153 Maybridge4_000696 Nn1c(nc2ccccc2c1=O)C(=O)N3CCCC3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 P15 compound treatment 0.091 0.0218 5.62 0.092 0.0218 6.07 8.2666 0.9992 1322891 Maybridge4_000697 CCOC(=O)CCc1ccc(OCc2c(C)c(C)c(C)c(C)c2C)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 P16 compound treatment 0.072 0.00281 0.72 0.071 8.12E-4 0.23 0.672 0.8858 3063154 Maybridge4_000698 Cc1c(C)c(C)c(c(C)c1C)S(=O)(=O)NCCCN2CCOCC2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 P17 compound treatment 0.106 0.0368 9.48 0.102 0.0318 8.86 12.9667 0.9994 1180785 Maybridge4_000699 Cc1c(C)c(C)c(C(=O)CCc2cccc(NC(=O)C3CCC3)c2)c(C)c1C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 P18 compound treatment 0.074 0.00481 1.24 0.079 0.00881 2.45 2.6116 0.9499 3063155 Maybridge4_000700 Cc1c(C)c(C)c(c(C)c1C)S(=O)(=O)NC(=N)N 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 P19 compound treatment 0.074 0.00481 1.24 0.074 0.00381 1.06 1.6269 0.997 3178924 Maybridge4_000701 N/C(=N\O)/Cc1nc(cs1)c2ccc(Cl)cc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 P20 compound treatment 0.105 0.0358 9.22 0.099 0.0288 8.02 12.1939 0.9976 3063157 Maybridge4_000702 Cc1nnsc1C(=O)NC(=O)Nc2cc(Cl)cc(Cl)c2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 P21 compound treatment 0.072 0.00281 0.72 0.071 8.12E-4 0.23 0.672 0.8858 3178925 Maybridge4_000703 CC1(C)NN(C(=N1)S)c2ccccc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 P22 compound treatment 0.085 0.0158 4.07 0.082 0.0118 3.29 5.205 0.9944 3063158 Maybridge4_000704 CSc1nc(nc(SC)c1Cl)c2ccc(Cl)cc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 P23 mock treatment 0.074 0.00481 1.24 0.074 0.00381 1.06 1.6269 0.997 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2050 P24 positive control 0.078 0.00881 2.27 0.081 0.0108 3.01 3.7336 0.9903 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 A01 compound treatment 0.088 0.0168 4.31 0.096 0.0219 6.11 7.3695 0.9855 1580862 Maybridge4_000705 CC1CC(C)CN(C1)c2ccc(NC(=O)c3ccc(Cl)cc3)cc2C(=O)O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 A02 compound treatment 0.077 0.00575 1.48 0.081 0.00694 1.93 2.413 0.9914 3063159 Maybridge4_000706 Cc1nn(C)c(Cl)c1S(=O)(=O)Nc2ccc(C)cc2C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 A03 compound treatment 0.077 0.00575 1.48 0.08 0.00594 1.65 2.2161 0.9985 3178926 Maybridge4_000707 CN(C)/C=N/S(=O)(=O)c1cc(cc(c1)C(F)(F)F)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 A04 compound treatment 0.102 0.0308 7.92 0.108 0.0339 9.45 12.2814 0.9961 3178927 Maybridge4_000708 Clc1ccc(NC(=S)N2CCCC2c3cccs3)c(Cl)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 A05 compound treatment 0.083 0.0118 3.03 0.088 0.0139 3.88 4.8838 0.9924 3063160 Maybridge4_000709 Cn1nccc1c2cc(F)cc(F)c2O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 A06 compound treatment 0.076 0.00475 1.22 0.079 0.00494 1.38 1.8371 0.9983 3178928 Maybridge4_000710 O=C(NC(=O)c1ccc(cc1)S(=O)(=O)N2CCOCC2)N3CCOCC3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 A07 compound treatment 0.076 0.00475 1.22 0.077 0.00294 0.82 1.4432 0.9809 3063161 Maybridge4_000711 Fc1cccc(Cl)c1COC(=O)c2ccc(Cl)cc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 A08 compound treatment 0.077 0.00575 1.48 0.08 0.00594 1.65 2.2161 0.9985 3063162 Maybridge4_000712 CN(C)/C=C/C(=O)c1cc(OCC(F)(F)F)ccc1OCC(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 A09 compound treatment 0.095 0.0238 6.11 0.102 0.0279 7.78 9.8255 0.9929 1674451 Maybridge4_000713 CN(NS(=O)(=O)c1cc(C)c(F)c(C)c1)c2cccc(Cl)c2C#N 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 A10 compound treatment 0.624 0.553 142.32 0.598 0.524 145.91 203.8092 0.9999 3063163 Maybridge4_000714 CN(C)/C=C/1\SCc2ccccc2C1=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 A11 compound treatment 0.1 0.0288 7.4 0.099 0.0249 6.94 10.145 0.9995 3178929 Maybridge4_000715 Cc1onc(c1C(=O)c2ccc(F)cc2)c3c(Cl)cccc3Cl 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 A12 compound treatment 0.083 0.0118 3.03 0.087 0.0129 3.6 4.6869 0.9962 1518860 Maybridge4_000716 COc1cccc(OC)c1C(=O)NN 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 A13 compound treatment 0.076 0.00475 1.22 0.078 0.00394 1.1 1.6402 0.9985 1454624 Maybridge4_000717 CC1=C(O)C(=O)OC1c2c(F)cccc2Cl 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 A14 compound treatment 0.162 0.0907 23.37 0.16 0.0859 23.93 33.4451 0.9999 3178930 Maybridge4_000718 Cc1nc(COc2cc(C)c(Cl)c(C)c2Cl)cs1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 A15 compound treatment 0.077 0.00575 1.48 0.08 0.00594 1.65 2.2161 0.9985 3178931 Maybridge4_000719 Clc1ccc(NC(=O)C(C#N)C(=O)c2cccs2)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 A16 compound treatment 0.076 0.00475 1.22 0.076 0.00194 0.54 1.2463 0.9324 1203853 Maybridge4_000720 CC1N(CCc2sccc12)C(=S)NC(=O)c3cccs3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 A17 compound treatment 0.073 0.00175 0.45 0.077 0.00294 0.82 0.8971 0.9605 3178932 Maybridge4_000721 CSc1nc(NS(=O)(=O)c2cc(cc(c2)C(F)(F)F)C(F)(F)F)nn1C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 A18 compound treatment 0.107 0.0357 9.2 0.101 0.0269 7.5 11.8133 0.9948 3063213 Maybridge4_000722 FC(F)(F)c1cccc(NC(=S)C(C#N)C(=O)N2CCCC2)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 A19 compound treatment 0.072 7.5E-4 0.19 0.076 0.00194 0.54 0.5181 0.904 3178933 Maybridge4_000723 Cc1nn(C)c(C)c1NC(=O)Nc2ccccc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 A20 compound treatment 0.077 0.00575 1.48 0.077 0.00294 0.82 1.6253 0.9609 1654657 Maybridge4_000724 Brc1ccc(Nc2ncnc3ccccc23)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 A21 compound treatment 0.073 0.00175 0.45 0.077 0.00294 0.82 0.8971 0.9605 1162031 Maybridge4_000725 Nc1n[nH]c(NC2CCCCNC2=O)n1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 A22 compound treatment 0.075 0.00375 0.97 0.077 0.00294 0.82 1.2612 0.9966 3179020 Maybridge4_000726 C1CCN2C(=CSC2=NC1)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 A23 mock treatment 0.074 0.00275 0.71 0.076 0.00194 0.54 0.8822 0.991 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 A24 positive control 0.076 0.00475 1.22 0.077 0.00294 0.82 1.4432 0.9809 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 B01 compound treatment 0.076 0.00475 1.22 0.082 0.00794 2.21 2.4279 0.961 1499601 Maybridge4_000727 S=C(Nc1ccccc1)Nc2ccccc2c3nc4ccccc4[nH]3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 B02 compound treatment 0.121 0.0498 12.81 0.121 0.0469 13.07 18.3006 0.9999 1693956 Maybridge4_000728 CSc1cc(nc(c1)c2ccc(Cl)cc2)c3cccs3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 B03 compound treatment 0.078 0.00675 1.74 0.081 0.00694 1.93 2.5951 0.9986 3063216 Maybridge4_000729 CN1CNC(=NC1)SCc2ccc(C#N)cc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 B04 compound treatment 0.118 0.0468 12.04 0.117 0.0429 11.96 16.9667 1.0 3179021 Maybridge4_000730 FC(F)(F)c1ccccc1NC(=O)N/C=C/c2ccsc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 B05 compound treatment 0.085 0.0138 3.54 0.088 0.0139 3.88 5.2479 0.9989 1138498 Maybridge4_000731 CN(C)c1ccc(cc1)C2Nc3cc(C)ccc3O2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 B06 compound treatment 0.072 7.5E-4 0.19 0.076 0.00194 0.54 0.5181 0.904 3179022 Maybridge4_000732 CC1=CC(=O)N(C1=O)c2ccn(C)n2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 B07 compound treatment 0.075 0.00375 0.97 0.076 0.00194 0.54 1.0643 0.9622 3179023 Maybridge4_000733 OC(=O)C1C(C2CC1C=C2)C(=O)Nc3ccc(Cl)cc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 B08 compound treatment 0.162 0.0907 23.37 0.171 0.0969 27.0 35.6112 0.9974 3063218 Maybridge4_000734 CCCc1c(cnn1c2ccccc2)c3nc(no3)c4ccc(Cl)cc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 B09 compound treatment 0.09 0.0187 4.83 0.095 0.0209 5.83 7.5367 0.9956 3179024 Maybridge4_000735 FC(F)(F)c1cccc(NC2(CCCCCC2)C#N)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 B10 compound treatment 0.07 -0.00125 -0.32 0.076 0.00194 0.54 0.154 0.2451 1512806 Maybridge4_000736 Cc1csc2c(ncnc12)N3CCSCC3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 B11 compound treatment 0.071 -2.5E-4 -0.06 0.08 0.00594 1.65 1.1237 0.6791 1281080 Maybridge4_000737 CS(=O)(=O)N1CCCN2C1c3ccccc3C2=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 B12 compound treatment 0.1 0.0288 7.4 0.097 0.0229 6.39 9.7512 0.9973 3179025 Maybridge4_000738 FC(F)(F)c1cc(cc(c1)C(F)(F)F)c2noc(n2)C3CCc4ccccc4O3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 B13 compound treatment 0.095 0.0238 6.11 0.095 0.0209 5.83 8.447 0.9997 3063220 Maybridge4_000739 Cc1c(C)c(C)c(CSCc2n[nH]c(=S)n2c3ccc(F)cc3)c(C)c1C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 B14 compound treatment 0.125 0.0537 13.84 0.123 0.0489 13.63 19.4227 1.0 3179026 Maybridge4_000740 Cc1csc2ncnc(Sc3ccccc3NS(=O)(=O)c4ccc(F)cc4)c12 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 B15 compound treatment 0.07 -0.00125 -0.32 0.075 9.37E-4 0.26 -0.043 -0.1037 3063222 Maybridge4_000741 CS/C(=N\C(=O)c1c(Cl)cccc1Cl)/N2CCCC2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 B16 compound treatment 0.111 0.0398 10.23 0.104 0.0299 8.34 13.1323 0.9948 1691561 Maybridge4_000742 Cc1csc2ncnc(N3CCN(CC3)C(=S)NCC4CC4)c12 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 B17 compound treatment 0.184 0.113 29.03 0.179 0.105 29.22 41.1919 1.0 1442583 Maybridge4_000743 Cc1ccc(C(=S)N)c(O)n1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 B18 compound treatment 0.075 0.00375 0.97 0.077 0.00294 0.82 1.2612 0.9966 1597708 Maybridge4_000744 COc1cc2CCNC(=O)c2cc1OC 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 B19 compound treatment 0.082 0.0107 2.77 0.081 0.00694 1.93 3.3233 0.9846 3179027 Maybridge4_000745 FC(F)(F)Oc1ccc(cc1)n2c(=N)c(/N=C/c3ccc(cc3)C(F)(F)F)c(C#N)[nH]c2=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 B20 compound treatment 0.136 0.0648 16.67 0.136 0.0619 17.25 23.9853 0.9999 1614161 Maybridge4_000746 Cc1csc(NC(=O)NS(=O)(=O)c2ccc(C)cc2)c1C(=O)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 B21 compound treatment 0.148 0.0767 19.76 0.139 0.0649 18.08 26.7608 0.999 3179028 Maybridge4_000747 Cc1csc(NC(=O)CSc2ccc(Cl)cc2)c1C(=O)N 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 B22 compound treatment 0.1 0.0288 7.4 0.098 0.0239 6.67 9.9481 0.9986 3063278 Maybridge4_000748 NNC(=S)Nc1ccccc1Cl 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 B23 mock treatment 0.071 -2.5E-4 -0.06 0.074 -6.25E-5 -0.02 -0.0578 -0.8672 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 B24 positive control 0.074 0.00275 0.71 0.076 0.00194 0.54 0.8822 0.991 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 C01 compound treatment 0.085 0.0138 3.54 0.093 0.0189 5.27 6.2326 0.9812 3179029 Maybridge4_000749 Cc1cc(C)n(Cc2c(Cl)cccc2Cl)n1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 C02 compound treatment 0.076 0.00475 1.22 0.079 0.00494 1.38 1.8371 0.9983 3063279 Maybridge4_000750 CC1SCC(CS1)NC(=O)c2ccccc2Cl 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 C03 compound treatment 0.073 0.00175 0.45 0.075 9.37E-4 0.26 0.5032 0.9663 3179030 Maybridge4_000751 CC(C)(C)n1cnnc1S 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 C04 compound treatment 0.076 0.00475 1.22 0.075 9.37E-4 0.26 1.0494 0.8392 3179031 Maybridge4_000752 Cc1c(cnn1c2ccc(Cl)cc2)C(=O)N 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 C05 compound treatment 0.566 0.495 127.38 0.572 0.498 138.67 188.1298 0.9991 3063283 Maybridge4_000753 CN(C)/C=c/1\s\c(=C\C(=O)c2cccs2)\[nH]c1=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 C06 compound treatment 0.134 0.0628 16.16 0.143 0.0689 19.2 24.9997 0.9963 3179032 Maybridge4_000754 Fc1ccc(c2ccc(o2)c3ccnn3S(=O)(=O)c4ccc(F)cc4F)c(F)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 C07 compound treatment 0.075 0.00375 0.97 0.081 0.00694 1.93 2.0489 0.9486 3063284 Maybridge4_000755 FC(F)(F)c1cc(cc(c1)S(=O)(=O)NC(=N)N2CCSCC2)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 C08 compound treatment 0.076 0.00475 1.22 0.094 0.0199 5.55 4.791 0.8427 3179033 Maybridge4_000756 NC(=O)N/C(=N/O)/CSCc1ccc(Cl)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 C09 compound treatment 0.078 0.00675 1.74 0.078 0.00394 1.1 2.0043 0.9753 3063285 Maybridge4_000757 Fc1cc(CSc2ccc(Cl)cc2)c3OCOCc3c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 C10 compound treatment 0.07 -0.00125 -0.32 0.076 0.00194 0.54 0.154 0.2451 1433051 Maybridge4_000758 CCOC(=O)Cc1nc(N)ncc1C(=O)OCC 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 C11 compound treatment 0.069 -0.00225 -0.58 0.091 0.0169 4.72 2.9258 0.6156 1461982 Maybridge4_000759 Cc1onc(c1C(O)c2ccc(F)cc2)c3c(Cl)cccc3Cl 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 C12 compound treatment 0.095 0.0238 6.11 0.105 0.0309 8.62 10.4163 0.9859 1346508 Maybridge4_000760 COc1ccc2C(NN(C)c3cccc(F)c3C#N)OC(=O)c2c1OC 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 C13 compound treatment 0.098 0.0267 6.89 0.095 0.0209 5.83 8.9932 0.9966 3179034 Maybridge4_000761 CN(C)/C=N/C(=S)NC1CC2CC1C=C2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 C14 compound treatment 0.07 -0.00125 -0.32 0.077 0.00294 0.82 0.3509 0.3991 1675569 Maybridge4_000762 C(N1CC(CN(Cc2ccccc2)C1)c3nn[nH]n3)c4ccccc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 C15 compound treatment 0.07 -0.00125 -0.32 0.072 -0.00206 -0.57 -0.6337 -0.9625 3063288 Maybridge4_000763 CNC(=O)n1cc(c(C)n1)c2ccccc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 C16 compound treatment 0.074 0.00275 0.71 0.076 0.00194 0.54 0.8822 0.991 1260907 Maybridge4_000764 CC1N(CCc2sccc12)S(=O)(=O)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 C17 compound treatment 0.076 0.00475 1.22 0.081 0.00694 1.93 2.2309 0.9757 1246781 Maybridge4_000765 CN(C)c1cccc(N(C)C)c1CNC(=O)c2ccccc2F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 C18 compound treatment 0.131 0.0597 15.38 0.125 0.0509 14.19 20.9089 0.9992 3179035 Maybridge4_000766 FC(F)(F)c1cccc(NC(=O)C(C#N)C(=S)Nc2ccccc2Cl)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 C19 compound treatment 0.068 -0.00325 -0.84 0.073 -0.00106 -0.3 -0.8009 -0.9024 3063289 Maybridge4_000767 CNC(=O)N1CCCC(Cn2cccc2)C1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 C20 compound treatment 0.07 -0.00125 -0.32 0.072 -0.00206 -0.57 -0.6337 -0.9625 1385501 Maybridge4_000768 Cc1ccc(cc1)c2csc(=N)n2c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 C21 compound treatment 0.077 0.00575 1.48 0.076 0.00194 0.54 1.4284 0.9065 1144063 Maybridge4_000769 Clc1ccc(NC(=O)NC2CCCCNC2=O)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 C22 compound treatment 0.071 -2.5E-4 -0.06 0.073 -0.00106 -0.3 -0.2547 -0.8413 3179036 Maybridge4_000770 CC1CN=C(N1)SCc2c(C)c(C)c(C)c(C)c2C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 C23 mock treatment 0.07 -0.00125 -0.32 0.075 9.37E-4 0.26 -0.043 -0.1037 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 C24 positive control 0.08 0.00875 2.25 0.077 0.00294 0.82 2.1715 0.906 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 D01 compound treatment 0.074 0.00275 0.71 0.079 0.00494 1.38 1.473 0.9524 3063290 Maybridge4_000771 CSC1=NCCN1Cc2ccccc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 D02 compound treatment 0.127 0.0558 14.35 0.149 0.0749 20.87 24.9068 0.9833 3179037 Maybridge4_000772 COC(=O)c1sc(cc1NC(=O)Nc2ccc(Cl)cc2)C(C)(C)C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 D03 compound treatment 0.092 0.0208 5.34 0.1 0.0259 7.22 8.8855 0.989 3063291 Maybridge4_000773 Cc1ccc(Cc2nc(cs2)c3ccc(Cl)cc3)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 D04 compound treatment 0.108 0.0367 9.46 0.112 0.0379 10.57 14.1615 0.9985 3179038 Maybridge4_000774 FC(F)(F)c1cc(SC(=O)N/C=C/c2ccsc2)cc(c1)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 D05 compound treatment 0.076 0.00475 1.22 0.08 0.00594 1.65 2.034 0.989 1247834 Maybridge4_000775 CC(C)(C)CC(C)(C)N1CNC(=S)NC1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 D06 compound treatment 0.068 -0.00325 -0.84 0.073 -0.00106 -0.3 -0.8009 -0.9024 3179039 Maybridge4_000776 Cn1cc(Br)c(n1)N2C(=O)C=CC2=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 D07 compound treatment 0.083 0.0118 3.03 0.093 0.0189 5.27 5.8685 0.9652 3179040 Maybridge4_000777 COc1cc(cc(OC)c1OC)C(O)c2cc(cc(c2)C(F)(F)F)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 D08 compound treatment 0.111 0.0398 10.23 0.116 0.0419 11.68 15.4954 0.9978 3063293 Maybridge4_000778 CCCc1nn(cc1C(=O)Nc2ccc(Cl)cc2)c3ccc(Cl)cc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 D09 compound treatment 0.082 0.0107 2.77 0.086 0.0119 3.32 4.3079 0.9959 1432923 Maybridge4_000779 CC(NC(=O)c1c(C)onc1c2ccccc2Cl)c3ccc(C)cc3C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 D10 compound treatment 0.099 0.0278 7.14 0.124 0.0499 13.91 14.8861 0.9521 3179041 Maybridge4_000780 FC(F)(F)c1c(cnn1c2ccc(Cl)cc2)C(=O)NCCc3ccc(Cl)cc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 D11 compound treatment 0.093 0.0217 5.6 0.102 0.0279 7.78 9.4614 0.987 3179119 Maybridge4_000781 COc1cc(cc(OC)c1OC)C(=O)N2/C(=N/c3ccccc3Cl)/SC(=C)C2(C)C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 D12 compound treatment 0.077 0.00575 1.48 0.09 0.0159 4.44 4.1853 0.8945 3062512 Maybridge4_000782 COC(=O)c1cnc(NN2C(=O)C=C(C)C2=O)nc1C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 D13 compound treatment 0.072 7.5E-4 0.19 0.071 -0.00306 -0.85 -0.4665 -0.5335 1164825 Maybridge4_000783 NNC(=O)Oc1ccccc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 D14 compound treatment 0.069 -0.00225 -0.58 0.078 0.00394 1.1 0.3658 0.2949 3179120 Maybridge4_000784 COC(=O)c1sccc1Oc2ccc(cc2NC(=O)/C=C/C(=O)O)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 D15 compound treatment 0.068 -0.00325 -0.84 0.074 -6.25E-5 -0.02 -0.604 -0.7217 3062514 Maybridge4_000785 Clc1cccc(Cl)c1C(=O)N=C2NCCCN2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 D16 compound treatment 0.072 7.5E-4 0.19 0.078 0.00394 1.1 0.9119 0.819 3179121 Maybridge4_000786 FC(F)(F)c1cccc(c1)S(=O)(=O)N2CCCCC2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 D17 compound treatment 0.077 0.00575 1.48 0.083 0.00894 2.49 2.8069 0.9692 3062515 Maybridge4_000787 CCOC(=O)C1=C(C)NC(=NC1c2cccs2)SC 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 D18 compound treatment 0.141 0.0698 17.96 0.149 0.0749 20.87 27.4556 0.9972 3179122 Maybridge4_000788 CCOC(=O)c1cnc(SCc2c(C)cc(C)cc2C)nc1C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 D19 compound treatment 0.099 0.0278 7.14 0.098 0.0239 6.67 9.766 0.9994 1515946 Maybridge4_000789 Fc1ccc(cc1)C(=O)ON(C2C3CC4CC(C3)CC2C4)C(=O)c5ccc(F)cc5 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 D20 compound treatment 0.069 -0.00225 -0.58 0.073 -0.00106 -0.3 -0.6189 -0.9514 1700551 Maybridge4_000790 COC(=O)CNS(=O)(=O)c1ccsc1C(=O)OC 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 D21 compound treatment 0.107 0.0357 9.2 0.111 0.0369 10.29 13.7825 0.9985 1564868 Maybridge4_000791 Clc1cc(Cl)cc(c1)c2nnc(o2)N3CCCC3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 D22 compound treatment 0.069 -0.00225 -0.58 0.072 -0.00206 -0.57 -0.8158 -1.0 3179123 Maybridge4_000792 COc1cc2ncnc(NCCCn3ccnc3)c2cc1OC 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 D23 mock treatment 0.069 -0.00225 -0.58 0.074 -6.25E-5 -0.02 -0.4219 -0.728 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 D24 positive control 0.078 0.00675 1.74 0.078 0.00394 1.1 2.0043 0.9753 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 E01 compound treatment 0.071 -2.5E-4 -0.06 0.076 0.00194 0.54 0.336 0.6184 3062517 Maybridge4_000793 CCc1nc2ccccc2nc1CC 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 E02 compound treatment 0.152 0.0808 20.79 0.158 0.0839 23.38 31.2306 0.9983 3179124 Maybridge4_000794 Cc1nc(S)c(C#N)c(C)c1Cc2ccc(Cl)cc2Cl 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 E03 compound treatment 0.071 -2.5E-4 -0.06 0.077 0.00294 0.82 0.533 0.6495 3062519 Maybridge4_000795 Fc1cccc(CSCc2c(F)cccc2Cl)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 E04 compound treatment 0.068 -0.00325 -0.84 0.073 -0.00106 -0.3 -0.8009 -0.9024 3179125 Maybridge4_000796 CN(C)/C=N/S(=O)(=O)c1c(C)noc1C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 E05 compound treatment 0.071 -2.5E-4 -0.06 0.076 0.00194 0.54 0.336 0.6184 3062520 Maybridge4_000797 CCOc1ccccc1CCC(=O)O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 E06 compound treatment 0.131 0.0597 15.38 0.132 0.0579 16.14 22.2873 0.9997 3179126 Maybridge4_000798 COc1ccc(NS(=O)(=O)c2ccc(Oc3c(C#N)cccc3C#N)cc2)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 E07 compound treatment 0.073 0.00175 0.45 0.076 0.00194 0.54 0.7001 0.996 3062522 Maybridge4_000799 Clc1ccc(cc1)S(=O)(=O)NC(=N)N2CCSCC2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 E08 compound treatment 0.132 0.0607 15.64 0.138 0.0639 17.81 23.6509 0.9979 3179127 Maybridge4_000800 FC(F)(F)COc1ccc(OCC(F)(F)F)c(c1)c2ccnc(NC(=O)Nc3ccccc3)n2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 E09 compound treatment 0.101 0.0297 7.66 0.099 0.0249 6.94 10.3271 0.9988 1521882 Maybridge4_000801 Clc1ccccc1C(=O)NC(=O)OCc2cccc(Oc3ccccc3)c2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 E10 compound treatment 0.225 0.154 39.59 0.219 0.145 40.36 56.5333 1.0 3179128 Maybridge4_000802 O=C(c1ccccc1)n2cc3SCc4ccccc4-c3n2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 E11 compound treatment 0.075 0.00375 0.97 0.091 0.0169 4.72 4.0181 0.8345 1615025 Maybridge4_000803 Fc1ccc(cc1)C(=O)CCC(=O)c2ccc(F)cc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 E12 compound treatment 0.128 0.0568 14.61 0.117 0.0429 11.96 18.7873 0.995 1276755 Maybridge4_000804 CN(n1cnc2ccsc2c1=O)S(=O)(=O)c3ccc(Cl)cc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 E13 compound treatment 0.109 0.0377 9.72 0.103 0.0289 8.06 12.5712 0.9957 1254744 Maybridge4_000805 Clc1ccc(NC(=O)NC(=O)C2(CC3CC4CC(C3)C2)C4)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 E14 compound treatment 0.069 -0.00225 -0.58 0.078 0.00394 1.1 0.3658 0.2949 1341148 Maybridge4_000806 O=C(Nc1ccccc1)n2nnc(n2)C3CN(Cc4ccccc4)CN(Cc5ccccc5)C3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 E15 compound treatment 0.07 -0.00125 -0.32 0.072 -0.00206 -0.57 -0.6337 -0.9625 1687071 Maybridge4_000807 CNC(=O)NCc1c(cccc1N(C)C)N(C)C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 E16 compound treatment 0.097 0.0257 6.63 0.095 0.0209 5.83 8.8111 0.998 3179129 Maybridge4_000808 NC(=O)/C(=C/1\SC=C(N1Cc2ccccc2)c3ccccc3)/C#N 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 E17 compound treatment 0.072 7.5E-4 0.19 0.074 -6.25E-5 -0.02 0.1242 0.6408 3062558 Maybridge4_000809 CCc1cnc(/N=C/N(C)C)nc1c2c(F)cccc2F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 E18 compound treatment 0.076 0.00475 1.22 0.077 0.00294 0.82 1.4432 0.9809 3179130 Maybridge4_000810 Cc1nc(c(s1)c2ccccc2)c3ccc(Cl)cc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 E19 compound treatment 0.076 0.00475 1.22 0.076 0.00194 0.54 1.2463 0.9324 3062560 Maybridge4_000811 COC(CNC(=S)Nc1ccccc1Cl)OC 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 E20 compound treatment 0.101 0.0297 7.66 0.101 0.0269 7.5 10.7209 0.9999 1542710 Maybridge4_000812 COc1ccc(CCn2nnc3ccccc3c2=O)cc1OC 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 E21 compound treatment 0.068 -0.00325 -0.84 0.072 -0.00206 -0.57 -0.9978 -0.9832 1303354 Maybridge4_000813 CC(C)NC(=O)NC1CCCCNC1=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 E22 compound treatment 0.07 -0.00125 -0.32 0.073 -0.00106 -0.3 -0.4368 -0.9991 3062562 Maybridge4_000814 O=C(N1C(Oc2ccccc12)c3ccc4OCOc4c3)c5ccccc5 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 E23 mock treatment 0.07 -0.00125 -0.32 0.077 0.00294 0.82 0.3509 0.3991 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 E24 positive control 0.079 0.00775 2.0 0.078 0.00394 1.1 2.1863 0.9603 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 F01 compound treatment 0.077 0.00575 1.48 0.079 0.00494 1.38 2.0192 0.9993 3179131 Maybridge4_000815 CN1CNC(=NC1)SCc2c(C)c(C)c(C)c(C)c2C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 F02 compound treatment 0.071 -2.5E-4 -0.06 0.075 9.37E-4 0.26 0.1391 0.5173 3062563 Maybridge4_000816 Cn1ncc(C(=O)O)c1C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 F03 compound treatment 0.071 -2.5E-4 -0.06 0.081 0.00694 1.93 1.3207 0.6832 3179132 Maybridge4_000817 C(SC1=NCCCN1C2CCCCC2)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 F04 compound treatment 0.129 0.0578 14.87 0.136 0.0619 17.25 22.7109 0.9973 3062565 Maybridge4_000818 Cc1cc(SC(=O)N/C=C/c2ccco2)c(C)cc1Cl 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 F05 compound treatment 0.085 0.0138 3.54 0.087 0.0129 3.6 5.051 1.0 1151481 Maybridge4_000819 CC(=O)Nc1ccc(cc1)C2Nc3cc(C)ccc3O2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 F06 compound treatment 0.078 0.00675 1.74 0.08 0.00594 1.65 2.3981 0.9997 1566379 Maybridge4_000820 O=C1CCC(=O)N1c2sc3CCCCc3c2C#N 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 F07 compound treatment 0.121 0.0498 12.81 0.119 0.0449 12.51 17.9067 0.9999 1625831 Maybridge4_000821 CC(C)(C)n1c(n[nH]c1=S)c2ccncc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 F08 compound treatment 0.161 0.0897 23.11 0.176 0.102 28.39 36.4138 0.9948 3179133 Maybridge4_000822 CCCc1c(cnn1c2ccccc2)C(=O)Sc3ccc(Cl)cc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 F09 compound treatment 0.08 0.00875 2.25 0.086 0.0119 3.32 3.9438 0.982 1730421 Maybridge4_000823 CC(NC(=O)c1ccccc1C(=O)NC(C)c2ccc3OCCOc3c2)c4ccc5OCCOc5c4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 F10 compound treatment 0.106 0.0348 8.95 0.101 0.0269 7.5 11.6312 0.9962 3062566 Maybridge4_000824 COC(=O)c1sccc1NN2C(=O)c3ccccc3C2=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 F11 compound treatment 0.117 0.0457 11.78 0.125 0.0509 14.19 18.36 0.9957 1672433 Maybridge4_000825 Cc1ccc(cc1)S(=O)(=O)N(Cc2ccccc2)C(C#N)c3ccc4OCOc4c3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 F12 compound treatment 0.074 0.00275 0.71 0.076 0.00194 0.54 0.8822 0.991 3179134 Maybridge4_000826 COC(=O)c1cnc(NN2C(=O)CCC2=O)nc1C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 F13 compound treatment 0.092 0.0208 5.34 0.079 0.00494 1.38 4.75 0.861 3179135 Maybridge4_000827 FC(F)(F)c1cccc(NC(=S)N(CCC#N)C2CCCCC2)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 F14 compound treatment 0.069 -0.00225 -0.58 0.079 0.00494 1.38 0.5627 0.3771 3062567 Maybridge4_000828 COC(=O)c1c(C)sc2c(cc(=O)[nH]c12)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 F15 compound treatment 0.069 -0.00225 -0.58 0.075 9.37E-4 0.26 -0.225 -0.3541 3062568 Maybridge4_000829 Clc1cccc(Cl)c1C(=O)N=C2NCCN2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 F16 compound treatment 0.164 0.0927 23.88 0.164 0.0899 25.05 34.5969 0.9997 1243939 Maybridge4_000830 COC(=O)c1ccsc1NC(=O)c2ccc(C)cc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 F17 compound treatment 0.13 0.0587 15.13 0.127 0.0529 14.74 21.1207 0.9999 3062570 Maybridge4_000831 S=C1CCc2ccccc2N1Cc3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 F18 compound treatment 0.146 0.0747 19.25 0.155 0.0809 22.54 29.5475 0.9969 3179136 Maybridge4_000832 COC(=O)c1sccc1Oc2ccc(cc2NC(=O)c3ccc(Cl)cc3)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 F19 compound treatment 0.078 0.00675 1.74 0.08 0.00594 1.65 2.3981 0.9997 3179137 Maybridge4_000833 FC(F)(F)Oc1ccc(NC(=O)N/C(=C(\N=C/c2ccc(Cl)cc2)/C#N)/C#N)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 F20 compound treatment 0.083 0.0118 3.03 0.071 -0.00306 -0.85 1.5361 0.4887 1627087 Maybridge4_000834 COC(=O)c1cc(OC)c(OC)cc1NC(=O)C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 F21 compound treatment 0.07 -0.00125 -0.32 0.073 -0.00106 -0.3 -0.4368 -0.9991 3062571 Maybridge4_000835 FC(F)(F)c1cc(cc(c1)C(F)(F)F)c2nnc(o2)N3CCOCC3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 F22 compound treatment 0.068 -0.00325 -0.84 0.074 -6.25E-5 -0.02 -0.604 -0.7217 3179138 Maybridge4_000836 COc1cc2ncnc(NCCCN3CCOCC3)c2cc1OC 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 F23 mock treatment 0.07 -0.00125 -0.32 0.072 -0.00206 -0.57 -0.6337 -0.9625 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 F24 positive control 0.08 0.00875 2.25 0.077 0.00294 0.82 2.1715 0.906 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 G01 compound treatment 0.073 0.00175 0.45 0.079 0.00494 1.38 1.2909 0.8921 3179214 Maybridge4_000837 CC(C)(C)C(=N)NS(=O)(=O)c1cc(cc(c1)C(F)(F)F)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 G02 compound treatment 0.103 0.0318 8.17 0.114 0.0399 11.12 13.645 0.9885 1694181 Maybridge4_000838 O=C(Nc1ccccc1)Nc2ccccc2C(=O)NC3CCSC3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 G03 compound treatment 0.07 -0.00125 -0.32 0.074 -6.25E-5 -0.02 -0.2399 -0.7443 3179215 Maybridge4_000839 Cc1onc(c1CSc2nncn2C(C)(C)C)c3c(Cl)cccc3Cl 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 G04 compound treatment 0.075 0.00375 0.97 0.078 0.00394 1.1 1.4581 0.998 3062572 Maybridge4_000840 FC(F)(F)c1cccc(c1)C(C#N)c2cccc(c2)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 G05 compound treatment 0.171 0.0998 25.68 0.177 0.103 28.67 38.4313 0.9985 3179216 Maybridge4_000841 CN(C)/C=C/1\CC(=C(O)C1=O)C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 G06 compound treatment 0.088 0.0168 4.31 0.087 0.0129 3.6 5.5972 0.996 3062573 Maybridge4_000842 CSc1cc(nn1S(=O)(=O)c2ccc(F)cc2F)C(C)(C)C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 G07 compound treatment 0.12 0.0488 12.55 0.117 0.0429 11.96 17.3308 0.9997 3179217 Maybridge4_000843 Fc1ccc(NC(=O)NC(=O)Cc2c(F)cccc2Cl)cc1Cl 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 G08 compound treatment 0.086 0.0147 3.8 0.086 0.0119 3.32 5.0362 0.9978 1112281 Maybridge4_000844 Clc1ccc(cc1)S(=O)(=O)NCc2ccccc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 G09 compound treatment 0.073 0.00175 0.45 0.077 0.00294 0.82 0.8971 0.9605 3179218 Maybridge4_000845 CC(C)(C)c1nc(NC(=N)N)sc1Br 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 G10 compound treatment 0.067 -0.00425 -1.09 0.087 0.0129 3.6 1.774 0.4711 1361037 Maybridge4_000846 N#CC1CN(Cc2cccs2)CN(Cc3cccs3)C1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 G11 compound treatment 0.107 0.0357 9.2 0.106 0.0319 8.89 12.7979 0.9999 3062574 Maybridge4_000847 CSCC(CSC)OC(=O)c1c(C)onc1c2c(Cl)cccc2Cl 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 G12 compound treatment 0.08 0.00875 2.25 0.094 0.0199 5.55 5.5192 0.9211 3179219 Maybridge4_000848 CN(n1cnc2ccsc2c1=O)S(=O)(=O)c3cc(cc(c3)C(F)(F)F)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 G13 compound treatment 0.118 0.0468 12.04 0.121 0.0469 13.07 17.7544 0.9992 3179220 Maybridge4_000849 CN(C)/C=N/C1=C(C(=O)c2ccccc12)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 G14 compound treatment 0.068 -0.00325 -0.84 0.076 0.00194 0.54 -0.2101 -0.2111 3062606 Maybridge4_000850 CC1N(CCc2sccc12)C(=O)c3ccc(cc3)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 G15 compound treatment 0.07 -0.00125 -0.32 0.073 -0.00106 -0.3 -0.4368 -0.9991 1282646 Maybridge4_000851 CN(C(=O)Nc1ccc(Cl)cc1)n2cnc3ccccc3c2=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 G16 compound treatment 0.102 0.0308 7.92 0.103 0.0289 8.06 11.2968 1.0 3179221 Maybridge4_000852 CCOC(=O)/C(=C/1\SC=C(N1c2c(C)cccc2C)c3ccccc3)/C#N 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 G17 compound treatment 0.073 0.00175 0.45 0.076 0.00194 0.54 0.7001 0.996 3062608 Maybridge4_000853 CNC(=O)n1cc(C)c(n1)c2cccs2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 G18 compound treatment 0.073 0.00175 0.45 0.075 9.37E-4 0.26 0.5032 0.9663 1645665 Maybridge4_000854 Cc1ccc(cc1C)c2nn(CCO)c(=O)c3ccccc23 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 G19 compound treatment 0.071 -2.5E-4 -0.06 0.075 9.37E-4 0.26 0.1391 0.5173 1361478 Maybridge4_000855 Cc1nn(C)c(C)c1Nc2nc(N)n[nH]2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 G20 compound treatment 0.067 -0.00425 -1.09 0.072 -0.00206 -0.57 -1.1799 -0.9547 3179222 Maybridge4_000856 CC1CN(CC(C)O1)C(=N)N 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 G21 compound treatment 0.077 0.00575 1.48 0.077 0.00294 0.82 1.6253 0.9609 3062610 Maybridge4_000857 Clc1ccc(SS(=O)(=O)CS(=O)(=O)Sc2ccc(Cl)cc2)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 G22 compound treatment 0.107 0.0357 9.2 0.112 0.0379 10.57 13.9794 0.9976 3179223 Maybridge4_000858 Clc1ccc(cc1Cl)C2Nc3ccccc3O2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 G23 mock treatment 0.075 0.00375 0.97 0.073 -0.00106 -0.3 0.4735 0.4689 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 G24 positive control 0.08 0.00875 2.25 0.078 0.00394 1.1 2.3684 0.9453 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 H01 compound treatment 0.074 0.00275 0.71 0.082 0.00794 2.21 2.0638 0.8891 3062611 Maybridge4_000859 CCN1CNC(=NC1)SCc2c(C)c(C)c(C)c(C)c2C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 H02 compound treatment 0.071 -2.5E-4 -0.06 0.077 0.00294 0.82 0.533 0.6495 3179224 Maybridge4_000860 CCOC(=O)c1sc(SC)nc1NS(=O)(=O)c2cc(cc(c2)C(F)(F)F)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 H03 compound treatment 0.072 7.5E-4 0.19 0.077 0.00294 0.82 0.715 0.8506 1702677 Maybridge4_000861 COc1ccc(CCNC(=O)c2nc3ccccc3c(=O)[nH]2)cc1OC 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 H04 compound treatment 0.135 0.0638 16.41 0.147 0.0729 20.31 25.9694 0.9944 1349117 Maybridge4_000862 CCOC(=O)c1cnn(C)c1NS(=O)(=O)c2ccc(Cl)cc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 H05 compound treatment 0.078 0.00675 1.74 0.079 0.00494 1.38 2.2012 0.9933 3179225 Maybridge4_000863 COc1ccc(C/N=C/c2ccc(NC(=O)C)cc2)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 H06 compound treatment 0.076 0.00475 1.22 0.078 0.00394 1.1 1.6402 0.9985 3062612 Maybridge4_000864 FC(F)(F)c1ccc(NS(=O)(=O)c2ccc(cc2)N3C(=O)C=CC3=O)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 H07 compound treatment 0.073 0.00175 0.45 0.084 0.00994 2.77 2.2755 0.8115 1216743 Maybridge4_000865 Clc1ccc(cc1)C(=C)NCc2ccco2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 H08 compound treatment 0.147 0.0757 19.5 0.159 0.0849 23.65 30.5172 0.9954 3062613 Maybridge4_000866 CSc1cc(nn1S(=O)(=O)c2ccc(C)cc2)c3ccc(F)cc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 H09 compound treatment 0.072 7.5E-4 0.19 0.092 0.0179 5.0 3.6689 0.7339 1649762 Maybridge4_000867 CC1C(OCCN1C(=O)CCN2C(=O)c3ccccc3C2=O)c4ccccc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 H10 compound treatment 0.069 -0.00225 -0.58 0.074 -6.25E-5 -0.02 -0.4219 -0.728 3062614 Maybridge4_000868 COC(=O)c1scc(C)c1NN2C(=O)C=C(C)C2=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 H11 compound treatment 0.111 0.0398 10.23 0.116 0.0419 11.68 15.4954 0.9978 1683075 Maybridge4_000869 CC1CC(CC(C)(C)C1)N(CCC#N)S(=O)(=O)c2ccc(Br)cc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 H12 compound treatment 0.107 0.0357 9.2 0.111 0.0369 10.29 13.7825 0.9985 3062615 Maybridge4_000870 COC(=O)c1sc2cc(sc2c1C)c3ccc(F)cc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 H13 compound treatment 0.072 7.5E-4 0.19 0.072 -0.00206 -0.57 -0.2696 -0.4449 3179226 Maybridge4_000871 Cc1ccc(NC(=S)N(CCC#N)C2CCCCC2)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 H14 compound treatment 0.084 0.0127 3.28 0.087 0.0129 3.6 4.869 0.9989 3062616 Maybridge4_000872 COC(=O)c1cc2c(nn(C)c2s1)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 H15 compound treatment 0.102 0.0308 7.92 0.106 0.0319 8.89 11.8876 0.9983 3179227 Maybridge4_000873 COc1ccc(cc1)c2c(N)nc(nc2SC)c3ccc(Cl)cc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 H16 compound treatment 0.071 -2.5E-4 -0.06 0.079 0.00494 1.38 0.9268 0.6733 3179228 Maybridge4_000874 CC(=O)N(c1ccc(cc1)C(F)(F)F)S(=O)(=O)c2ccc(cc2)N3C(=O)CCC3=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 H17 compound treatment 0.116 0.0447 11.52 0.117 0.0429 11.96 16.6026 0.9998 1612694 Maybridge4_000875 Nc1nc2Oc3ccc(Br)cc3C4C(C#N)C(O)(Nc(c1C#N)c42)c5ccccc5 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 H18 compound treatment 0.073 0.00175 0.45 0.076 0.00194 0.54 0.7001 0.996 1678485 Maybridge4_000876 Cn1nccc1NS(=O)(=O)c2ccc(NS(=O)(=O)c3ccc(Cl)cc3)cc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 H19 compound treatment 0.074 0.00275 0.71 0.076 0.00194 0.54 0.8822 0.991 3062617 Maybridge4_000877 CC(C)/N=C/c1ccc(cc1)c2ccccc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 H20 compound treatment 0.07 -0.00125 -0.32 0.072 -0.00206 -0.57 -0.6337 -0.9625 3179229 Maybridge4_000878 Cn1nccc1NC(=O)/C=C/C(=O)O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 H21 compound treatment 0.07 -0.00125 -0.32 0.072 -0.00206 -0.57 -0.6337 -0.9625 3062618 Maybridge4_000879 Cn1ccc(NC(=O)NC(=O)c2c(F)cccc2F)n1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 H22 compound treatment 0.069 -0.00225 -0.58 0.072 -0.00206 -0.57 -0.8158 -1.0 1656689 Maybridge4_000880 OCCNc1ncnc2sc3CCCCc3c12 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 H23 mock treatment 0.07 -0.00125 -0.32 0.072 -0.00206 -0.57 -0.6337 -0.9625 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 H24 positive control 0.08 0.00875 2.25 0.078 0.00394 1.1 2.3684 0.9453 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 I01 compound treatment 0.072 7.5E-4 0.19 0.08 0.00594 1.65 1.3058 0.7844 3062619 Maybridge4_000881 Cc1n[nH]c(C)c1Cc2c(F)cccc2Cl 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 I02 compound treatment 0.069 -0.00225 -0.58 0.075 9.37E-4 0.26 -0.225 -0.3541 1705532 Maybridge4_000882 O=C(Nc1ccccc1)N2CCCC2c3cccs3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 I03 compound treatment 0.115 0.0437 11.26 0.124 0.0499 13.91 17.799 0.9945 3062620 Maybridge4_000883 Nc1ccccc1C2C=NNC2=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 I04 compound treatment 0.107 0.0357 9.2 0.097 0.0229 6.39 11.0256 0.9841 3179230 Maybridge4_000884 Fc1c(COC(=O)c2ccccc2)cccc1COC(=O)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 I05 compound treatment 0.241 0.17 43.71 0.252 0.178 49.55 65.9448 0.998 3062621 Maybridge4_000885 CSC(=S)N(C)/N=C/c1cc(Cl)cc(Cl)c1O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 I06 compound treatment 0.109 0.0377 9.72 0.108 0.0339 9.45 13.5559 0.9999 3179231 Maybridge4_000886 Cc1nc(NC(=N)NC(=O)Nc2ccc(Cl)cc2)sc1Br 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 I07 compound treatment 0.079 0.00775 2.0 0.084 0.00994 2.77 3.3679 0.9871 3062622 Maybridge4_000887 Fc1ccccc1C(=O)Oc2ccc(Cl)c(Cl)c2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 I08 compound treatment 0.129 0.0578 14.87 0.129 0.0549 15.3 21.3324 0.9999 3179232 Maybridge4_000888 Clc1ccc(cc1)S(=O)(=O)N(Cc2ccccc2)S(=O)(=O)c3ccc(Cl)cc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 I09 compound treatment 0.107 0.0357 9.2 0.108 0.0339 9.45 13.1917 0.9999 1166421 Maybridge4_000889 Fc1cc(CSc2nc3ccccc3s2)c4OCOCc4c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 I10 compound treatment 0.094 0.0227 5.86 0.096 0.0219 6.11 8.4619 0.9998 1473503 Maybridge4_000890 OC(=O)C1(CN(CCc2ccc(Cl)cc2)CN(CCc3ccc(Cl)cc3)C1)C#N 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 I11 compound treatment 0.084 0.0127 3.28 0.078 0.00394 1.1 3.0966 0.8947 3179233 Maybridge4_000891 FC(F)(F)c1cc(NC(=O)C2(CC3CC4CC(C3)C2)C4)cc(c1)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 I12 compound treatment 0.072 7.5E-4 0.19 0.075 9.37E-4 0.26 0.3212 0.989 3062667 Maybridge4_000892 COc1cccc(OC)c1SC 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 I13 compound treatment 0.072 7.5E-4 0.19 0.074 -6.25E-5 -0.02 0.1242 0.6408 3062668 Maybridge4_000893 C/C(=N\O)/Cc1ncn(n1)c2cc(C)on2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 I14 compound treatment 0.068 -0.00325 -0.84 0.074 -6.25E-5 -0.02 -0.604 -0.7217 3179234 Maybridge4_000894 Clc1ccc(/C=N/N2CCOCC2)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 I15 compound treatment 0.068 -0.00325 -0.84 0.073 -0.00106 -0.3 -0.8009 -0.9024 3062670 Maybridge4_000895 OCCCc1cc(n[nH]1)c2ccccc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 I16 compound treatment 0.076 0.00475 1.22 0.082 0.00794 2.21 2.4279 0.961 3179329 Maybridge4_000896 O=C(CC#N)Nc1ccncc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 I17 compound treatment 0.074 0.00275 0.71 0.076 0.00194 0.54 0.8822 0.991 3062671 Maybridge4_000897 CN(C)/C=C/C(=O)c1nnn(c1C)c2ccccc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 I18 compound treatment 0.073 0.00175 0.45 0.075 9.37E-4 0.26 0.5032 0.9663 1670735 Maybridge4_000898 OCCn1nc(c2ccc(F)cc2)c3ccccc3c1=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 I19 compound treatment 0.073 0.00175 0.45 0.076 0.00194 0.54 0.7001 0.996 3179330 Maybridge4_000899 Cc1onc(c1NC(=O)NC2CCSC2)c3c(Cl)cccc3Cl 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 I20 compound treatment 0.152 0.0808 20.79 0.15 0.0759 21.15 29.6552 1.0 3062672 Maybridge4_000900 CSC1=NNC(N1)c2ccc(cc2)N(C)C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 I21 compound treatment 0.069 -0.00225 -0.58 0.071 -0.00306 -0.85 -1.0127 -0.9822 3062673 Maybridge4_000901 CSc1nc(/N=C/N(C)C)nn1CCC#N 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 I22 compound treatment 0.174 0.103 26.46 0.186 0.112 31.17 40.7498 0.9967 1639939 Maybridge4_000902 Cc1ccc(cc1)S(=O)(=O)N2C(Oc3ccccc23)c4ccc(Cl)c(Cl)c4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 I23 mock treatment 0.07 -0.00125 -0.32 0.073 -0.00106 -0.3 -0.4368 -0.9991 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 I24 positive control 0.079 0.00775 2.0 0.078 0.00394 1.1 2.1863 0.9603 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 J01 compound treatment 0.077 0.00575 1.48 0.084 0.00994 2.77 3.0038 0.957 3062674 Maybridge4_000903 CCN1CNC(=NC1)SCc2cccc(C#N)c2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 J02 compound treatment 0.07 -0.00125 -0.32 0.076 0.00194 0.54 0.154 0.2451 3179331 Maybridge4_000904 CCCc1c(cnn1C)C(=O)Nc2cc(F)ccc2F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 J03 compound treatment 0.071 -2.5E-4 -0.06 0.076 0.00194 0.54 0.336 0.6184 3179332 Maybridge4_000905 CC(O)CN1CNC(=NC1)SCc2ccc(Cl)cc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 J04 compound treatment 0.113 0.0418 10.75 0.116 0.0419 11.68 15.8595 0.9991 3062676 Maybridge4_000906 COC(=O)c1sc(cc1NC(=O)C(F)(F)F)c2ccc(F)cc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 J05 compound treatment 0.076 0.00475 1.22 0.082 0.00794 2.21 2.4279 0.961 3179333 Maybridge4_000907 OCCN1CNC(=NC1)SCc2ccc(Cl)c(Cl)c2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 J06 compound treatment 0.079 0.00775 2.0 0.086 0.0119 3.32 3.7617 0.9702 3062677 Maybridge4_000908 COC(=O)c1scc(C)c1S(=O)(=O)Nc2ccc(C)cc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 J07 compound treatment 0.114 0.0428 11.01 0.118 0.0439 12.24 16.4354 0.9986 1718232 Maybridge4_000909 O=c1n2CCN(Cc3ccccc3)c2nc4ccccc14 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 J08 compound treatment 0.071 -2.5E-4 -0.06 0.073 -0.00106 -0.3 -0.2547 -0.8413 3062678 Maybridge4_000910 CCOC(=O)c1c[nH]c(=S)nc1C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 J09 compound treatment 0.127 0.0558 14.35 0.123 0.0489 13.63 19.7868 0.9997 3179334 Maybridge4_000911 Cc1cc2ccccc2c(/N=C/c3cc(Br)cc(Br)c3O)c1C#N 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 J10 compound treatment 0.077 0.00575 1.48 0.075 9.37E-4 0.26 1.2315 0.8192 1179240 Maybridge4_000912 COc1ccc(cc1)c2cc(N)nc(N)n2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 J11 compound treatment 0.069 -0.00225 -0.58 0.073 -0.00106 -0.3 -0.6189 -0.9514 1730849 Maybridge4_000913 Cc1ccc(cc1)S(=O)(=O)N(CCC#N)CC2CCCO2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 J12 compound treatment 0.104 0.0328 8.43 0.1 0.0259 7.22 11.0702 0.997 3062679 Maybridge4_000914 COC(=O)c1cnc(Nc2ccccc2)nc1C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 J13 compound treatment 0.138 0.0668 17.19 0.133 0.0589 16.41 23.7587 0.9997 3179335 Maybridge4_000915 CC(C)c1ccc(NC(=S)Nc2cccc(c2)C(F)(F)F)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 J14 compound treatment 0.082 0.0107 2.77 0.082 0.00794 2.21 3.5202 0.9938 1398467 Maybridge4_000916 COC(=O)c1sccc1S(=O)(=O)N2CCN(CC2)c3ncnc4c(C)csc34 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 J15 compound treatment 0.07 -0.00125 -0.32 0.072 -0.00206 -0.57 -0.6337 -0.9625 3062680 Maybridge4_000917 COC(=O)c1ccc(/N=C/N(C)C)o1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 J16 compound treatment 0.07 -0.00125 -0.32 0.075 9.37E-4 0.26 -0.043 -0.1037 1273229 Maybridge4_000918 COC(=O)c1ccsc1N2C(=O)c3ccccc3C2=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 J17 compound treatment 0.155 0.0838 21.56 0.16 0.0859 23.93 32.1706 0.9986 1150677 Maybridge4_000919 COc1ccc2Oc3nc(N)c(C#N)c(N)c3C(C(C#N)C#N)c2c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 J18 compound treatment 0.118 0.0468 12.04 0.115 0.0409 11.4 16.5729 0.9996 3179336 Maybridge4_000920 COC(=O)c1sccc1Oc2ccc(cc2NC(=O)c3ccccc3OC)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 J19 compound treatment 0.082 0.0107 2.77 0.081 0.00694 1.93 3.3233 0.9846 3062681 Maybridge4_000921 C1CC1/N=C/c2ccc(cc2)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 J20 compound treatment 0.087 0.0158 4.06 0.092 0.0179 5.0 6.3998 0.9946 1209715 Maybridge4_000922 COc1cc(C(=O)NN)c(cc1OC)n2c(C)ccc2C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 J21 compound treatment 0.069 -0.00225 -0.58 0.073 -0.00106 -0.3 -0.6189 -0.9514 3179337 Maybridge4_000923 Cc1cc(c(Cl)cc1Cl)S(=O)(=O)Nc2ccsc2C(=O)N 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 J22 compound treatment 0.068 -0.00325 -0.84 0.071 -0.00306 -0.85 -1.1948 -1.0 3062682 Maybridge4_000924 Cn1nccc1NC(=O)c2ccccc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 J23 mock treatment 0.07 -0.00125 -0.32 0.074 -6.25E-5 -0.02 -0.2399 -0.7443 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 J24 positive control 0.076 0.00475 1.22 0.081 0.00694 1.93 2.2309 0.9757 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 K01 compound treatment 0.117 0.0457 11.78 0.122 0.0479 13.35 17.7693 0.9981 3179338 Maybridge4_000925 CN(C)/C=N/S(=O)(=O)c1c(C)c(C)c(C)c(C)c1C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 K02 compound treatment 0.068 -0.00325 -0.84 0.073 -0.00106 -0.3 -0.8009 -0.9024 1131158 Maybridge4_000926 O=S(=O)(N1CCCC1c2cccs2)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 K03 compound treatment 0.073 0.00175 0.45 0.077 0.00294 0.82 0.8971 0.9605 1673268 Maybridge4_000927 COc1ccc(CCn2cnn3c(=O)c4ccccc4nc3c2=O)cc1OC 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 K04 compound treatment 0.099 0.0278 7.14 0.107 0.0329 9.17 11.5383 0.9924 3062684 Maybridge4_000928 Clc1ccc(Sc2c(C#N)cccc2C#N)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 K05 compound treatment 0.123 0.0517 13.32 0.121 0.0469 13.07 18.6647 1.0 3179339 Maybridge4_000929 Cc1onc(c1C(=O)NC(=N)N2CCCC2)c3c(Cl)cccc3Cl 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 K06 compound treatment 0.072 7.5E-4 0.19 0.074 -6.25E-5 -0.02 0.1242 0.6408 3062686 Maybridge4_000930 NC(=O)N/C(=N\O)/CSc1ccc(Cl)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 K07 compound treatment 0.118 0.0468 12.04 0.124 0.0499 13.91 18.3452 0.9974 3179340 Maybridge4_000931 Clc1ccc(SCC(=N)NS(=O)(=O)c2ccc(Cl)cc2)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 K08 compound treatment 0.112 0.0408 10.49 0.113 0.0389 10.84 15.0867 0.9999 3179341 Maybridge4_000932 CCN(S(=O)(=O)c1ccc(F)cc1)S(=O)(=O)c2c(C)c(C)c(C)c(C)c2C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 K09 compound treatment 0.076 0.00475 1.22 0.076 0.00194 0.54 1.2463 0.9324 3062687 Maybridge4_000933 CS(=O)(=O)Cc1cc(F)cc2COCOc12 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 K10 compound treatment 0.126 0.0548 14.1 0.129 0.0549 15.3 20.7863 0.9992 1659719 Maybridge4_000934 Fc1cccc(Cl)c1CSC2=CC(=O)CC(C2)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 K11 compound treatment 0.107 0.0357 9.2 0.098 0.0239 6.67 11.2225 0.9875 3179342 Maybridge4_000935 Cc1c(C)c(C)c(C#CCOC2CCCCO2)c(C)c1C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 K12 compound treatment 0.088 0.0168 4.31 0.092 0.0179 5.0 6.5818 0.9973 3179343 Maybridge4_000936 COc1cccc(OC)c1C(=O)c2cc[n+](C)cc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 K13 compound treatment 0.279 0.208 53.49 0.272 0.198 55.12 76.8015 0.9999 3062688 Maybridge4_000937 N#Cc1c(oc(c1c2ccc(C#N)cc2)n3cccc3)c4cccs4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 K14 compound treatment 0.069 -0.00225 -0.58 0.078 0.00394 1.1 0.3658 0.2949 3179344 Maybridge4_000938 Clc1ccc(/C=N/N2CCCCC2)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 K15 compound treatment 0.082 0.0107 2.77 0.079 0.00494 1.38 2.9294 0.9479 3062689 Maybridge4_000939 CN(C)/C=N/c1c(cnn1C)c2nc(cs2)c3ccc(Cl)cc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 K16 compound treatment 0.068 -0.00325 -0.84 0.072 -0.00206 -0.57 -0.9978 -0.9832 1505900 Maybridge4_000940 Clc1ccc(Cl)c(c1)S(=O)(=O)N2CCCCC2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 K17 compound treatment 0.094 0.0227 5.86 0.099 0.0249 6.94 9.0526 0.9964 3179345 Maybridge4_000941 CN(C1CC2CC1C=C2)C(=O)Nc3ccc(Cl)cc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 K18 compound treatment 0.081 0.00975 2.51 0.085 0.0109 3.05 3.9289 0.9954 1333053 Maybridge4_000942 N1C(Nc2ccccc12)c3c[nH]c4ccccc34 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 K19 compound treatment 0.071 -2.5E-4 -0.06 0.072 -0.00206 -0.57 -0.4517 -0.7815 3062581 Maybridge4_000943 CC(C)(C)c1cc2N=CN3CCN=C3n2n1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 K20 compound treatment 0.372 0.301 77.43 0.374 0.3 83.53 113.8193 0.9993 3179346 Maybridge4_000944 CN(CCC#N)c1ccc(/C=C/2\CC/C(=C\c3ccc(cc3)N(C)CCC#N)/C2=O)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 K21 compound treatment 0.069 -0.00225 -0.58 0.072 -0.00206 -0.57 -0.8158 -1.0 3062583 Maybridge4_000945 CC1SCC(CS1)NC(=O)Nc2ccc(Cl)cc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 K22 compound treatment 0.075 0.00375 0.97 0.081 0.00694 1.93 2.0489 0.9486 3179347 Maybridge4_000946 COc1ccc(cc1)C2Nc3ccccc3O2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 K23 mock treatment 0.071 -2.5E-4 -0.06 0.074 -6.25E-5 -0.02 -0.0578 -0.8672 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 K24 positive control 0.077 0.00575 1.48 0.082 0.00794 2.21 2.6099 0.981 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 L01 compound treatment 0.073 0.00175 0.45 0.082 0.00794 2.21 1.8817 0.8341 3062584 Maybridge4_000947 CN1CNC(=NC1)SCc2ccc(Cl)c(Cl)c2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 L02 compound treatment 0.077 0.00575 1.48 0.084 0.00994 2.77 3.0038 0.957 3179348 Maybridge4_000948 Cn1cc(NC(=O)Nc2ccc(cc2)C(F)(F)F)c(n1)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 L03 compound treatment 0.069 -0.00225 -0.58 0.079 0.00494 1.38 0.5627 0.3771 3062585 Maybridge4_000949 CN(C)/N=C(\N)/c1ccc(Cl)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 L04 compound treatment 0.161 0.0897 23.11 0.157 0.0829 23.1 32.6722 1.0 3179349 Maybridge4_000950 NC(=O)c1sc(cc1NC(=O)c2cccs2)c3ccsc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 L05 compound treatment 0.073 0.00175 0.45 0.076 0.00194 0.54 0.7001 0.996 3062586 Maybridge4_000951 CSC1=NCN(CCCO)CN1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 L06 compound treatment 0.107 0.0357 9.2 0.104 0.0299 8.34 12.404 0.9988 3179350 Maybridge4_000952 FC(F)(F)c1cc(=O)oc2cc(ccc12)N3C(=O)c4ccccc4C3=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 L07 compound treatment 0.163 0.0917 23.62 0.158 0.0839 23.38 33.2333 1.0 3062588 Maybridge4_000953 Brc1ccc(CSC2=Nc3ccccc3C(=O)NN2)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 L08 compound treatment 0.128 0.0568 14.61 0.133 0.0589 16.41 21.9381 0.9983 3179351 Maybridge4_000954 COc1ccc(CC(=O)n2nc(cc2SC)c3ccc(F)cc3)cc1OC 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 L09 compound treatment 0.299 0.228 58.64 0.278 0.204 56.8 81.6242 0.9999 3062590 Maybridge4_000955 COc1ccc(cc1OC)c2sc(/N=C/c3cccs3)c(C#N)c2C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 L10 compound treatment 0.067 -0.00425 -1.09 0.074 -6.25E-5 -0.02 -0.7861 -0.7183 3179352 Maybridge4_000956 COC(=O)c1cnc(nc1C(F)(F)F)N2CCOCC2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 L11 compound treatment 0.079 0.00775 2.0 0.081 0.00694 1.93 2.7771 0.9999 1310115 Maybridge4_000957 N#CCc1ccc(NC2(CCCCC2)C#N)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 L12 compound treatment 0.134 0.0628 16.16 0.127 0.0529 14.74 21.8489 0.999 3062591 Maybridge4_000958 FC(F)(F)c1nc(Sc2ccc(Cl)cc2)ncc1C(=O)OCc3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 L13 compound treatment 0.07 -0.00125 -0.32 0.075 9.37E-4 0.26 -0.043 -0.1037 3179450 Maybridge4_000959 CC1CN(CC(C)O1)C(=S)Nc2cccc(c2)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 L14 compound treatment 0.069 -0.00225 -0.58 0.073 -0.00106 -0.3 -0.6189 -0.9514 3179451 Maybridge4_000960 Cc1csc2c(ncnc12)N3CCN(CC3)C(=O)NC(C)(C)C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 L15 compound treatment 0.072 7.5E-4 0.19 0.076 0.00194 0.54 0.5181 0.904 3062624 Maybridge4_000961 Clc1ccc2sc(Sc3ccccc3)nc2c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 L16 compound treatment 0.069 -0.00225 -0.58 0.071 -0.00306 -0.85 -1.0127 -0.9822 3179452 Maybridge4_000962 C(N1CCC(CC1)Nc2ncnc3sccc23)c4ccccc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 L17 compound treatment 0.073 0.00175 0.45 0.074 -6.25E-5 -0.02 0.3063 0.6793 1533957 Maybridge4_000963 CSCCC1NC(=O)NC1=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 L18 compound treatment 0.148 0.0767 19.76 0.141 0.0669 18.64 27.1547 0.9996 3179453 Maybridge4_000964 COC(=O)c1sccc1Oc2ccc(cc2NC(=O)Nc3ccc(Cl)cc3)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 L19 compound treatment 0.079 0.00775 2.0 0.084 0.00994 2.77 3.3679 0.9871 3062627 Maybridge4_000965 CN(C)c1ccsc1C(=O)NN 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 L20 compound treatment 0.076 0.00475 1.22 0.079 0.00494 1.38 1.8371 0.9983 3179454 Maybridge4_000966 COc1cc2ncnc(SCC(=O)NN)c2cc1OC 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 L21 compound treatment 0.073 0.00175 0.45 0.077 0.00294 0.82 0.8971 0.9605 3062629 Maybridge4_000967 CNC(=O)c1c(C)csc1NC(=O)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 L22 compound treatment 0.069 -0.00225 -0.58 0.073 -0.00106 -0.3 -0.6189 -0.9514 1534695 Maybridge4_000968 CCN(CC)c1ncnc2sc3CCCCc3c12 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 L23 mock treatment 0.072 7.5E-4 0.19 0.073 -0.00106 -0.3 -0.0727 -0.2057 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 L24 positive control 0.076 0.00475 1.22 0.08 0.00594 1.65 2.034 0.989 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 M01 compound treatment 0.075 0.00375 0.97 0.082 0.00794 2.21 2.2458 0.931 3062631 Maybridge4_000969 COc1ccc(OC)c(c1)S(=O)(=O)/N=C/N(C)C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 M02 compound treatment 0.069 -0.00225 -0.58 0.074 -6.25E-5 -0.02 -0.4219 -0.728 3179455 Maybridge4_000970 Cc1nn(C)c2SC(=NS(=O)(=O)c12)N3CCOCC3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 M03 compound treatment 0.068 -0.00325 -0.84 0.071 -0.00306 -0.85 -1.1948 -1.0 3062632 Maybridge4_000971 Cn1c(S)nnc1C(C)(C)C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 M04 compound treatment 0.096 0.0248 6.37 0.101 0.0269 7.5 9.8106 0.9967 3179456 Maybridge4_000972 FC(F)(F)c1ccc(CNC(=O)c2ccc(Cl)cc2Cl)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 M05 compound treatment 0.072 7.5E-4 0.19 0.077 0.00294 0.82 0.715 0.8506 3062633 Maybridge4_000973 CC1CN(CC(C)O1)C(=N)NS(=O)(=O)c2ccc(Cl)c(Cl)c2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 M06 compound treatment 0.121 0.0498 12.81 0.126 0.0519 14.46 19.2852 0.9982 1452088 Maybridge4_000974 CN(C)c1cc(oc(=O)c1Cl)c2ccc(Cl)cc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 M07 compound treatment 0.138 0.0668 17.19 0.134 0.0599 16.69 23.9556 0.9999 3062634 Maybridge4_000975 Fc1cccc(Cl)c1CSC(=S)N2CCSCC2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 M08 compound treatment 0.074 0.00275 0.71 0.079 0.00494 1.38 1.473 0.9524 3179457 Maybridge4_000976 CN(C)/C=C/C(=O)C(c1ccccc1)c2ccccc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 M09 compound treatment 0.072 7.5E-4 0.19 0.075 9.37E-4 0.26 0.3212 0.989 3179458 Maybridge4_000977 Cc1cc(C)n(n1)C2=NCCN2S(=O)(=O)c3cc(cc(c3)C(F)(F)F)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 M10 compound treatment 0.112 0.0408 10.49 0.111 0.0369 10.29 14.6928 1.0 1473043 Maybridge4_000978 CC(NS(=O)(=O)c1ccc(Oc2cccc(Cl)c2C#N)cc1)C(C)(C)C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 M11 compound treatment 0.12 0.0488 12.55 0.114 0.0399 11.12 16.74 0.9982 3179459 Maybridge4_000979 Cc1ccc(C)n1c2ccsc2COC(=O)Nc3c(C)onc3c4c(F)cccc4Cl 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 M12 compound treatment 0.07 -0.00125 -0.32 0.074 -6.25E-5 -0.02 -0.2399 -0.7443 3062636 Maybridge4_000980 CC(=O)n1nccc1c2nccnc2C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 M13 compound treatment 0.07 -0.00125 -0.32 0.076 0.00194 0.54 0.154 0.2451 3062637 Maybridge4_000981 Cc1cc(no1)n2cnc(n2)c3cnoc3C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 M14 compound treatment 0.068 -0.00325 -0.84 0.074 -6.25E-5 -0.02 -0.604 -0.7217 1215853 Maybridge4_000982 COC(=O)c1cccc(NC(=O)NC(C)C)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 M15 compound treatment 0.074 0.00275 0.71 0.076 0.00194 0.54 0.8822 0.991 1711378 Maybridge4_000983 Cn1ncc(NCCc2ccncc2)c(Cl)c1=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 M16 compound treatment 0.135 0.0638 16.41 0.134 0.0599 16.69 23.4094 1.0 1176335 Maybridge4_000984 CC1CCN(CC1)C(=O)C(C#N)C(=S)Nc2ccc(C)cc2C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 M17 compound treatment 0.139 0.0678 17.44 0.139 0.0649 18.08 25.1223 0.9998 3179460 Maybridge4_000985 CN(C)/C=C/C(=O)c1sc(=S)n(CCc2ccc(Cl)cc2)c1C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 M18 compound treatment 0.116 0.0447 11.52 0.108 0.0339 9.45 14.8303 0.9952 1468395 Maybridge4_000986 COc1ccc(cc1OC)c2c(C)n(C)c(C)c2c3ccc(OC)c(OC)c3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 M19 compound treatment 0.164 0.0927 23.88 0.165 0.0909 25.33 34.7938 0.9996 3179461 Maybridge4_000987 Cc1ccc(C)n1c2ccccc2C3C=NNC3=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 M20 compound treatment 0.077 0.00575 1.48 0.081 0.00694 1.93 2.413 0.9914 1563316 Maybridge4_000988 CNc1ccccc1C(=O)NC2CCCCC2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 M21 compound treatment 0.076 0.00475 1.22 0.08 0.00594 1.65 2.034 0.989 3179462 Maybridge4_000989 CC1SCC(CS1)NC(=O)c2c(C)onc2c3c(Cl)cccc3Cl 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 M22 compound treatment 0.068 -0.00325 -0.84 0.075 9.37E-4 0.26 -0.4071 -0.4644 3062639 Maybridge4_000990 Cc1c(C)c(C)c(CN)c(C)c1C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 M23 mock treatment 0.072 7.5E-4 0.19 0.074 -6.25E-5 -0.02 0.1242 0.6408 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 M24 positive control 0.076 0.00475 1.22 0.08 0.00594 1.65 2.034 0.989 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 N01 compound treatment 0.07 -0.00125 -0.32 0.085 0.0109 3.05 1.9263 0.6289 3062690 Maybridge4_000991 CSC1=NCCCN1C(=O)c2ccccc2I 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 N02 compound treatment 0.075 0.00375 0.97 0.078 0.00394 1.1 1.4581 0.998 3179463 Maybridge4_000992 CCOC(=O)c1cn(CC(=O)NN)nc1C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 N03 compound treatment 0.083 0.0118 3.03 0.094 0.0199 5.55 6.0654 0.9592 3062691 Maybridge4_000993 CC(C)(C)N1CNC(=NC1)SCc2ccc(Cl)cc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 N04 compound treatment 0.211 0.14 35.98 0.245 0.171 47.61 59.1045 0.9905 3179464 Maybridge4_000994 NC(=O)c1sc(cc1NC(=O)/C=C/c2ccsc2)c3ccsc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 N05 compound treatment 0.145 0.0737 18.99 0.133 0.0589 16.41 25.0331 0.9974 3179465 Maybridge4_000995 COc1cc(/C=N/N(C)C(=S)Nc2cccc(Cl)c2C)cc(OC)c1OC 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 N06 compound treatment 0.142 0.0707 18.22 0.145 0.0709 19.76 26.85 0.9992 3062692 Maybridge4_000996 FC(F)(F)c1c(cnn1c2ccccc2)C(=O)Sc3ccc(Cl)cc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 N07 compound treatment 0.075 0.00375 0.97 0.086 0.0119 3.32 3.0335 0.8763 3179466 Maybridge4_000997 Cc1ccc2N(CCCc2c1)C(=O)c3cc(cc(c3)C(F)(F)F)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 N08 compound treatment 0.072 7.5E-4 0.19 0.079 0.00494 1.38 1.1089 0.7986 1622973 Maybridge4_000998 CC1CN(CC(C)O1)c2ncnc3c(C)csc23 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 N09 compound treatment 0.072 7.5E-4 0.19 0.077 0.00294 0.82 0.715 0.8506 1148536 Maybridge4_000999 COc1cc(cc(OC)c1OC)C(=O)N2CCCN3C2c4ccccc4C3=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 N10 compound treatment 0.143 0.0717 18.47 0.138 0.0639 17.81 25.6536 0.9998 3062693 Maybridge4_001000 COC(=O)c1c(C)sc2cc(sc12)C(C)(C)C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 N11 compound treatment 0.071 -2.5E-4 -0.06 0.075 9.37E-4 0.26 0.1391 0.5173 1697786 Maybridge4_001001 COc1cc(cc(OC)c1OC)C(=O)N(CCC#N)C2CC(C)CC(C)(C)C2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 N12 compound treatment 0.082 0.0107 2.77 0.085 0.0109 3.05 4.111 0.9989 3062695 Maybridge4_001002 CC1CN(CC(C)O1)c2ncc(C(=O)OCC3CC3)c(n2)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 N13 compound treatment 0.07 -0.00125 -0.32 0.075 9.37E-4 0.26 -0.043 -0.1037 3179467 Maybridge4_001003 CC1CN(CC(C)O1)C(=S)Nc2c(C)cccc2C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 N14 compound treatment 0.101 0.0297 7.66 0.102 0.0279 7.78 10.9178 1.0 3179468 Maybridge4_001004 Cc1csc2ncnc(N3CCN(CC3)C(=O)Nc4ccc(OC(F)(F)F)cc4)c12 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 N15 compound treatment 0.252 0.181 46.54 0.248 0.174 48.44 67.1597 0.9998 3062698 Maybridge4_001005 CN(C)C(=O)Oc1ccc2nnc3ccnn3c2c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 N16 compound treatment 0.073 0.00175 0.45 0.08 0.00594 1.65 1.4878 0.8681 1412351 Maybridge4_001006 C1CCN(C1)c2ncnc3sccc23 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 N17 compound treatment 0.072 7.5E-4 0.19 0.074 -6.25E-5 -0.02 0.1242 0.6408 3179469 Maybridge4_001007 CC(C)CC1NC(=O)N(C)C1=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 N18 compound treatment 0.071 -2.5E-4 -0.06 0.076 0.00194 0.54 0.336 0.6184 1428548 Maybridge4_001008 Cn1nccc1N2C(=O)c3ccccc3C2=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 N19 compound treatment 0.152 0.0808 20.79 0.155 0.0809 22.54 30.6398 0.9992 3179470 Maybridge4_001009 C/C(=N\O)/CSC(=O)c1c(C)onc1c2c(F)cccc2Cl 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 N20 compound treatment 0.074 0.00275 0.71 0.08 0.00594 1.65 1.6699 0.9284 3062700 Maybridge4_001010 CNC(=S)NCc1ccco1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 N21 compound treatment 0.068 -0.00325 -0.84 0.072 -0.00206 -0.57 -0.9978 -0.9832 3179471 Maybridge4_001011 Cn1ccc(NC(=O)Nc2ccccc2)n1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 N22 compound treatment 0.068 -0.00325 -0.84 0.074 -6.25E-5 -0.02 -0.604 -0.7217 1103188 Maybridge4_001012 C(CNc1ncnc2sc3CCCCc3c12)CN4CCOCC4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 N23 mock treatment 0.071 -2.5E-4 -0.06 0.074 -6.25E-5 -0.02 -0.0578 -0.8672 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 N24 positive control 0.076 0.00475 1.22 0.08 0.00594 1.65 2.034 0.989 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 O01 compound treatment 0.072 7.5E-4 0.19 0.085 0.0109 3.05 2.2904 0.7504 3062702 Maybridge4_001013 CN(C)/C=N/S(=O)(=O)c1ccc(Cl)c(Cl)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 O02 compound treatment 0.096 0.0248 6.37 0.111 0.0369 10.29 11.7799 0.9735 3179472 Maybridge4_001014 Cc1nn(C)c2SC(=NS(=O)(=O)c12)SCc3c(F)cccc3Cl 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 O03 compound treatment 0.221 0.15 38.56 0.224 0.15 41.76 56.7897 0.9992 3062703 Maybridge4_001015 CN(C)/C=C/C(=O)c1cc(F)ccc1O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 O04 compound treatment 0.072 7.5E-4 0.19 0.078 0.00394 1.1 0.9119 0.819 3179473 Maybridge4_001016 FC(F)(F)c1cc(cc(c1)C(F)(F)F)C(=O)OC2CCSC2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 O05 compound treatment 0.074 0.00275 0.71 0.082 0.00794 2.21 2.0638 0.8891 3062704 Maybridge4_001017 CC1CN(CC(C)O1)C(=N)NS(=O)(=O)c2cc(cc(c2)C(F)(F)F)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 O06 compound treatment 0.07 -0.00125 -0.32 0.078 0.00394 1.1 0.5478 0.4794 3179474 Maybridge4_001018 FC(F)(F)COc1ccc(OCC(F)(F)F)c(c1)c2ccn[nH]2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 O07 compound treatment 0.093 0.0217 5.6 0.097 0.0229 6.39 8.4767 0.9978 3179571 Maybridge4_001019 Fc1cccc(Cl)c1CCNC(=O)NC(=O)Cc2c(F)cccc2Cl 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 O08 compound treatment 0.079 0.00775 2.0 0.078 0.00394 1.1 2.1863 0.9603 3062705 Maybridge4_001020 FC(F)(F)COc1ccc(OCC(F)(F)F)c(c1)S(=O)(=O)n2cccc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 O09 compound treatment 0.088 0.0168 4.31 0.087 0.0129 3.6 5.5972 0.996 3179572 Maybridge4_001021 CS/C(=N/S(=O)(=O)c1ccccc1)/NCCc2ccc(Cl)cc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 O10 compound treatment 0.1 0.0288 7.4 0.1 0.0259 7.22 10.3419 0.9999 1316388 Maybridge4_001022 Clc1ccc(cc1)S(=O)(=O)NCC2CN(Cc3ccccc3)CN(Cc4ccccc4)C2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 O11 compound treatment 0.123 0.0517 13.32 0.112 0.0379 10.57 16.8924 0.9934 1687690 Maybridge4_001023 Clc1cc(Cl)cc(OC(=O)C2(CC3CC4CC(C3)C2)C4)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 O12 compound treatment 0.071 -2.5E-4 -0.06 0.075 9.37E-4 0.26 0.1391 0.5173 3063461 Maybridge4_001024 Cc1nc(CSCc2ccc(Cl)cc2Cl)cs1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 O13 compound treatment 0.09 0.0187 4.83 0.102 0.0279 7.78 8.9152 0.9737 1553397 Maybridge4_001025 O=C(Nc1ccccc1)OC(CSc2ccccn2)CSc3ccccn3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 O14 compound treatment 0.149 0.0778 20.02 0.152 0.0779 21.71 29.5029 0.9992 1170892 Maybridge4_001026 COC(=O)c1cccc(NC(=O)Nc2ccccc2)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 O15 compound treatment 0.107 0.0357 9.2 0.11 0.0359 10.01 13.5856 0.9991 1387636 Maybridge4_001027 CN(C)c1cccc(N(C)C)c1CNS(=O)(=O)c2cc(C)c(Cl)cc2Cl 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 O16 compound treatment 0.114 0.0428 11.01 0.116 0.0419 11.68 16.0415 0.9996 1136580 Maybridge4_001028 Clc1ccccc1NC(=S)C(C#N)C(=O)N2CCCC2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 O17 compound treatment 0.089 0.0177 4.57 0.093 0.0189 5.27 6.9608 0.9975 3063462 Maybridge4_001029 CN(C1CC2CC1C=C2)S(=O)(=O)c3cc(cc(c3)C(F)(F)F)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 O18 compound treatment 0.129 0.0578 14.87 0.128 0.0539 15.02 21.1355 1.0 1238489 Maybridge4_001030 Cc1cc2NC(=O)c3ccccc3C(=Nc2cc1C)c4ccccc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 O19 compound treatment 0.455 0.384 98.8 0.451 0.377 104.97 144.0934 0.9995 3063463 Maybridge4_001031 CN(C)/C=N/c1ccccc1C2C=NNC2=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 O20 compound treatment 0.073 0.00175 0.45 0.076 0.00194 0.54 0.7001 0.996 3179573 Maybridge4_001032 S=C1NCCN1Cc2ccccc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 O21 compound treatment 0.083 0.0118 3.03 0.086 0.0119 3.32 4.49 0.9989 1607454 Maybridge4_001033 CC1=C(N2CCOCC2)C(=NCCN1)C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 O22 compound treatment 0.069 -0.00225 -0.58 0.074 -6.25E-5 -0.02 -0.4219 -0.728 1293246 Maybridge4_001034 Cc1nc2ccccc2n1C3CC(=O)N(C3=O)c4ccccc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 O23 mock treatment 0.072 7.5E-4 0.19 0.074 -6.25E-5 -0.02 0.1242 0.6408 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 O24 positive control 0.076 0.00475 1.22 0.081 0.00694 1.93 2.2309 0.9757 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 P01 compound treatment 0.083 0.0118 3.03 0.087 0.0129 3.6 4.6869 0.9962 1354193 Maybridge4_001035 OCCN1CNC(=S)NC1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 P02 compound treatment 0.087 0.0158 4.06 0.094 0.0199 5.55 6.7936 0.9881 3179574 Maybridge4_001036 FC(F)(F)c1cc(NC(=O)N/C=C/c2ccsc2)cc(c1)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 P03 compound treatment 0.075 0.00375 0.97 0.095 0.0209 5.83 4.8058 0.8131 3063464 Maybridge4_001037 C(SC1=NCN(Cc2ccccc2)CN1)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 P04 compound treatment 0.079 0.00775 2.0 0.086 0.0119 3.32 3.7617 0.9702 3179575 Maybridge4_001038 COC(=O)c1sccc1N2C(=O)C=C(C)C2=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 P05 compound treatment 0.123 0.0517 13.32 0.121 0.0469 13.07 18.6647 1.0 3179576 Maybridge4_001039 CN(/N=C/c1ccccn1)C(=S)Nc2ccc(C)c(Cl)c2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 P06 compound treatment 0.095 0.0238 6.11 0.101 0.0269 7.5 9.6286 0.9949 1429512 Maybridge4_001040 CCCc1c(NC(=O)Nc2ccc(Cl)cc2Cl)cnn1c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 P07 compound treatment 0.077 0.00575 1.48 0.091 0.0169 4.72 4.3823 0.8864 1160255 Maybridge4_001041 N#CC1(CCCCCC1)NC(Cc2ccccc2)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 P08 compound treatment 0.077 0.00575 1.48 0.08 0.00594 1.65 2.2161 0.9985 1344462 Maybridge4_001042 CC(C)Nc1ncnc2c(C)csc12 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 P09 compound treatment 0.079 0.00775 2.0 0.083 0.00894 2.49 3.171 0.994 3179577 Maybridge4_001043 COc1cc(cc(OC)c1OC)C2NN=C3C2N4CCC3CC4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 P10 compound treatment 0.08 0.00875 2.25 0.082 0.00794 2.21 3.1561 1.0 3063465 Maybridge4_001044 FC(F)(F)c1ccc(NC(=O)C2CCc3ccccc3O2)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 P11 compound treatment 0.074 0.00275 0.71 0.075 9.37E-4 0.26 0.6853 0.9081 1463450 Maybridge4_001045 COc1cc(cc(OC)c1OC)C(=O)N(CCC#N)Cc2ccncc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 P12 compound treatment 0.116 0.0447 11.52 0.123 0.0489 13.63 17.7841 0.9965 3179578 Maybridge4_001046 CSc1cc(nn1S(=O)(=O)c2cccc(c2)C(F)(F)F)c3ccc(F)cc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 P13 compound treatment 0.117 0.0457 11.78 0.118 0.0439 12.24 16.9816 0.9998 3063466 Maybridge4_001047 COc1cccc(NC(=S)N(CCC#N)/N=C/c2ccc3OCOc3c2)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 P14 compound treatment 0.084 0.0127 3.28 0.084 0.00994 2.77 4.2782 0.9964 1234970 Maybridge4_001048 Cc1csc2ncnc(N3CCN(CC3)C(=S)Nc4ccc(F)cc4F)c12 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 P15 compound treatment 0.076 0.00475 1.22 0.078 0.00394 1.1 1.6402 0.9985 1069786 Maybridge4_001049 NNC(=O)OC1(CC2CC3CC(C2)C1)C3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 P16 compound treatment 0.072 7.5E-4 0.19 0.077 0.00294 0.82 0.715 0.8506 3179579 Maybridge4_001050 CCOC(=O)c1cnc(Sc2ccc(F)c(Cl)c2)nc1C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 P17 compound treatment 0.099 0.0278 7.14 0.102 0.0279 7.78 10.5537 0.9991 3063467 Maybridge4_001051 Sc1nc(ccc1C#N)c2ccc3OCCOc3c2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 P18 compound treatment 0.074 0.00275 0.71 0.077 0.00294 0.82 1.0791 0.9974 1377109 Maybridge4_001052 CCOC(=O)c1cc(=O)c2cc(Cl)ccc2o1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 P19 compound treatment 0.072 7.5E-4 0.19 0.074 -6.25E-5 -0.02 0.1242 0.6408 1695486 Maybridge4_001053 CC1CCCN(C1)c2ccc3nncn3n2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 P20 compound treatment 0.072 7.5E-4 0.19 0.076 0.00194 0.54 0.5181 0.904 3063468 Maybridge4_001054 Cn1ncc(Br)c1NC(=O)CSc2ccc(Cl)cc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 P21 compound treatment 0.081 0.00975 2.51 0.076 0.00194 0.54 2.1566 0.8399 3179580 Maybridge4_001055 COC(=O)c1sccc1NS(=O)(=O)c2ccc(F)cc2F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 P22 compound treatment 0.078 0.00675 1.74 0.077 0.00294 0.82 1.8074 0.9409 1127720 Maybridge4_001056 CCC(C)Nc1ncnc2cc(OC)c(OC)cc12 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 P23 mock treatment 0.073 0.00175 0.45 0.076 0.00194 0.54 0.7001 0.996 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2051 P24 positive control 0.079 0.00775 2.0 0.081 0.00694 1.93 2.7771 0.9999 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 A01 compound treatment 0.084 0.0147 3.8 0.081 0.0122 3.39 5.0854 0.9984 1118682 Maybridge4_001057 Cc1cc(NS(=O)(=O)c2ccc(NC(=O)c3ccco3)cc2)no1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 A02 compound treatment 0.079 0.00975 2.51 0.083 0.0142 3.95 4.5689 0.976 1260001 Maybridge4_001058 O=C(CC1(CC2CC3CC(C2)C1)C3)NC4CCN(Cc5ccccc5)CC4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 A03 compound treatment 0.094 0.0248 6.37 0.095 0.0262 7.29 9.6629 0.9977 3063469 Maybridge4_001059 Cn1ncc(C(=O)Sc2ccc(Cl)cc2)c1n3cccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 A04 compound treatment 0.117 0.0478 12.29 0.116 0.0472 13.14 17.9857 0.9994 3179581 Maybridge4_001060 Oc1cc(nc(SCC(=O)c2ccc(Cl)s2)n1)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 A05 compound treatment 0.088 0.0187 4.83 0.095 0.0262 7.29 8.5706 0.9799 3063470 Maybridge4_001061 FC(F)(F)c1ccnc(Sc2ccccc2NC(=O)Nc3ccccc3)n1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 A06 compound treatment 0.115 0.0457 11.78 0.114 0.0452 12.58 17.2277 0.9995 3179582 Maybridge4_001062 CC(C)(C)c1cc(C(=O)N2CCN(CC2)c3ccc(cn3)C(F)(F)F)n(Cc4ccc(F)cc4)n1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 A07 compound treatment 0.079 0.00975 2.51 0.077 0.00819 2.28 3.3874 0.9988 3063471 Maybridge4_001063 CN(/N=C/c1ncc(cc1Cl)C(F)(F)F)C(=O)c2ccc(Cl)cc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 A08 compound treatment 0.081 0.0118 3.03 0.075 0.00619 1.72 3.3577 0.9644 3179583 Maybridge4_001064 COC(=O)c1ccc(n1C)S(=O)(=O)NCCNc2cccc(n2)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 A09 compound treatment 0.075 0.00575 1.48 0.075 0.00619 1.72 2.2653 0.9971 3063472 Maybridge4_001065 Cc1cccc(c1)n2c(CC#N)n[nH]c2=S 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 A10 compound treatment 0.107 0.0377 9.72 0.109 0.0402 11.19 14.7866 0.9975 1646442 Maybridge4_001066 Cc1ccc2N(CC(=O)N(C3CCCCC3)c4ccccc4)CCCc2c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 A11 compound treatment 0.078 0.00875 2.25 0.074 0.00519 1.44 2.6146 0.9769 1595838 Maybridge4_001067 COC(=O)c1sccc1S(=O)(=O)Nc2cc(OC)c(OC)cc2C(=O)OC 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 A12 compound treatment 0.126 0.0568 14.61 0.119 0.0502 13.98 20.215 0.9998 3179584 Maybridge4_001068 FC(F)(F)c1ccc(N2CCc3ccccc3C2)c(NC(=O)c4ccccc4)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 A13 compound treatment 0.09 0.0208 5.34 0.089 0.0202 5.62 7.7531 0.9997 3063473 Maybridge4_001069 FC(F)(F)C1=NCCN(C=C1)S(=O)(=O)c2ccc(CNC(=O)c3ccccc3)s2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 A14 compound treatment 0.074 0.00475 1.22 0.073 0.00419 1.17 1.6894 0.9997 1536339 Maybridge4_001070 OC(=O)COCC(=O)N1CCCN(CC1)c2nc3ccc(Cl)cc3s2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 A15 compound treatment 0.076 0.00675 1.74 0.074 0.00519 1.44 2.2504 0.9958 1391994 Maybridge4_001071 CCOC(=O)C1CCN(CC1)c2ncnc3cc(OC)c(OC)cc23 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 A16 compound treatment 0.104 0.0348 8.95 0.102 0.0332 9.24 12.862 0.9999 1501197 Maybridge4_001072 Cc1nc(cs1)c2ccc(s2)S(=O)(=O)NCC3CCN(CC3)C(=O)OC(C)(C)C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 A17 compound treatment 0.075 0.00575 1.48 0.073 0.00419 1.17 1.8715 0.993 1440783 Maybridge4_001073 COc1cc(cc(OC)c1OC)C(CC(=O)O)CC(=O)N2CCC(CC2)n3cccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 A18 compound treatment 0.178 0.109 28.0 0.179 0.11 30.69 41.4975 0.999 1175173 Maybridge4_001074 CC(C)(C)c1ccc(cc1)c2noc(n2)c3ccc4OCCc4c3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 A19 compound treatment 0.073 0.00375 0.97 0.072 0.00319 0.89 1.3104 0.9991 1213784 Maybridge4_001075 NC(=O)C1CCN(CN2C(=O)c3ccccc3C2=O)CC1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 A20 compound treatment 0.102 0.0328 8.43 0.098 0.0292 8.13 11.7102 0.9998 1134687 Maybridge4_001076 OC(=O)c1nccnc1C(=O)Nc2ccc(cc2)N3CCOCC3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 A21 compound treatment 0.103 0.0338 8.69 0.104 0.0352 9.8 13.0738 0.9982 3063474 Maybridge4_001077 FC(F)(F)c1ccc(NC(=O)Nc2ccc(cc2)C(F)(F)F)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 A22 compound treatment 0.075 0.00575 1.48 0.074 0.00519 1.44 2.0684 0.9999 3179585 Maybridge4_001078 COc1ccccc1N2CCN(CC2)C(=O)c3cnn(c3C)c4ccc(Cl)cc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 A23 mock treatment 0.07 7.5E-4 0.19 0.072 0.00319 0.89 0.7642 0.8413 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 A24 positive control 0.077 0.00775 2.0 0.075 0.00619 1.72 2.6294 0.9973 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 B01 compound treatment 0.078 0.00875 2.25 0.076 0.00719 2.0 3.0084 0.9983 1733246 Maybridge4_001079 Cc1cnc(cn1)C(=O)Nc2nnn[nH]2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 B02 compound treatment 0.08 0.0107 2.77 0.078 0.00919 2.56 3.7664 0.9992 1403239 Maybridge4_001080 NC(=O)C1CCN(CC(O)COc2ccc(cc2)c3csnn3)CC1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 B03 compound treatment 0.078 0.00875 2.25 0.077 0.00819 2.28 3.2053 1.0 1480432 Maybridge4_001081 COc1ccc(cc1OC)S(=O)(=O)NCCN2CCNC2=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 B04 compound treatment 0.074 0.00475 1.22 0.073 0.00419 1.17 1.6894 0.9997 3179682 Maybridge4_001082 Cc1ccsc1CNC(=O)c2ccc(Cl)cc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 B05 compound treatment 0.077 0.00775 2.0 0.075 0.00619 1.72 2.6294 0.9973 1539091 Maybridge4_001083 OC(=O)c1cc(ccc1O)S(=O)(=O)NCCN2CCNC2=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 B06 compound treatment 0.075 0.00575 1.48 0.073 0.00419 1.17 1.8715 0.993 1590468 Maybridge4_001084 O=C(Nc1ccc(cc1)S(=O)(=O)N2CCOCC2)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 B07 compound treatment 0.079 0.00975 2.51 0.078 0.00919 2.56 3.5843 1.0 1660094 Maybridge4_001085 Cc1nn(nc1C(=O)NC2CCS(=O)(=O)C2)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 B08 compound treatment 0.102 0.0328 8.43 0.074 0.00519 1.44 6.984 0.8164 1742612 Maybridge4_001086 COc1ccc(SCC(=O)NCc2ccc3OCOc3c2)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 B09 compound treatment 0.116 0.0468 12.04 0.115 0.0462 12.86 17.6067 0.9994 3179683 Maybridge4_001087 CCOC(=O)c1c(NC(=O)NC(C)(C)C)sc2CN(C)CCc12 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 B10 compound treatment 0.121 0.0517 13.32 0.122 0.0532 14.81 19.8955 0.9986 1477333 Maybridge4_001088 Cc1cc(NC(=O)C2CCN(CC2)C(=O)OCc3ccccc3)n(C)n1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 B11 compound treatment 0.09 0.0208 5.34 0.086 0.0172 4.79 7.1624 0.9985 1603040 Maybridge4_001089 O=C(N1CCN(CC1)C(c2ccccc2)c3ccccc3)c4ccc5OCCc5c4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 B12 compound treatment 0.145 0.0757 19.5 0.147 0.0782 21.77 29.188 0.9985 3179684 Maybridge4_001090 Cn1c(SCC(=O)c2ccc3OCCOc3c2)nnc1c4ccc5ccccc5c4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 B13 compound treatment 0.139 0.0698 17.96 0.135 0.0662 18.43 25.7326 0.9999 3063475 Maybridge4_001091 CN(C(=O)c1scc(c1C)S(=O)(=O)c2ccc(Cl)cc2)c3nnc(s3)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 B14 compound treatment 0.271 0.202 51.94 0.278 0.209 58.26 77.9246 0.9984 3179685 Maybridge4_001092 CCOC(=O)c1c(C)n(c(C)c1/C=C/2\C(=O)Nc3ccccc23)c4ccccc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 B15 compound treatment 0.072 0.00275 0.71 0.071 0.00219 0.61 0.9314 0.9972 1321807 Maybridge4_001093 Cn1nc(cc1C(=O)NN2CCOCC2)C(C)(C)C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 B16 compound treatment 0.104 0.0348 8.95 0.109 0.0402 11.19 14.2405 0.9938 3179686 Maybridge4_001094 Cc1ccc(cc1)S(=O)(=O)CCSc2nccc(n2)c3cccs3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 B17 compound treatment 0.075 0.00575 1.48 0.073 0.00419 1.17 1.8715 0.993 1191907 Maybridge4_001095 O=C1NCCN1CCNC(=S)NC2CC2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 B18 compound treatment 0.075 0.00575 1.48 0.073 0.00419 1.17 1.8715 0.993 1709557 Maybridge4_001096 COc1ccc(OCC(O)CNC(=O)c2c(C)onc2c3ccccc3)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 B19 compound treatment 0.095 0.0257 6.63 0.095 0.0262 7.29 9.845 0.9989 1259000 Maybridge4_001097 CCCc1c(cnn1c2ccccc2)C(=O)N(Cc3cccs3)Cc4ccccc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 B20 compound treatment 0.071 0.00175 0.45 0.07 0.00119 0.33 0.5525 0.9884 1607244 Maybridge4_001098 O=C(N1CCN(CCN2CCOCC2)CC1)c3ccco3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 B21 compound treatment 0.074 0.00475 1.22 0.073 0.00419 1.17 1.6894 0.9997 1594969 Maybridge4_001099 CCCc1c(cnn1c2ccccc2)C(=O)Nc3nc[nH]n3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 B22 compound treatment 0.156 0.0867 22.34 0.16 0.0912 25.4 33.7507 0.998 3063476 Maybridge4_001100 Clc1ccc(Sc2cccc(Cl)c2Cn3cccc3)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 B23 mock treatment 0.069 -2.5E-4 -0.06 0.069 1.88E-4 0.05 -0.0086 -0.1037 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 B24 positive control 0.074 0.00475 1.22 0.073 0.00419 1.17 1.6894 0.9997 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 C01 compound treatment 0.073 0.00375 0.97 0.072 0.00319 0.89 1.3104 0.9991 3179687 Maybridge4_001101 Cc1cc(NS(=O)(=O)c2ccc(cc2)N3C(=O)C=CC3=O)no1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 C02 compound treatment 0.107 0.0377 9.72 0.104 0.0352 9.8 13.802 1.0 1404378 Maybridge4_001102 OC1(CCN(CC1)C(=O)CC2(CC3CC4CC(C3)C2)C4)c5ccc(Cl)cc5 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 C03 compound treatment 0.089 0.0198 5.09 0.086 0.0172 4.79 6.9803 0.9995 1249628 Maybridge4_001103 COc1ccc(cc1OC)C(=O)N2CCN(CC2)c3ncnc4cc(sc34)c5ccccc5 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 C04 compound treatment 0.104 0.0348 8.95 0.101 0.0322 8.96 12.6651 1.0 3063496 Maybridge4_001104 Fc1ccc(NC(=O)NCc2nc(no2)c3ccc(cc3)C(F)(F)F)c(F)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 C05 compound treatment 0.072 0.00275 0.71 0.071 0.00219 0.61 0.9314 0.9972 3063497 Maybridge4_001105 OC(CSc1ccccc1NC(=O)/C=C\C(=O)O)Cn2ccc(n2)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 C06 compound treatment 0.074 0.00475 1.22 0.072 0.00319 0.89 1.4925 0.9876 3063498 Maybridge4_001106 Cn1nc(c(c1NC(=O)c2nccnc2C(=O)O)c3cccc(c3)C(F)(F)F)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 C07 compound treatment 0.082 0.0127 3.28 0.084 0.0152 4.23 5.312 0.9921 3179688 Maybridge4_001107 CN(/N=C/c1ncc(cc1Cl)C(F)(F)F)C(=O)Nc2ccc(Cl)cc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 C08 compound treatment 0.074 0.00475 1.22 0.075 0.00619 1.72 2.0833 0.9859 3063499 Maybridge4_001108 FC(F)(F)C1=NCCN(C=C1)C(=O)C2CCN(CC2)c3nccc(n3)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 C09 compound treatment 0.136 0.0668 17.19 0.132 0.0632 17.6 24.5956 0.9999 1483010 Maybridge4_001109 COc1ccc(CN(Cc2cccn2C)C(=O)c3cc4cc(OC)ccc4[nH]3)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 C10 compound treatment 0.074 0.00475 1.22 0.073 0.00419 1.17 1.6894 0.9997 1408441 Maybridge4_001110 COC(=O)c1sc(cc1NC(=O)COCC(=O)O)c2ccc(cc2)C(C)(C)C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 C11 compound treatment 0.074 0.00475 1.22 0.073 0.00419 1.17 1.6894 0.9997 3179689 Maybridge4_001111 FC(F)(F)c1cc(N2CCN(CC2)C(=O)C3CCC3)c4ccccc4n1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 C12 compound treatment 0.088 0.0187 4.83 0.087 0.0182 5.07 6.9952 0.9997 3063500 Maybridge4_001112 FC(F)(F)c1oc(cc1C(=O)NCc2cccs2)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 C13 compound treatment 0.201 0.132 33.92 0.189 0.12 33.47 47.6541 1.0 3179690 Maybridge4_001113 CCC(=O)N(C)c1nc(cs1)c2ccc(Cl)s2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 C14 compound treatment 0.077 0.00775 2.0 0.075 0.00619 1.72 2.6294 0.9973 3179691 Maybridge4_001114 Fc1ccc(cc1)S(=O)(=O)Nc2ccccc2NC3CCN(Cc4ccccc4)CC3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 C15 compound treatment 0.102 0.0328 8.43 0.1 0.0312 8.69 12.104 0.9999 1317474 Maybridge4_001115 COc1cccc(Cl)c1NC(=O)N2CCN(CC2)c3cc(C)nc4ccccc34 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 C16 compound treatment 0.078 0.00875 2.25 0.075 0.00619 1.72 2.8115 0.9912 3179692 Maybridge4_001116 CC(C)(C)OC(=O)N1CCC(CNS(=O)(=O)c2cccc(c2)C(F)(F)F)CC1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 C17 compound treatment 0.163 0.0938 24.14 0.18 0.111 30.97 38.9636 0.9924 1139184 Maybridge4_001117 COc1ccc(CC2CCC3(CC2)NC(=O)c4ccccc4O3)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 C18 compound treatment 0.113 0.0437 11.26 0.117 0.0482 13.42 17.4544 0.9962 1486833 Maybridge4_001118 COC(=O)c1cc(oc1C)S(=O)(=O)NCC2CN(Cc3ccccc3)CN(Cc4ccccc4)C2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 C19 compound treatment 0.07 7.5E-4 0.19 0.069 1.88E-4 0.05 0.1735 0.8672 1538683 Maybridge4_001119 OC1(CCN(CN2C(=O)c3ccccc3C2=O)CC1)c4ccc(Cl)cc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 C20 compound treatment 0.091 0.0217 5.6 0.089 0.0202 5.62 7.9352 1.0 3063501 Maybridge4_001120 OC(=O)/C=C/C(=O)Nc1ccc(nc1N2CCOCC2)N3CCOCC3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 C21 compound treatment 0.071 0.00175 0.45 0.069 1.88E-4 0.05 0.3555 0.7838 1658419 Maybridge4_001121 NC(=O)C1CCN(CC(O)CSc2ccc(F)cc2)CC1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 C22 compound treatment 0.07 7.5E-4 0.19 0.069 1.88E-4 0.05 0.1735 0.8672 1233858 Maybridge4_001122 CS(=O)(=O)CS(=O)(=O)Nc1ccc2OCCOc2c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 C23 mock treatment 0.068 -0.00125 -0.32 0.069 1.88E-4 0.05 -0.1906 -0.5847 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 C24 positive control 0.075 0.00575 1.48 0.075 0.00619 1.72 2.2653 0.9971 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 D01 compound treatment 0.075 0.00575 1.48 0.074 0.00519 1.44 2.0684 0.9999 1662148 Maybridge4_001123 Cc1nc(cn1C)S(=O)(=O)NC2CCS(=O)(=O)C2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 D02 compound treatment 0.073 0.00375 0.97 0.073 0.00419 1.17 1.5073 0.9956 1341736 Maybridge4_001124 CCN(CC)c1ccc(NS(=O)(=O)c2ccc(F)cc2)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 D03 compound treatment 0.099 0.0297 7.66 0.097 0.0282 7.85 10.9671 0.9999 3063502 Maybridge4_001125 Cn1cnc(c1)S(=O)(=O)NCC2CCN(CC2)S(=O)(=O)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 D04 compound treatment 0.082 0.0127 3.28 0.083 0.0142 3.95 5.1151 0.9958 3179693 Maybridge4_001126 Cc1nnc(Sc2nc3ccc(Cl)cc3s2)n1c4ccc5OCCOc5c4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 D05 compound treatment 0.075 0.00575 1.48 0.076 0.00719 2.0 2.4622 0.989 1259497 Maybridge4_001127 O=C1NCCN1CCNS(=O)(=O)c2cccs2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 D06 compound treatment 0.074 0.00475 1.22 0.073 0.00419 1.17 1.6894 0.9997 1281709 Maybridge4_001128 OC(=O)CSCC(=O)N1CCN(Cc2ccc3OCOc3c2)CC1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 D07 compound treatment 0.13 0.0607 15.64 0.139 0.0702 19.55 24.8817 0.9939 1146339 Maybridge4_001129 CCCCc1ccc(cc1)n2c(coc2=O)c3ccc(F)cc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 D08 compound treatment 0.115 0.0457 11.78 0.116 0.0472 13.14 17.6216 0.9985 1522891 Maybridge4_001130 COC(=O)C1=C(CSC1)Nc2ccccc2NS(=O)(=O)c3cn(C)cn3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 D09 compound treatment 0.074 0.00475 1.22 0.073 0.00419 1.17 1.6894 0.9997 3063503 Maybridge4_001131 FC(F)(F)c1nn2c(=O)cc([nH]c2c1c3ccccc3)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 D10 compound treatment 0.104 0.0348 8.95 0.106 0.0372 10.36 13.6497 0.9973 1088065 Maybridge4_001132 Cc1cc(C(=O)Nc2ccccc2)c(C)o1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 D11 compound treatment 0.072 0.00275 0.71 0.071 0.00219 0.61 0.9314 0.9972 1383227 Maybridge4_001133 O=C(OCCn1ncc2ccccc2c1=O)c3ccc4OCCc4c3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 D12 compound treatment 0.091 0.0217 5.6 0.09 0.0212 5.9 8.1321 0.9997 1524796 Maybridge4_001134 Cc1ccc(cc1)c2cc(Cc3ccccc3)c(=O)[nH]n2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 D13 compound treatment 0.104 0.0348 8.95 0.113 0.0442 12.31 15.0282 0.9877 1531019 Maybridge4_001135 Cc1c(csc1C(=O)N(Cc2ccccc2)Cc3cccnc3)S(=O)(=O)c4ccc(Cl)cc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 D14 compound treatment 0.075 0.00575 1.48 0.074 0.00519 1.44 2.0684 0.9999 3063504 Maybridge4_001136 OC(=O)c1nccnc1C(=O)Nc2ccc(CC#N)cc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 D15 compound treatment 0.072 0.00275 0.71 0.07 0.00119 0.33 0.7345 0.9399 1469748 Maybridge4_001137 CSc1nsc(SC)c1C(=O)NN2CCOCC2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 D16 compound treatment 0.129 0.0597 15.38 0.132 0.0632 17.6 23.3212 0.9978 3063505 Maybridge4_001138 Fc1ccc(cc1)S(=O)(=O)CCSc2nccc(n2)c3cccs3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 D17 compound treatment 0.073 0.00375 0.97 0.073 0.00419 1.17 1.5073 0.9956 3179791 Maybridge4_001139 COC(=O)c1ccc(n1C)S(=O)(=O)Nc2ccc3COC(=O)c3c2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 D18 compound treatment 0.077 0.00775 2.0 0.076 0.00719 2.0 2.8264 1.0 3179792 Maybridge4_001140 COc1ccc(OCC(O)CNC(=O)c2ccc(OC(F)(F)F)cc2)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 D19 compound treatment 0.07 7.5E-4 0.19 0.068 -8.12E-4 -0.23 -0.0235 -0.0789 1658181 Maybridge4_001141 CCCc1c(cnn1c2ccccc2)C(=O)NCc3ccc4OCOc4c3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 D20 compound treatment 0.098 0.0288 7.4 0.109 0.0402 11.19 13.1481 0.9799 1302806 Maybridge4_001142 CCOC(=O)N1CCC(CC1)NC(=O)Nc2ccc(F)cc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 D21 compound treatment 0.07 7.5E-4 0.19 0.069 1.88E-4 0.05 0.1735 0.8672 1417198 Maybridge4_001143 COc1cccc2n(C)nc(NC(=O)CCC(=O)O)c12 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 D22 compound treatment 0.071 0.00175 0.45 0.069 1.88E-4 0.05 0.3555 0.7838 1130087 Maybridge4_001144 COc1ccc(OCC(O)CNC(=O)Nc2ccccc2)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 D23 mock treatment 0.069 -2.5E-4 -0.06 0.069 1.88E-4 0.05 -0.0086 -0.1037 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 D24 positive control 0.075 0.00575 1.48 0.075 0.00619 1.72 2.2653 0.9971 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 E01 compound treatment 0.076 0.00675 1.74 0.075 0.00619 1.72 2.4474 1.0 1356815 Maybridge4_001145 Cn1ncc2c(NN3C(=O)CCC3=O)ncnc12 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 E02 compound treatment 0.135 0.0658 16.93 0.132 0.0632 17.6 24.4135 0.9998 3063506 Maybridge4_001146 FC(F)(F)c1ccc(NC(=O)Nc2ccc(cc2)N3CCN(Cc4ccccc4)CC3)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 E03 compound treatment 0.239 0.17 43.71 0.241 0.172 47.95 64.8125 0.9989 3179793 Maybridge4_001147 COC(=O)c1sc(cc1NS(=O)(=O)c2ccc(C)cc2)c3cccs3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 E04 compound treatment 0.12 0.0508 13.07 0.119 0.0502 13.98 19.1226 0.9994 1593578 Maybridge4_001148 Cc1noc(C)c1n2sc(=O)n(CC3CC3)c2=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 E05 compound treatment 0.161 0.0917 23.62 0.156 0.0872 24.28 33.8733 0.9999 1366685 Maybridge4_001149 OC(CSc1ccccc1NC(=O)c2ccc(Cl)cc2)Cn3ccc4ccccc34 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 E06 compound treatment 0.187 0.118 30.32 0.171 0.102 28.46 41.5607 0.9995 1718437 Maybridge4_001150 CCCCc1ccc(NC(=O)N2CCN(CC2)c3cc(C)nc4ccccc34)c(C)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 E07 compound treatment 0.072 0.00275 0.71 0.07 0.00119 0.33 0.7345 0.9399 3063507 Maybridge4_001151 CNC(=S)NC1CC2CCC1C2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 E08 compound treatment 0.125 0.0558 14.35 0.121 0.0522 14.53 20.4268 1.0 1663721 Maybridge4_001152 Fc1ccc(cc1Cl)n2sc(=O)n(C3Cc4ccccc4C3)c2=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 E09 compound treatment 0.212 0.143 36.75 0.214 0.145 40.43 54.5799 0.9989 3063508 Maybridge4_001153 Cc1nnsc1c2nc(cs2)c3ccc(Cl)s3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 E10 compound treatment 0.084 0.0147 3.8 0.08 0.0112 3.12 4.8885 0.9952 1128288 Maybridge4_001154 COC(=O)c1ccc(n1C)S(=O)(=O)N(Cc2ccccc2)Cc3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 E11 compound treatment 0.122 0.0527 13.58 0.128 0.0592 16.48 21.2591 0.9954 1703913 Maybridge4_001155 CC(C)Cc1ccc(cc1)C(C)C(=O)Nc2cccc(c2)c3cnco3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 E12 compound treatment 0.108 0.0388 9.98 0.107 0.0382 10.63 14.5748 0.9995 1704448 Maybridge4_001156 Cc1cccc(Cl)c1n2sc(=O)n(CC3CC3)c2=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 E13 compound treatment 0.14 0.0707 18.22 0.137 0.0682 18.99 26.3085 0.9998 1205718 Maybridge4_001157 CN(C(=O)C1CCCCC1)c2nc(cs2)c3ccc(Cl)s3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 E14 compound treatment 0.122 0.0527 13.58 0.123 0.0542 15.09 20.2745 0.9986 3179794 Maybridge4_001158 Cc1ccc(OCC(O)CNc2ccc(Br)c(c2)C(F)(F)F)cc1C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 E15 compound treatment 0.072 0.00275 0.71 0.069 1.88E-4 0.05 0.5376 0.7572 3063509 Maybridge4_001159 OC(=O)c1sccc1S(=O)(=O)N2CCN(CC2)c3ccc(cn3)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 E16 compound treatment 0.073 0.00375 0.97 0.072 0.00319 0.89 1.3104 0.9991 1390204 Maybridge4_001160 Cn1cnc(c1)S(=O)(=O)NCC2CCN(CC2)C(=O)OC(C)(C)C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 E17 compound treatment 0.132 0.0628 16.16 0.134 0.0652 18.15 24.2612 0.9983 1537127 Maybridge4_001161 COc1ccccc1NC(=O)N2CCN(CC2)C(c3ccccc3)c4ccccc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 E18 compound treatment 0.102 0.0328 8.43 0.1 0.0312 8.69 12.104 0.9999 1388804 Maybridge4_001162 COc1ccc(cc1)C(=O)CN2CCCc3cc(C)ccc23 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 E19 compound treatment 0.101 0.0318 8.17 0.101 0.0322 8.96 12.1189 0.9989 1307254 Maybridge4_001163 COc1ccc(CN(Cc2cccn2C)S(=O)(=O)c3ccccc3)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 E20 compound treatment 0.072 0.00275 0.71 0.07 0.00119 0.33 0.7345 0.9399 1235221 Maybridge4_001164 Fc1cccc(Cl)c1CN2CCC(CC2)NS(=O)(=O)c3cccc4nonc34 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 E21 compound treatment 0.127 0.0578 14.87 0.118 0.0492 13.7 20.2001 0.9992 3179795 Maybridge4_001165 COC(=O)c1ccc(n1C)S(=O)(=O)N2CCN(CC2)c3ccc(cn3)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 E22 compound treatment 0.072 0.00275 0.71 0.067 -0.00181 -0.5 0.1437 0.1653 1482186 Maybridge4_001166 Cc1ccc(cc1)S(=O)(=O)NC(=O)NCC2CCN(CC2)C(=O)OC(C)(C)C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 E23 mock treatment 0.068 -0.00125 -0.32 0.068 -8.12E-4 -0.23 -0.3876 -0.9851 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 E24 positive control 0.073 0.00375 0.97 0.074 0.00519 1.44 1.7043 0.9808 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 F01 compound treatment 0.079 0.00975 2.51 0.078 0.00919 2.56 3.5843 1.0 3063510 Maybridge4_001167 Fc1cccc(Cl)c1CN2CCC(CC2)NS(=O)(=O)c3ccc(cc3)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 F02 compound treatment 0.155 0.0858 22.08 0.147 0.0782 21.77 31.0086 1.0 1623040 Maybridge4_001168 CCN(CC)c1ccc(NC(=O)Nc2ccc(OCc3ccccc3)cc2)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 F03 compound treatment 0.118 0.0488 12.55 0.122 0.0532 14.81 19.3493 0.9966 1283930 Maybridge4_001169 C1C(Cc2ccccc12)Nc3nc(ns3)c4ccccc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 F04 compound treatment 0.073 0.00375 0.97 0.071 0.00219 0.61 1.1135 0.9753 3179796 Maybridge4_001170 CC(C)(CC(=O)O)CC(=O)Nc1ccc(cc1)n2nc(cc2c3cccs3)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 F05 compound treatment 0.074 0.00475 1.22 0.073 0.00419 1.17 1.6894 0.9997 3063512 Maybridge4_001171 FC(F)(F)c1cc(cc(c1)S(=O)(=O)NCCN2CCNC2=O)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 F06 compound treatment 0.075 0.00575 1.48 0.072 0.00319 0.89 1.6745 0.9701 1430388 Maybridge4_001172 Cc1ccc(NC(=O)c2ccsc2)cc1NS(=O)(=O)C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 F07 compound treatment 0.074 0.00475 1.22 0.073 0.00419 1.17 1.6894 0.9997 1313330 Maybridge4_001173 Cc1oc(cc1C(=O)NCc2ccc3OCOc3c2)S(=O)(=O)N4CCCC4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 F08 compound treatment 0.089 0.0198 5.09 0.092 0.0232 6.46 8.1619 0.993 3063513 Maybridge4_001174 COC(=O)C1=C(CSC1)Nc2ccccc2NS(=O)(=O)c3ccc(cc3Cl)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 F09 compound treatment 0.099 0.0297 7.66 0.097 0.0282 7.85 10.9671 0.9999 1684282 Maybridge4_001175 COC(=O)c1sccc1c2ccc(CN3CCC(CC3)c4ccccc4OC)o2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 F10 compound treatment 0.076 0.00675 1.74 0.073 0.00419 1.17 2.0535 0.9812 1364415 Maybridge4_001176 Cc1oc(cc1C(=O)NC2Cc3ccccc3C2)C(C)(C)C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 F11 compound treatment 0.073 0.00375 0.97 0.073 0.00419 1.17 1.5073 0.9956 3063529 Maybridge4_001177 FC(F)(F)c1cc(cc(c1)C(F)(F)F)c2ccc(COC(=O)c3ccc4OCCc4c3)o2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 F12 compound treatment 0.147 0.0778 20.02 0.146 0.0772 21.5 29.3552 0.9994 1341364 Maybridge4_001178 Cc1ccc2nc(sc2c1)c3ccc(NC(=O)C4CCC4)cc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 F13 compound treatment 0.07 7.5E-4 0.19 0.069 1.88E-4 0.05 0.1735 0.8672 3063530 Maybridge4_001179 O=C(NCCN1CCN(Cc2ccccc2)CC1)Nc3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 F14 compound treatment 0.107 0.0377 9.72 0.108 0.0392 10.91 14.5897 0.9983 1693889 Maybridge4_001180 O=C(Nc1ccccc1)Nc2ccc(CC#N)cc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 F15 compound treatment 0.071 0.00175 0.45 0.07 0.00119 0.33 0.5525 0.9884 3063531 Maybridge4_001181 Cc1nc(ccc1C(=O)NN2CCOCC2)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 F16 compound treatment 0.074 0.00475 1.22 0.073 0.00419 1.17 1.6894 0.9997 1169808 Maybridge4_001182 O=C(Nc1cccc2ccccc12)N3CCN(CC3)c4ncccc4C#N 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 F17 compound treatment 0.097 0.0278 7.14 0.097 0.0282 7.85 10.6029 0.9989 3179797 Maybridge4_001183 Cc1onc(c1C(=O)N(C(=O)c2c(C)onc2c3ccccc3)c4ncc(C)nc4C)c5ccccc5 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 F18 compound treatment 0.074 0.00475 1.22 0.072 0.00319 0.89 1.4925 0.9876 1265508 Maybridge4_001184 COc1ccc(OCC(O)CNC(=O)c2sccc2Cl)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 F19 compound treatment 0.077 0.00775 2.0 0.074 0.00519 1.44 2.4325 0.9874 3063532 Maybridge4_001185 COC(=O)c1cnc(nc1C(F)(F)F)N2CCCN(CC2)C(=O)c3cc(nn3C)C(C)(C)C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 F20 compound treatment 0.073 0.00375 0.97 0.073 0.00419 1.17 1.5073 0.9956 3179798 Maybridge4_001186 CCOC(=O)N1CCC(CC1)NC(=O)Nc2cc(C)oc2C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 F21 compound treatment 0.071 0.00175 0.45 0.068 -8.12E-4 -0.23 0.1586 0.3146 1597233 Maybridge4_001187 COc1cccc2n(C)nc(NC(=O)CSCC(=O)O)c12 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 F22 compound treatment 0.072 0.00275 0.71 0.07 0.00119 0.33 0.7345 0.9399 1439715 Maybridge4_001188 CCc1ccc(cc1)S(=O)(=O)NCC(O)COc2ccc(OC)cc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 F23 mock treatment 0.066 -0.00325 -0.84 0.068 -8.12E-4 -0.23 -0.7517 -0.8672 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 F24 positive control 0.072 0.00275 0.71 0.074 0.00519 1.44 1.5222 0.9461 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 G01 compound treatment 0.075 0.00575 1.48 0.073 0.00419 1.17 1.8715 0.993 1075387 Maybridge4_001189 NC(=O)NC1CCCCCCC1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 G02 compound treatment 0.098 0.0288 7.4 0.098 0.0292 8.13 10.9819 0.9989 1679776 Maybridge4_001190 COC(=O)c1c(C)oc(C)c1S(=O)(=O)NC2CCCCCCCCCCC2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 G03 compound treatment 0.108 0.0388 9.98 0.108 0.0392 10.91 14.7718 0.999 3063533 Maybridge4_001191 COC(=O)c1cnc(nc1C(F)(F)F)n2ncc(C#N)c2N 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 G04 compound treatment 0.108 0.0388 9.98 0.106 0.0372 10.36 14.3779 0.9998 1394712 Maybridge4_001192 OCCN1CCN(CC1)C2=Cc3ccccc3C2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 G05 compound treatment 0.077 0.00775 2.0 0.077 0.00819 2.28 3.0233 0.9978 1644505 Maybridge4_001193 CC(C)(C)NC(=O)N1CCN(CC1)c2nc(ns2)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 G06 compound treatment 0.072 0.00275 0.71 0.071 0.00219 0.61 0.9314 0.9972 3063534 Maybridge4_001194 OC(=O)COCC(=O)N1CCN(CC1)c2cc(nc3ccccc23)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 G07 compound treatment 0.074 0.00475 1.22 0.073 0.00419 1.17 1.6894 0.9997 1201054 Maybridge4_001195 COc1ccccc1NC(=S)NC2CC3CCC2C3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 G08 compound treatment 0.125 0.0558 14.35 0.118 0.0492 13.7 19.836 0.9997 1231183 Maybridge4_001196 CCOC(=O)c1cccc(c1)n2sc(=O)n(C3Cc4ccccc4C3)c2=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 G09 compound treatment 0.232 0.163 41.9 0.237 0.168 46.84 62.7503 0.9985 1624776 Maybridge4_001197 Clc1ccc(s1)c2csc(n2)c3ccc4OCCc4c3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 G10 compound treatment 0.076 0.00675 1.74 0.073 0.00419 1.17 2.0535 0.9812 1282547 Maybridge4_001198 COC(=O)c1ccc(n1C)S(=O)(=O)N(C2CCCCC2)C3CCCCC3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 G11 compound treatment 0.076 0.00675 1.74 0.075 0.00619 1.72 2.4474 1.0 3063535 Maybridge4_001199 COC(=O)c1cc(oc1C)S(=O)(=O)Nc2cccc(c2)c3cnco3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 G12 compound treatment 0.124 0.0548 14.1 0.124 0.0552 15.37 20.8355 0.9991 3063536 Maybridge4_001200 FC(F)(F)c1ccccc1n2sc(=O)n(CC3CC3)c2=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 G13 compound treatment 0.079 0.00975 2.51 0.077 0.00819 2.28 3.3874 0.9988 3178224 Maybridge4_001201 COc1ccc(Oc2ccc(cc2NS(=O)(=O)c3cccc4nonc34)C(F)(F)F)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 G14 compound treatment 0.119 0.0498 12.81 0.121 0.0522 14.53 19.3344 0.998 3178225 Maybridge4_001202 FC(F)(F)c1cc(NC(=O)c2ccc(CN3C(=O)c4ccccc4C3=O)o2)ccc1Br 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 G15 compound treatment 0.071 0.00175 0.45 0.069 1.88E-4 0.05 0.3555 0.7838 3063537 Maybridge4_001203 OC(=O)c1sccc1S(=O)(=O)Nc2ccccc2N3CCOCC3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 G16 compound treatment 0.074 0.00475 1.22 0.072 0.00319 0.89 1.4925 0.9876 1305367 Maybridge4_001204 CC(C)(C)OC(=O)N1CCC(CNC(=O)Nc2ccccc2)CC1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 G17 compound treatment 0.082 0.0127 3.28 0.079 0.0102 2.84 4.3274 0.9974 1532622 Maybridge4_001205 Clc1ccc(cc1Cl)n2c(SCC(=O)N3CCOCC3)nc4ccccc4c2=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 G18 compound treatment 0.073 0.00375 0.97 0.071 0.00219 0.61 1.1135 0.9753 1304189 Maybridge4_001206 Fc1ccc(cc1)c2ccc(=O)n(CCC#N)n2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 G19 compound treatment 0.072 0.00275 0.71 0.071 0.00219 0.61 0.9314 0.9972 1675293 Maybridge4_001207 Cn1nc(NC(=O)C2CCC2C(=O)O)c3c(F)cccc13 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 G20 compound treatment 0.081 0.0118 3.03 0.079 0.0102 2.84 4.1454 0.9995 1345399 Maybridge4_001208 COC(=O)c1sccc1NC(=O)c2cc(oc2C)S(=O)(=O)N(C)C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 G21 compound treatment 0.114 0.0447 11.52 0.12 0.0512 14.26 18.2272 0.9944 1463889 Maybridge4_001209 Cc1ccc(C)n1c2nn(c3cccc(F)c23)S(=O)(=O)c4ccc(C)c5ccccc45 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 G22 compound treatment 0.07 7.5E-4 0.19 0.069 1.88E-4 0.05 0.1735 0.8672 1398688 Maybridge4_001210 Cc1cc(NS(=O)(=O)c2ccc3OCCOc3c2)no1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 G23 mock treatment 0.069 -2.5E-4 -0.06 0.069 1.88E-4 0.05 -0.0086 -0.1037 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 G24 positive control 0.074 0.00475 1.22 0.075 0.00619 1.72 2.0833 0.9859 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 H01 compound treatment 0.077 0.00775 2.0 0.075 0.00619 1.72 2.6294 0.9973 1708371 Maybridge4_001211 OC(=O)COCC(=O)NC1CCN(Cc2c(F)cccc2Cl)CC1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 H02 compound treatment 0.167 0.0978 25.17 0.161 0.0922 25.67 35.9502 1.0 3063538 Maybridge4_001212 Clc1ccc2nc(Sc3ccccc3NS(=O)(=O)c4ccc(C#N)cc4)sc2c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 H03 compound treatment 0.073 0.00375 0.97 0.071 0.00219 0.61 1.1135 0.9753 1419067 Maybridge4_001213 Cc1c(cnn1c2ccc(F)cc2)C(=O)N(Cc3ccccc3)Cc4cccnc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 H04 compound treatment 0.071 0.00175 0.45 0.069 1.88E-4 0.05 0.3555 0.7838 1711883 Maybridge4_001214 NS(=O)(=O)c1ccc(NC(=O)CC2(CC(=O)O)CCCC2)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 H05 compound treatment 0.077 0.00775 2.0 0.075 0.00619 1.72 2.6294 0.9973 1352488 Maybridge4_001215 Clc1c(sc2ccccc12)C(=O)NCCN3CCNC3=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 H06 compound treatment 0.086 0.0168 4.31 0.084 0.0152 4.23 6.0403 1.0 3178226 Maybridge4_001216 FC(F)(F)c1cc(no1)c2cc(cs2)S(=O)(=O)Nc3ccc4OCCOc4c3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 H07 compound treatment 0.078 0.00875 2.25 0.076 0.00719 2.0 3.0084 0.9983 1151414 Maybridge4_001217 COc1ccccc1OCC(O)CNCc2ccc3OCOc3c2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 H08 compound treatment 0.074 0.00475 1.22 0.073 0.00419 1.17 1.6894 0.9997 1595899 Maybridge4_001218 COC(=O)C1=C(CSC1)Nc2ccccc2NC(=O)c3ccccc3C(=O)O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 H09 compound treatment 0.158 0.0887 22.85 0.156 0.0872 24.28 33.3271 0.9995 3063539 Maybridge4_001219 CC(C)n1c(SCC(=O)Nc2ccccc2Cl)nc3cc(Cl)ccc13 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 H10 compound treatment 0.071 0.00175 0.45 0.069 1.88E-4 0.05 0.3555 0.7838 3178227 Maybridge4_001220 Cc1nc(ccc1C(=O)Nc2ccccc2c3ccccc3)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 H11 compound treatment 0.095 0.0257 6.63 0.103 0.0342 9.52 11.4204 0.9844 1134518 Maybridge4_001221 CN(C(=O)c1ccc(Cl)cc1)c2ccc(Cl)cc2C(=O)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 H12 compound treatment 0.109 0.0398 10.23 0.131 0.0622 17.32 19.4831 0.9685 1256492 Maybridge4_001222 CCCc1ccc(cc1)S(=O)(=O)Nc2ccc(C)c(NS(=O)(=O)C)c2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 H13 compound treatment 0.071 0.00175 0.45 0.069 1.88E-4 0.05 0.3555 0.7838 1621469 Maybridge4_001223 CCOC(=O)C1=C(NC(=O)NC1C)C(C)c2ccccc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 H14 compound treatment 0.128 0.0587 15.13 0.127 0.0582 16.2 22.1545 0.9994 1158832 Maybridge4_001224 CCc1ccnc(NC(=O)Nc2ccccc2C(C)(C)C)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 H15 compound treatment 0.074 0.00475 1.22 0.073 0.00419 1.17 1.6894 0.9997 3178228 Maybridge4_001225 O=S(=O)(NN1CCOCC1)c2cc(cs2)S(=O)(=O)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 H16 compound treatment 0.075 0.00575 1.48 0.073 0.00419 1.17 1.8715 0.993 1405785 Maybridge4_001226 Clc1cncc(Cl)c1N2CCCN(CC2)C(=O)Nc3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 H17 compound treatment 0.082 0.0127 3.28 0.083 0.0142 3.95 5.1151 0.9958 3178229 Maybridge4_001227 Cn1c(Cc2ccsc2)nnc1Sc3nc4ccc(Cl)cc4s3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 H18 compound treatment 0.078 0.00875 2.25 0.072 0.00319 0.89 2.2207 0.9171 1596031 Maybridge4_001228 COc1ccc(OCC(O)CNC(=O)c2ccc(cc2)N(C)C)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 H19 compound treatment 0.074 0.00475 1.22 0.071 0.00219 0.61 1.2956 0.9482 1496534 Maybridge4_001229 COC(=O)c1ccc(n1C)S(=O)(=O)NN2CCOCC2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 H20 compound treatment 0.07 7.5E-4 0.19 0.068 -8.12E-4 -0.23 -0.0235 -0.0789 1382593 Maybridge4_001230 CCOC(=O)N1CCC(CC1)NC(=O)Nc2ccc3OCCc3c2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 H21 compound treatment 0.102 0.0328 8.43 0.101 0.0322 8.96 12.3009 0.9995 1574673 Maybridge4_001231 COc1cccc2n(C)nc(NC(=O)c3nccnc3C(=O)O)c12 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 H22 compound treatment 0.07 7.5E-4 0.19 0.07 0.00119 0.33 0.3704 0.9672 1461069 Maybridge4_001232 CCOc1ccccc1NC(=O)N2CCCN(CC2)c3ncccc3C#N 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 H23 mock treatment 0.069 -2.5E-4 -0.06 0.069 1.88E-4 0.05 -0.0086 -0.1037 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 H24 positive control 0.075 0.00575 1.48 0.075 0.00619 1.72 2.2653 0.9971 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 I01 compound treatment 0.09 0.0208 5.34 0.088 0.0192 5.34 7.5562 1.0 1638533 Maybridge4_001233 CC(C)(C)c1ccc(cc1)c2cc(NS(=O)(=O)c3ccccc3)c(s2)C(=O)N 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 I02 compound treatment 0.071 0.00175 0.45 0.07 0.00119 0.33 0.5525 0.9884 3178230 Maybridge4_001234 COC(=O)c1c(C)oc(C)c1S(=O)(=O)NCc2ccc(OC)cc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 I03 compound treatment 0.079 0.00975 2.51 0.078 0.00919 2.56 3.5843 1.0 1615822 Maybridge4_001235 CCC(CO)NC(=S)Nc1ccsc1C(=O)OC 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 I04 compound treatment 0.119 0.0498 12.81 0.119 0.0502 13.98 18.9406 0.9991 1181672 Maybridge4_001236 COc1ccc(cc1)n2nnnc2c3c[nH]c4ccc(Cl)cc34 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 I05 compound treatment 0.07 7.5E-4 0.19 0.069 1.88E-4 0.05 0.1735 0.8672 3178231 Maybridge4_001237 OC(=O)/C=C\C(=O)N1CCN(CC1)c2nc(ns2)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 I06 compound treatment 0.073 0.00375 0.97 0.072 0.00319 0.89 1.3104 0.9991 1121093 Maybridge4_001238 COC(=O)c1ccc(n1C)S(=O)(=O)NC2CCN(Cc3ccccc3)CC2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 I07 compound treatment 0.07 7.5E-4 0.19 0.072 0.00319 0.89 0.7642 0.8413 3178232 Maybridge4_001239 CCCN(CCC)C(=S)NC1CC2CC1C=C2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 I08 compound treatment 0.076 0.00675 1.74 0.076 0.00719 2.0 2.6443 0.9975 1340809 Maybridge4_001240 OC1CCN(CC1)C(=O)c2cccc(CN3CCN(CC3)c4nc(ns4)c5ccccc5)c2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 I09 compound treatment 0.084 0.0147 3.8 0.082 0.0132 3.67 5.2823 0.9999 1278544 Maybridge4_001241 CN1CCN(CC1)c2ccc(NS(=O)(=O)c3cccc4nonc34)cc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 I10 compound treatment 0.071 0.00175 0.45 0.068 -8.12E-4 -0.23 0.1586 0.3146 1350689 Maybridge4_001242 COC(=O)c1ccc(n1C)S(=O)(=O)NC(C)(C)C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 I11 compound treatment 0.113 0.0437 11.26 0.114 0.0452 12.58 16.8636 0.9985 3178233 Maybridge4_001243 Cn1c(CSc2ccnc3cc(Cl)ccc23)nnc1SCC(=O)c4ccc(Cl)s4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 I12 compound treatment 0.179 0.11 28.26 0.173 0.104 29.02 40.498 0.9999 3063555 Maybridge4_001244 O/C(=C\Sc1nc2CCCCc2c(c1C#N)C(F)(F)F)/c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 I13 compound treatment 0.073 0.00375 0.97 0.07 0.00119 0.33 0.9166 0.8981 1516805 Maybridge4_001245 COC(=O)Cc1nc(NC(=O)C2CCC2C(=O)O)sc1C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 I14 compound treatment 0.073 0.00375 0.97 0.07 0.00119 0.33 0.9166 0.8981 1616395 Maybridge4_001246 CC(C)(C)OC(=O)N1CCC(CNC(=O)c2ccc(F)cc2F)CC1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 I15 compound treatment 0.121 0.0517 13.32 0.116 0.0472 13.14 18.7139 1.0 1670393 Maybridge4_001247 Cc1oc(cc1c2nc(no2)c3ccc(cc3)C(C)(C)C)S(=O)(=O)N4CCOCC4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 I16 compound treatment 0.162 0.0927 23.88 0.164 0.0952 26.51 35.6307 0.9986 1316867 Maybridge4_001248 CC(C)(C)c1ccc(cc1)c2nnc(SCc3cccc(c3)C(=O)N)n2c4ccc5OCOc5c4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 I17 compound treatment 0.074 0.00475 1.22 0.07 0.00119 0.33 1.0986 0.8672 1620610 Maybridge4_001249 OC(CNCc1ccc2OCOc2c1)COc3ccc(F)cc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 I18 compound treatment 0.078 0.00875 2.25 0.075 0.00619 1.72 2.8115 0.9912 1465779 Maybridge4_001250 CC(=O)Nc1cccc(c1)n2nnc(SCC(=O)c3ccccc3)n2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 I19 compound treatment 0.072 0.00275 0.71 0.069 1.88E-4 0.05 0.5376 0.7572 1598604 Maybridge4_001251 Cn1nc(NC(=O)CC(C)(C)CC(=O)O)c2c(F)cccc12 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 I20 compound treatment 0.1 0.0308 7.92 0.105 0.0362 10.08 12.7245 0.9929 1238878 Maybridge4_001252 Cc1oc(cc1C(=O)Nc2ccccc2)S(=O)(=O)N3CCCC3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 I21 compound treatment 0.072 0.00275 0.71 0.068 -8.12E-4 -0.23 0.3407 0.4583 1457140 Maybridge4_001253 Cc1ccc(C)n1c2nn(c3cccc(F)c23)S(=O)(=O)C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 I22 compound treatment 0.104 0.0348 8.95 0.107 0.0382 10.63 13.8466 0.9963 1519073 Maybridge4_001254 O=S(=O)(NCC1CCN(CC1)S(=O)(=O)c2ccccc2)c3cccc4nonc34 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 I23 mock treatment 0.07 7.5E-4 0.19 0.068 -8.12E-4 -0.23 -0.0235 -0.0789 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 I24 positive control 0.076 0.00675 1.74 0.076 0.00719 2.0 2.6443 0.9975 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 J01 compound treatment 0.079 0.00975 2.51 0.078 0.00919 2.56 3.5843 1.0 1542762 Maybridge4_001255 OC(=O)c1nccnc1C(=O)NC2CCN(Cc3c(F)cccc3Cl)CC2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 J02 compound treatment 0.071 0.00175 0.45 0.07 0.00119 0.33 0.5525 0.9884 1359019 Maybridge4_001256 CCCc1cnc(nc1)N2CCN(CC2)C(=S)NC 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 J03 compound treatment 0.141 0.0717 18.47 0.154 0.0852 23.72 29.8382 0.9923 1448044 Maybridge4_001257 CC(C)n1c(SCC(=O)c2ccccc2)nc3cc(Cl)ccc13 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 J04 compound treatment 0.073 0.00375 0.97 0.072 0.00319 0.89 1.3104 0.9991 1537193 Maybridge4_001258 CCS(=O)(=O)c1ccc(O)c(NC(=O)CCCC(=O)O)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 J05 compound treatment 0.077 0.00775 2.0 0.075 0.00619 1.72 2.6294 0.9973 1258625 Maybridge4_001259 Cc1oc(cc1C(=O)NCCN2CCNC2=O)S(=O)(=O)N3CCCC3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 J06 compound treatment 0.076 0.00675 1.74 0.075 0.00619 1.72 2.4474 1.0 1248986 Maybridge4_001260 Cc1ccc2n(CC(=O)c3ccccc3)c(=O)oc2c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 J07 compound treatment 0.076 0.00675 1.74 0.073 0.00419 1.17 2.0535 0.9812 1612362 Maybridge4_001261 OC(=O)COCC(=O)Nc1ccc2COC(=O)c2c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 J08 compound treatment 0.075 0.00575 1.48 0.074 0.00519 1.44 2.0684 0.9999 1623545 Maybridge4_001262 COC(=O)C1=C(CSC1)Nc2ccccc2NC(=O)COCC(=O)O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 J09 compound treatment 0.107 0.0377 9.72 0.108 0.0392 10.91 14.5897 0.9983 3063556 Maybridge4_001263 FC(F)(F)c1ccnc(n1)N2CCN(CCNC(=O)NC3CCCCC3)CC2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 J10 compound treatment 0.079 0.00975 2.51 0.077 0.00819 2.28 3.3874 0.9988 3178332 Maybridge4_001264 O=C(CSc1nccc(n1)c2cccs2)Nc3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 J11 compound treatment 0.12 0.0508 13.07 0.113 0.0442 12.31 17.9411 0.9996 3178333 Maybridge4_001265 Clc1cc(ccc1NC(=O)C2CCN(CC2)C(=O)OCc3ccccc3)N4CCOCC4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 J12 compound treatment 0.125 0.0558 14.35 0.128 0.0592 16.48 21.8053 0.9976 3063557 Maybridge4_001266 Cc1csc(NC(=O)c2ccccc2C(=O)O)c1c3nc4ccccc4s3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 J13 compound treatment 0.099 0.0297 7.66 0.107 0.0382 10.63 12.9363 0.987 3178334 Maybridge4_001267 Fc1cc(CNC(=O)c2ccc3nonc3c2)c4OCOCc4c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 J14 compound treatment 0.082 0.0127 3.28 0.081 0.0122 3.39 4.7213 0.9999 1272012 Maybridge4_001268 C1COc2cc(ccc2O1)c3cn4cccnc4n3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 J15 compound treatment 0.072 0.00275 0.71 0.07 0.00119 0.33 0.7345 0.9399 1207844 Maybridge4_001269 Cc1ccc(cc1)c2csc3ncnc(NCCN4CCNC4=O)c23 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 J16 compound treatment 0.073 0.00375 0.97 0.071 0.00219 0.61 1.1135 0.9753 3063558 Maybridge4_001270 OC(=O)COCC(=O)Nc1cccc(c1)C(=O)O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 J17 compound treatment 0.101 0.0318 8.17 0.103 0.0342 9.52 12.5127 0.9971 1592295 Maybridge4_001271 Cn1nc(c(NC(=O)c2ccc(F)cc2)c1C(C)(C)C)C(C)(C)C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 J18 compound treatment 0.1 0.0308 7.92 0.11 0.0412 11.47 13.7091 0.9836 1672779 Maybridge4_001272 O=C(Nc1ccccc1)Nc2ccc(C#N)cc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 J19 compound treatment 0.077 0.00775 2.0 0.077 0.00819 2.28 3.0233 0.9978 1287020 Maybridge4_001273 Nc1nccc(n1)c2nn(ccc2=O)c3ccc(Cl)cc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 J20 compound treatment 0.071 0.00175 0.45 0.069 1.88E-4 0.05 0.3555 0.7838 1290569 Maybridge4_001274 CCOC(=O)N1CCC(CC1)NC(=O)c2ccccc2C(=O)O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 J21 compound treatment 0.071 0.00175 0.45 0.069 1.88E-4 0.05 0.3555 0.7838 1226002 Maybridge4_001275 Cc1nn(C)cc1NC(=O)Nc2ccc(F)cc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 J22 compound treatment 0.07 7.5E-4 0.19 0.068 -8.12E-4 -0.23 -0.0235 -0.0789 3178335 Maybridge4_001276 O=C(Nc1ccccc1)N(CCC#N)Cc2ccccc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 J23 mock treatment 0.069 -2.5E-4 -0.06 0.069 1.88E-4 0.05 -0.0086 -0.1037 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 J24 positive control 0.076 0.00675 1.74 0.076 0.00719 2.0 2.6443 0.9975 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 K01 compound treatment 0.08 0.0107 2.77 0.078 0.00919 2.56 3.7664 0.9992 1539150 Maybridge4_001277 CC(C)(C)c1cc2ncnc(NC3CCN(Cc4ccccc4)CC3)c2s1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 K02 compound treatment 0.08 0.0107 2.77 0.079 0.0102 2.84 3.9633 0.9999 1563937 Maybridge4_001278 COC(=O)c1c(C)oc(C)c1S(=O)(=O)Nc2ccc(cc2)C(C)C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 K03 compound treatment 0.07 7.5E-4 0.19 0.069 1.88E-4 0.05 0.1735 0.8672 3063559 Maybridge4_001279 CCC1CSc2nc3ccsc3c(=O)n12 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 K04 compound treatment 0.097 0.0278 7.14 0.097 0.0282 7.85 10.6029 0.9989 3178336 Maybridge4_001280 FC(F)(F)c1cccc(c1)N2CCN(CC2)C3=Cc4ccccc4CC3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 K05 compound treatment 0.064 -0.00525 -1.35 0.064 -0.00481 -1.34 -1.9035 -1.0 3063560 Maybridge4_001281 FC(F)(F)c1ccnc(S)n1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 K06 compound treatment 0.079 0.00975 2.51 0.076 0.00719 2.0 3.1905 0.9937 3178337 Maybridge4_001282 COC(=O)c1ccc(n1C)S(=O)(=O)Nc2ccc(cc2)N3CCOCC3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 K07 compound treatment 0.128 0.0587 15.13 0.139 0.0702 19.55 24.5176 0.992 1176274 Maybridge4_001283 CC1CC(CC(C)(C)C1)NC(=S)NC2CC3CC2C=C3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 K08 compound treatment 0.145 0.0757 19.5 0.138 0.0692 19.27 27.4157 1.0 1427567 Maybridge4_001284 Cc1ccc(C)n1c2ccc(cc2)C3(O)CCSc4ccccc43 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 K09 compound treatment 0.146 0.0767 19.76 0.15 0.0812 22.61 29.9608 0.9977 1358302 Maybridge4_001285 CC(C)(C)OC(=O)N1CCC(CC1)c2nc(cs2)c3ccc(Cl)s3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 K10 compound treatment 0.069 -2.5E-4 -0.06 0.068 -8.12E-4 -0.23 -0.2055 -0.8736 1583408 Maybridge4_001286 COc1ccccc1CCNS(=O)(=O)c2ccc(C(=O)O)n2C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 K11 compound treatment 0.103 0.0338 8.69 0.106 0.0372 10.36 13.4676 0.9962 3178338 Maybridge4_001287 OC1(CCN(CC1)C(=O)c2cc(cc(c2)C(F)(F)F)C(F)(F)F)c3ccc(Cl)cc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 K12 compound treatment 0.075 0.00575 1.48 0.073 0.00419 1.17 1.8715 0.993 3063561 Maybridge4_001288 OC1(NC(=O)c2cnn(c2C(F)(F)F)c3ccccc3)C(=O)c4ccccc4C1=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 K13 compound treatment 0.077 0.00775 2.0 0.075 0.00619 1.72 2.6294 0.9973 3178339 Maybridge4_001289 COc1ccc(NC(=O)c2ccccc2C(F)(F)F)cc1OC3CCCC3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 K14 compound treatment 0.073 0.00375 0.97 0.07 0.00119 0.33 0.9166 0.8981 1513815 Maybridge4_001290 CC(C)(C)OC(=O)N1CCC(CNS(=O)(=O)c2cccc3cccnc23)CC1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 K15 compound treatment 0.071 0.00175 0.45 0.068 -8.12E-4 -0.23 0.1586 0.3146 1269818 Maybridge4_001291 Cc1cc(NS(=O)(=O)c2ccc(NCN3C(=O)c4ccccc4C3=O)cc2)no1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 K16 compound treatment 0.079 0.00975 2.51 0.074 0.00519 1.44 2.7966 0.9656 3178340 Maybridge4_001292 CC(C)NC(=O)CSc1nnc(c2ccc(cc2)C(C)(C)C)n1c3ccc4OCOc4c3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 K17 compound treatment 0.073 0.00375 0.97 0.07 0.00119 0.33 0.9166 0.8981 1222771 Maybridge4_001293 NC(=O)C1CCN(CC(O)COc2ccc(F)cc2)CC1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 K18 compound treatment 0.118 0.0488 12.55 0.118 0.0492 13.7 18.5616 0.999 1223041 Maybridge4_001294 CC(=O)Nc1cccc(c1)n2nnc(SCc3cc(Cl)cc4COCOc34)n2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 K19 compound treatment 0.111 0.0418 10.75 0.121 0.0522 14.53 17.878 0.989 1546521 Maybridge4_001295 COc1ccc2[nH]c(cc2c1)C(=O)N3CCC(Cc4ccccc4)CC3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 K20 compound treatment 0.093 0.0238 6.11 0.099 0.0302 8.41 10.2686 0.9878 1729108 Maybridge4_001296 Cc1oc(cc1c2nc(no2)c3ccc(F)cc3)S(=O)(=O)N4CCCC4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 K21 compound treatment 0.135 0.0658 16.93 0.131 0.0622 17.32 24.2166 0.9999 3178447 Maybridge4_001297 Cc1ccc(C)n1c2nn(c3cccc(F)c23)S(=O)(=O)c4cccc(c4)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 K22 compound treatment 0.129 0.0597 15.38 0.136 0.0672 18.71 24.1089 0.9953 1411945 Maybridge4_001298 Cc1ccc(Oc2ncccc2NS(=O)(=O)c3ccc(s3)c4ccccn4)c5CCCc51 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 K23 mock treatment 0.069 -2.5E-4 -0.06 0.069 1.88E-4 0.05 -0.0086 -0.1037 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 K24 positive control 0.078 0.00875 2.25 0.077 0.00819 2.28 3.2053 1.0 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 L01 compound treatment 0.08 0.0107 2.77 0.078 0.00919 2.56 3.7664 0.9992 3178448 Maybridge4_001299 COCc1cc(O)nc(SCC(=O)c2ccccc2)n1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 L02 compound treatment 0.078 0.00875 2.25 0.082 0.0132 3.67 4.19 0.9725 3063562 Maybridge4_001300 Fc1ccc(cc1)S(=O)(=O)N2CCCN(CC2)c3nccc(n3)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 L03 compound treatment 0.147 0.0778 20.02 0.146 0.0772 21.5 29.3552 0.9994 3178449 Maybridge4_001301 Nc1nc(SCC(=O)c2cc(no2)c3ccccc3)ncc1C(=O)O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 L04 compound treatment 0.075 0.00575 1.48 0.075 0.00619 1.72 2.2653 0.9971 1497829 Maybridge4_001302 CCCNC(=O)Nc1cc(ccc1O)S(=O)(=O)CC 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 L05 compound treatment 0.074 0.00475 1.22 0.073 0.00419 1.17 1.6894 0.9997 1614464 Maybridge4_001303 OC(CN(CCN1CCNC1=O)CC(O)c2ccccc2)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 L06 compound treatment 0.156 0.0867 22.34 0.154 0.0852 23.72 32.5691 0.9995 1416766 Maybridge4_001304 Clc1ccc2scc(CNS(=O)(=O)c3cc(cs3)S(=O)(=O)c4ccccc4)c2c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 L07 compound treatment 0.155 0.0858 22.08 0.155 0.0862 24.0 32.584 0.9991 3063563 Maybridge4_001305 O=C(Nc1ccc2COC(=O)c2c1)c3cc4ccccc4s3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 L08 compound treatment 0.101 0.0318 8.17 0.102 0.0332 9.24 12.3158 0.9981 3178450 Maybridge4_001306 Cc1cc(NC(=O)NCCNc2ncccc2C(F)(F)F)c(o1)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 L09 compound treatment 0.072 0.00275 0.71 0.069 1.88E-4 0.05 0.5376 0.7572 3178451 Maybridge4_001307 FC(F)(F)c1ccnc(n1)N2CCN(CCNC(=O)c3cccs3)CC2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 L10 compound treatment 0.071 0.00175 0.45 0.069 1.88E-4 0.05 0.3555 0.7838 3063564 Maybridge4_001308 O=C(CSc1nccc(n1)c2cccs2)N3CCOCC3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 L11 compound treatment 0.099 0.0297 7.66 0.103 0.0342 9.52 12.1486 0.9942 1340769 Maybridge4_001309 Cc1c(csc1C(=O)NC2CCN(Cc3ccccc3)CC2)S(=O)(=O)c4ccc(Cl)cc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 L12 compound treatment 0.096 0.0267 6.89 0.093 0.0242 6.74 9.6332 0.9999 1452839 Maybridge4_001310 Clc1cccc(Oc2ccccc2)c1CNC(=O)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 L13 compound treatment 0.073 0.00375 0.97 0.073 0.00419 1.17 1.5073 0.9956 1545947 Maybridge4_001311 Cc1ccc(cc1)S(=O)(=O)NC(=O)OCCn2ncc3ccccc3c2=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 L14 compound treatment 0.11 0.0408 10.49 0.111 0.0422 11.75 15.7267 0.9984 1335669 Maybridge4_001312 O=C(Nc1ccccc1)Nc2ccccc2C(=O)NCC3CC3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 L15 compound treatment 0.071 0.00175 0.45 0.07 0.00119 0.33 0.5525 0.9884 1301958 Maybridge4_001313 O=C1NCCN1CCNc2cccc(C#N)n2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 L16 compound treatment 0.074 0.00475 1.22 0.072 0.00319 0.89 1.4925 0.9876 1237826 Maybridge4_001314 OC(=O)c1cccc(NC(=O)c2nccnc2C(=O)O)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 L17 compound treatment 0.119 0.0498 12.81 0.119 0.0502 13.98 18.9406 0.9991 1167798 Maybridge4_001315 CCOC(=O)C1CCN(CC1)c2ccccc2CN3CCCc4cc(C)ccc34 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 L18 compound treatment 0.091 0.0217 5.6 0.089 0.0202 5.62 7.9352 1.0 1532681 Maybridge4_001316 O=C(NCC1CC1)c2ccccc2NS(=O)(=O)c3cccc4nonc34 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 L19 compound treatment 0.071 0.00175 0.45 0.069 1.88E-4 0.05 0.3555 0.7838 3178452 Maybridge4_001317 COc1ccc(OCCNC(=O)c2nccnc2C(=O)O)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 L20 compound treatment 0.071 0.00175 0.45 0.07 0.00119 0.33 0.5525 0.9884 3063588 Maybridge4_001318 OC(=O)COCC(=O)Nc1ccc(cc1)n2ccc(n2)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 L21 compound treatment 0.072 0.00275 0.71 0.07 0.00119 0.33 0.7345 0.9399 1125657 Maybridge4_001319 NC(=O)C1CCN(CC1)C(=O)Nc2cc3ccccc3s2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 L22 compound treatment 0.126 0.0568 14.61 0.138 0.0692 19.27 23.9566 0.9907 3063589 Maybridge4_001320 Cc1ccc(cc1)S(=O)(=O)CCSCc2csc3ccccc23 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 L23 mock treatment 0.07 7.5E-4 0.19 0.069 1.88E-4 0.05 0.1735 0.8672 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 L24 positive control 0.076 0.00675 1.74 0.075 0.00619 1.72 2.4474 1.0 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 M01 compound treatment 0.116 0.0468 12.04 0.115 0.0462 12.86 17.6067 0.9994 1132483 Maybridge4_001321 N(c1ccccc1)c2ncnc3cc(sc23)c4ccccc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 M02 compound treatment 0.072 0.00275 0.71 0.069 1.88E-4 0.05 0.5376 0.7572 1732345 Maybridge4_001322 OC(=O)CSCC(=O)N1CCN(CC1)S(=O)(=O)c2cc(Cl)cc(Cl)c2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 M03 compound treatment 0.072 0.00275 0.71 0.072 0.00319 0.89 1.1284 0.9937 1627433 Maybridge4_001323 NCCNC(=O)Cc1ccc(O)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 M04 compound treatment 0.078 0.00875 2.25 0.076 0.00719 2.0 3.0084 0.9983 1237825 Maybridge4_001324 O=C(Nc1nc2ccccc2c(=O)s1)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 M05 compound treatment 0.146 0.0767 19.76 0.156 0.0872 24.28 31.1424 0.9948 1700739 Maybridge4_001325 OC(CSc1cccs1)CSc2ccccc2NC(=O)c3ccc(Cl)cc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 M06 compound treatment 0.072 0.00275 0.71 0.071 0.00219 0.61 0.9314 0.9972 1271443 Maybridge4_001326 COC(=O)c1ccc(n1C)S(=O)(=O)Nc2ccsc2C(=O)OC 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 M07 compound treatment 0.17 0.101 25.94 0.171 0.102 28.46 38.4657 0.9989 3063590 Maybridge4_001327 S=C(NC(Cc1ccccc1)c2ccccc2)NC3CC4CC3C=C4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 M08 compound treatment 0.176 0.107 27.48 0.174 0.105 29.29 40.1488 0.9995 1434508 Maybridge4_001328 Fc1ccc2[nH]cc(CCCN3CCN(CC3)c4nc5cc(Cl)ccc5s4)c2c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 M09 compound treatment 0.072 0.00275 0.71 0.069 1.88E-4 0.05 0.5376 0.7572 1293074 Maybridge4_001329 COC(=O)c1cc(oc1C)S(=O)(=O)Nc2nn(C)c3ccccc23 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 M10 compound treatment 0.094 0.0248 6.37 0.096 0.0272 7.57 9.8598 0.9963 1681613 Maybridge4_001330 O=C(NCc1ccc2OCOc2c1)c3cc4ccccc4s3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 M11 compound treatment 0.12 0.0508 13.07 0.117 0.0482 13.42 18.7288 0.9999 1565655 Maybridge4_001331 CC(C)(C)c1ccc(cc1)S(=O)(=O)N2CCC(O)(CC2)c3ccc(Cl)cc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 M12 compound treatment 0.072 0.00275 0.71 0.071 0.00219 0.61 0.9314 0.9972 1050571 Maybridge4_001332 OC(=O)CCc1cccnc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 M13 compound treatment 0.081 0.0118 3.03 0.079 0.0102 2.84 4.1454 0.9995 1126449 Maybridge4_001333 COc1ccc(NC(=O)C2CCCCC2)cc1OC3CCCC3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 M14 compound treatment 0.072 0.00275 0.71 0.07 0.00119 0.33 0.7345 0.9399 1537113 Maybridge4_001334 CC(C)(C)OC(=O)N1CCC(CNS(=O)(=O)c2ccc3OCCOc3c2)CC1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 M15 compound treatment 0.164 0.0948 24.4 0.162 0.0932 25.95 35.601 0.9995 1458162 Maybridge4_001335 CC(C)(C)c1ccc(NC(=O)c2ccc(cc2)N3C(=O)CSCC3=O)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 M16 compound treatment 0.082 0.0127 3.28 0.079 0.0102 2.84 4.3274 0.9974 1342126 Maybridge4_001336 NC(=O)NC(=O)Cc1nc2ccccc2s1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 M17 compound treatment 0.073 0.00375 0.97 0.072 0.00319 0.89 1.3104 0.9991 1668027 Maybridge4_001337 OC(CNC1Cc2ccccc2C1)COc3ccc(F)cc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 M18 compound treatment 0.073 0.00375 0.97 0.071 0.00219 0.61 1.1135 0.9753 3063591 Maybridge4_001338 OC(=O)CSc1nc2cccnc2s1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 M19 compound treatment 0.071 0.00175 0.45 0.069 1.88E-4 0.05 0.3555 0.7838 1290479 Maybridge4_001339 NC(=O)C1CCN(CC(O)COc2ccc3OCOc3c2)CC1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 M20 compound treatment 0.073 0.00375 0.97 0.071 0.00219 0.61 1.1135 0.9753 1132021 Maybridge4_001340 COC(=O)c1scc(C)c1NS(=O)(=O)c2ccc3OCCc3c2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 M21 compound treatment 0.149 0.0798 20.53 0.164 0.0952 26.51 33.264 0.992 1157417 Maybridge4_001341 COc1ccc(cc1OC)S(=O)(=O)n2nc(n3c(C)ccc3C)c4c(F)cccc24 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 M22 compound treatment 0.07 7.5E-4 0.19 0.068 -8.12E-4 -0.23 -0.0235 -0.0789 1722963 Maybridge4_001342 Cc1nc(cn1C)S(=O)(=O)N2CCC(CC2)NC(=O)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 M23 mock treatment 0.069 -2.5E-4 -0.06 0.069 1.88E-4 0.05 -0.0086 -0.1037 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 M24 positive control 0.078 0.00875 2.25 0.077 0.00819 2.28 3.2053 1.0 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 N01 compound treatment 0.081 0.0118 3.03 0.08 0.0112 3.12 4.3423 0.9999 1329289 Maybridge4_001343 OC(=O)c1ccccc1C(=O)NCCN2CCNC2=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 N02 compound treatment 0.098 0.0288 7.4 0.102 0.0332 9.24 11.7696 0.9939 3178453 Maybridge4_001344 FC(F)(F)c1ccnc(n1)N2CCCN(CC2)S(=O)(=O)c3cccc4nonc34 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 N03 compound treatment 0.078 0.00875 2.25 0.076 0.00719 2.0 3.0084 0.9983 1118431 Maybridge4_001345 CCOC(=O)c1cc(NC(=O)CC(C)(C)CC(=O)O)ccc1N2CCCCC2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 N04 compound treatment 0.073 0.00375 0.97 0.073 0.00419 1.17 1.5073 0.9956 1615128 Maybridge4_001346 CCS(=O)(=O)c1ccc(O)c(NC(=O)Nc2ccccc2OC)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 N05 compound treatment 0.086 0.0168 4.31 0.085 0.0162 4.51 6.2372 0.9998 3178454 Maybridge4_001347 Cc1nc(cn1C)S(=O)(=O)NCCNc2ccc(nn2)c3ccc(F)cc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 N06 compound treatment 0.074 0.00475 1.22 0.073 0.00419 1.17 1.6894 0.9997 3063592 Maybridge4_001348 FC(F)(F)c1ccc(cc1)S(=O)(=O)Nc2ccc3COC(=O)c3c2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 N07 compound treatment 0.082 0.0127 3.28 0.079 0.0102 2.84 4.3274 0.9974 1059288 Maybridge4_001349 O=C1NC(Nc2ccccc12)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 N08 compound treatment 0.108 0.0388 9.98 0.109 0.0402 11.19 14.9687 0.9984 3063593 Maybridge4_001350 Cc1cc(NC(=O)Nc2ccccc2)c(o1)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 N09 compound treatment 0.072 0.00275 0.71 0.07 0.00119 0.33 0.7345 0.9399 3178455 Maybridge4_001351 COc1cccc(c1)C(=O)NCCN2CCN(CC2)c3nccc(n3)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 N10 compound treatment 0.07 7.5E-4 0.19 0.069 1.88E-4 0.05 0.1735 0.8672 1126742 Maybridge4_001352 Cc1cc(NC(=O)CCCC(=O)O)n(C)n1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 N11 compound treatment 0.123 0.0537 13.84 0.128 0.0592 16.48 21.4411 0.9962 1374549 Maybridge4_001353 COc1ccccc1C2CCN(CC2)C(=O)c3scc(c3C)S(=O)(=O)c4ccc(Cl)cc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 N12 compound treatment 0.098 0.0288 7.4 0.091 0.0222 6.18 9.6035 0.996 1540730 Maybridge4_001354 Cc1oc(cc1C(=O)N2CCN(CC2)C(c3ccccc3)c4ccccc4)C(C)(C)C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 N13 compound treatment 0.077 0.00775 2.0 0.073 0.00419 1.17 2.2356 0.9673 1417640 Maybridge4_001355 O=C(Nc1cccc2ccccc12)OCCn3ncc4ccccc4c3=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 N14 compound treatment 0.072 0.00275 0.71 0.071 0.00219 0.61 0.9314 0.9972 1318344 Maybridge4_001356 COC(=O)c1sccc1S(=O)(=O)Nc2ccc3OCCOc3c2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 N15 compound treatment 0.074 0.00475 1.22 0.072 0.00319 0.89 1.4925 0.9876 3178549 Maybridge4_001357 FC(F)(F)Oc1ccc(NC(=S)NCCN2CCNC2=O)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 N16 compound treatment 0.075 0.00575 1.48 0.073 0.00419 1.17 1.8715 0.993 1460315 Maybridge4_001358 COc1ccc(OCC(O)CNC(=O)c2cc(nn2C)C(C)(C)C)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 N17 compound treatment 0.074 0.00475 1.22 0.073 0.00419 1.17 1.6894 0.9997 1196797 Maybridge4_001359 CCCc1c(cnn1c2ccccc2)C(=O)NC3CCN(Cc4ccccc4)CC3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 N18 compound treatment 0.098 0.0288 7.4 0.098 0.0292 8.13 10.9819 0.9989 3178550 Maybridge4_001360 COc1cc(OCc2ccccc2)ccc1CN3CCN(CC3)c4ccc(cn4)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 N19 compound treatment 0.131 0.0617 15.9 0.133 0.0642 17.88 23.8822 0.9983 1300856 Maybridge4_001361 O=C(NC1Cc2ccccc2C1)Nc3cc4ccccc4s3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 N20 compound treatment 0.072 0.00275 0.71 0.07 0.00119 0.33 0.7345 0.9399 1617412 Maybridge4_001362 OC(=O)CC(CC(=O)N1CCN(CC1)C(=O)c2ccco2)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 N21 compound treatment 0.196 0.127 32.63 0.192 0.123 34.31 47.3346 0.9997 1534103 Maybridge4_001363 OC(COc1ccc(cc1)c2csnn2)CN3CCN(CC3)C(c4ccccc4)c5ccccc5 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 N22 compound treatment 0.165 0.0958 24.65 0.172 0.103 28.74 37.7523 0.9971 3063594 Maybridge4_001364 Clc1ccc(c(Cl)c1)S(=O)(=O)CCSCc2csc3ccccc23 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 N23 mock treatment 0.07 7.5E-4 0.19 0.068 -8.12E-4 -0.23 -0.0235 -0.0789 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 N24 positive control 0.077 0.00775 2.0 0.076 0.00719 2.0 2.8264 1.0 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 O01 compound treatment 0.083 0.0138 3.54 0.081 0.0122 3.39 4.9033 0.9998 1379542 Maybridge4_001365 CC(C)(C)c1cc2ncnc(N3CCCCC3)c2s1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 O02 compound treatment 0.073 0.00375 0.97 0.072 0.00319 0.89 1.3104 0.9991 1268570 Maybridge4_001366 Cc1cc(OCC(=O)N(C2CCCCC2)c3ccccc3)c4ccccc4n1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 O03 compound treatment 0.071 0.00175 0.45 0.07 0.00119 0.33 0.5525 0.9884 3063595 Maybridge4_001367 FC(F)(F)c1ccn(n1)S(=O)(=O)c2ccc(Cl)cc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 O04 compound treatment 0.175 0.106 27.23 0.163 0.0942 26.23 37.8006 0.9998 1471781 Maybridge4_001368 Cc1csc2c(=O)sc(NC(=O)c3cccs3)nc12 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 O05 compound treatment 0.074 0.00475 1.22 0.072 0.00319 0.89 1.4925 0.9876 3178551 Maybridge4_001369 COC(=O)c1cn(Cc2ccc(Cl)cc2)cc(F)c1=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 O06 compound treatment 0.074 0.00475 1.22 0.072 0.00319 0.89 1.4925 0.9876 1122209 Maybridge4_001370 COC(=O)c1ccc(n1C)S(=O)(=O)N2CCCN(Cc3ccccc3)CC2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 O07 compound treatment 0.075 0.00575 1.48 0.073 0.00419 1.17 1.8715 0.993 1177633 Maybridge4_001371 CC(C)(CCO)NC(=S)NC1CC2CC1C=C2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 O08 compound treatment 0.071 0.00175 0.45 0.068 -8.12E-4 -0.23 0.1586 0.3146 1162225 Maybridge4_001372 CCNC(=O)c1c(C)onc1c2ccccc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 O09 compound treatment 0.07 7.5E-4 0.19 0.068 -8.12E-4 -0.23 -0.0235 -0.0789 3063596 Maybridge4_001373 Cc1csc2c(NCCCN3CCOCC3)ncnc12 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 O10 compound treatment 0.093 0.0238 6.11 0.089 0.0202 5.62 8.2993 0.9991 3178552 Maybridge4_001374 COc1ccc(cc1)c2cc(C(=O)Nc3ccc(F)cc3)c(o2)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 O11 compound treatment 0.071 0.00175 0.45 0.07 0.00119 0.33 0.5525 0.9884 3063597 Maybridge4_001375 Fc1ccc(cc1)S(=O)(=O)N2CCN=C(C=C2)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 O12 compound treatment 0.072 0.00275 0.71 0.07 0.00119 0.33 0.7345 0.9399 1566889 Maybridge4_001376 O=C(Nc1ccc2OCCOc2c1)c3cccs3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 O13 compound treatment 0.079 0.00975 2.51 0.077 0.00819 2.28 3.3874 0.9988 3178553 Maybridge4_001377 CC(=O)Nc1c(c(nn1C)C(F)(F)F)c2cccc(c2)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 O14 compound treatment 0.081 0.0118 3.03 0.077 0.00819 2.28 3.7515 0.9903 1314147 Maybridge4_001378 CC(C)(C)OC(=O)N1CCC(CNS(=O)(=O)c2cc(Cl)sc2Cl)CC1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 O15 compound treatment 0.072 0.00275 0.71 0.069 1.88E-4 0.05 0.5376 0.7572 1617882 Maybridge4_001379 OC(=O)CC1(CC(=O)N2CCN(CC2)C(c3ccccc3)c4ccccc4)CCCC1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 O16 compound treatment 0.105 0.0357 9.2 0.1 0.0312 8.69 12.6502 0.9996 3063620 Maybridge4_001380 Cc1nc(nc(SCC(=O)c2ccc(F)cc2)c1Cl)c3ccccn3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 O17 compound treatment 0.075 0.00575 1.48 0.073 0.00419 1.17 1.8715 0.993 1499688 Maybridge4_001381 NC(=O)C1CCN(Cn2nnc3ccccc23)CC1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 O18 compound treatment 0.085 0.0158 4.06 0.088 0.0192 5.34 6.6459 0.9907 1432924 Maybridge4_001382 COc1ccc(CCNC(=O)c2cc3ccccc3s2)cc1OC 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 O19 compound treatment 0.137 0.0678 17.44 0.135 0.0662 18.43 25.3684 0.9996 1075902 Maybridge4_001383 COc1ccccc1NC(=O)Nc2ccccc2OC 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 O20 compound treatment 0.076 0.00675 1.74 0.075 0.00619 1.72 2.4474 1.0 3063621 Maybridge4_001384 Fc1ccc(cc1)S(=O)(=O)CCN2CCN=C(C=C2)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 O21 compound treatment 0.1 0.0308 7.92 0.101 0.0322 8.96 11.9368 0.9981 1600262 Maybridge4_001385 O=C(CC1(CC2CC3CC(C2)C1)C3)NCc4ccc5OCOc5c4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 O22 compound treatment 0.072 0.00275 0.71 0.068 -8.12E-4 -0.23 0.3407 0.4583 1226207 Maybridge4_001386 OC(=O)CCn1nc(ccc1=O)c2ccc(F)cc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 O23 mock treatment 0.07 7.5E-4 0.19 0.067 -0.00181 -0.5 -0.2204 -0.4078 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 O24 positive control 0.077 0.00775 2.0 0.076 0.00719 2.0 2.8264 1.0 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 P01 compound treatment 0.085 0.0158 4.06 0.083 0.0142 3.95 5.6613 0.9999 1550189 Maybridge4_001387 Cc1ccc(cc1)C(=O)NCCN2CCNC2=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 P02 compound treatment 0.114 0.0447 11.52 0.11 0.0412 11.47 16.258 1.0 3178554 Maybridge4_001388 Cc1ccsc1CNC(=O)Nc2ccc(cc2)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 P03 compound treatment 0.099 0.0297 7.66 0.096 0.0272 7.57 10.7701 1.0 3063622 Maybridge4_001389 CCOC(=O)C(C#N)C1C(=C(N)Oc2c(C)cc(Cl)cc12)C(=O)OCC 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 P04 compound treatment 0.171 0.102 26.2 0.186 0.117 32.64 41.6016 0.9941 1160881 Maybridge4_001390 COC(=O)c1sccc1c2ccc(CN3CCCc4cc(OC)ccc34)o2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 P05 compound treatment 0.081 0.0118 3.03 0.079 0.0102 2.84 4.1454 0.9995 1537339 Maybridge4_001391 COC(=O)c1sccc1S(=O)(=O)NC2CCS(=O)(=O)C2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 P06 compound treatment 0.079 0.00975 2.51 0.077 0.00819 2.28 3.3874 0.9988 3178555 Maybridge4_001392 O=C1OCc2ccc(NS(=O)(=O)c3ccccc3C#N)cc12 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 P07 compound treatment 0.08 0.0107 2.77 0.084 0.0152 4.23 4.9479 0.9789 1343805 Maybridge4_001393 O=C(NC1CCN(Cc2ccccc2)CC1)Nc3cc4ccccc4s3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 P08 compound treatment 0.091 0.0217 5.6 0.09 0.0212 5.9 8.1321 0.9997 3063623 Maybridge4_001394 Cc1cc(NC(=O)NCc2ccccc2)c(o1)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 P09 compound treatment 0.093 0.0238 6.11 0.089 0.0202 5.62 8.2993 0.9991 3178556 Maybridge4_001395 FC(F)(F)c1ccnc(n1)N2CCN(CCNC(=O)c3ccc(Cl)cc3)CC2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 P10 compound treatment 0.1 0.0308 7.92 0.094 0.0252 7.01 10.5583 0.9982 1315475 Maybridge4_001396 Cc1oc(cc1C(=O)NCc2csc3ccc(Cl)cc23)C(C)(C)C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 P11 compound treatment 0.135 0.0658 16.93 0.138 0.0692 19.27 25.5951 0.9979 1707754 Maybridge4_001397 Cc1c(csc1C(=O)N2CCCc3cc(C)ccc23)S(=O)(=O)c4ccc(Cl)cc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 P12 compound treatment 0.13 0.0607 15.64 0.125 0.0562 15.65 22.1248 1.0 1437749 Maybridge4_001398 CC(C)c1ccc(NC(=O)c2cc(oc2C)C(C)(C)C)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 P13 compound treatment 0.083 0.0138 3.54 0.085 0.0162 4.51 5.691 0.9928 3178557 Maybridge4_001399 FC(F)(F)c1cc(cc(c1)C(F)(F)F)c2ccc(COC(=O)c3cccs3)o2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 P14 compound treatment 0.073 0.00375 0.97 0.072 0.00319 0.89 1.3104 0.9991 1200741 Maybridge4_001400 CC(C)(CC(=O)O)CC(=O)N1CCN(CC1)c2ncccc2C#N 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 P15 compound treatment 0.089 0.0198 5.09 0.09 0.0212 5.9 7.768 0.9973 1650074 Maybridge4_001401 CCOC(=O)c1ccc(NC(=S)NCCN2CCNC2=O)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 P16 compound treatment 0.084 0.0147 3.8 0.075 0.00619 1.72 3.9038 0.9361 1225431 Maybridge4_001402 COc1ccc(OCC(O)CNC(=O)c2cccnc2Oc3ccc(Cl)cc3)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 P17 compound treatment 0.086 0.0168 4.31 0.084 0.0152 4.23 6.0403 1.0 1670405 Maybridge4_001403 CCCc1c(cnn1c2ccccc2)C(=O)NC3Cc4ccccc4C3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 P18 compound treatment 0.08 0.0107 2.77 0.079 0.0102 2.84 3.9633 0.9999 1600703 Maybridge4_001404 COc1cc(OCc2ccccc2)ccc1CN3CCC(CC3)C(=O)c4ccc(F)cc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 P19 compound treatment 0.129 0.0597 15.38 0.129 0.0602 16.76 22.7304 0.9991 1497768 Maybridge4_001405 Fc1ccc(NC(=O)Nc2cc3ccccc3s2)c(F)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 P20 compound treatment 0.111 0.0418 10.75 0.108 0.0392 10.91 15.3179 1.0 1490941 Maybridge4_001406 Cc1nnsc1C(=O)NCc2c(Cl)cccc2Sc3ccc(Cl)cc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 P21 compound treatment 0.085 0.0158 4.06 0.081 0.0122 3.39 5.2674 0.9961 1271550 Maybridge4_001407 OC(CNCc1ccc2OCOc2c1)COc3ccc(cc3)c4csnn4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 P22 compound treatment 0.077 0.00775 2.0 0.072 0.00319 0.89 2.0387 0.9335 3063624 Maybridge4_001408 CC1(C)CCc2cc(CN3CCN(CC3)c4ncc(cc4Cl)C(F)(F)F)ccc2O1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 P23 mock treatment 0.073 0.00375 0.97 0.069 1.88E-4 0.05 0.7196 0.7443 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2052 P24 positive control 0.077 0.00775 2.0 0.077 0.00819 2.28 3.0233 0.9978 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 A01 compound treatment 0.077 0.00719 1.85 0.086 0.0137 3.81 4.004 0.9449 1291502 Maybridge4_001409 Fc1ccc(cc1)c2n[nH]cc2CN3CCN(Cc4ccccc4)CC3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 A02 compound treatment 0.085 0.0152 3.91 0.092 0.0197 5.48 6.642 0.9863 1286225 Maybridge4_001410 O=C(NC1CCN(CC1)C(=O)OCc2ccccc2)Nc3ccccc3N4CCOCC4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 A03 compound treatment 0.165 0.0952 24.51 0.184 0.112 31.1 39.3238 0.993 1251898 Maybridge4_001411 Cc1cc(C)c(SCC(=O)NCc2ccc3OCOc3c2)c(C)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 A04 compound treatment 0.076 0.00619 1.59 0.079 0.00669 1.86 2.4434 0.997 1262294 Maybridge4_001412 CCCCN1Cc2c([nH]c3cc(nn3c2=O)C(C)(C)C)C1=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 A05 compound treatment 0.074 0.00419 1.08 0.078 0.00569 1.58 1.8824 0.9824 1594634 Maybridge4_001413 OC(=O)CCCC(=O)NC1CCCc2ccccc12 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 A06 compound treatment 0.088 0.0182 4.68 0.09 0.0177 4.93 6.7943 0.9997 3178643 Maybridge4_001414 COc1cc2CCN(Cc3sc4ccccc4c3C)C(C)c2cc1OC 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 A07 compound treatment 0.076 0.00619 1.59 0.076 0.00369 1.03 1.8526 0.9774 1319283 Maybridge4_001415 OC(CNC(=O)Nc1ccccc1)c2ccccc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 A08 compound treatment 0.073 0.00319 0.82 0.077 0.00469 1.31 1.5034 0.975 1715585 Maybridge4_001416 Cc1cccc(NC(=O)c2ccco2)n1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 A09 compound treatment 0.073 0.00319 0.82 0.077 0.00469 1.31 1.5034 0.975 1554836 Maybridge4_001417 CCCc1cnc(nc1)N2CCN(CC2)S(=O)(=O)C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 A10 compound treatment 0.095 0.0252 6.49 0.101 0.0287 7.99 10.2349 0.9946 3178644 Maybridge4_001418 O=S(=O)(Nc1ccccc1N2CCOCC2)c3ccc(s3)c4ccccn4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 A11 compound treatment 0.088 0.0182 4.68 0.093 0.0207 5.76 7.3851 0.9947 3178645 Maybridge4_001419 Cc1ccc(cc1)n2nc(cc2c3cccs3)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 A12 compound treatment 0.068 -0.00181 -0.47 0.068 -0.00431 -1.2 -1.1792 -0.9152 3063626 Maybridge4_001420 Oc1nnc(S)n1C2CC2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 A13 compound treatment 0.079 0.00919 2.37 0.077 0.00469 1.31 2.5957 0.9607 3178646 Maybridge4_001421 CN(C(=O)c1c(C)onc1c2c(Cl)cccc2Cl)c3nnc(s3)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 A14 compound treatment 0.129 0.0592 15.24 0.142 0.0697 19.41 24.4988 0.9928 3063627 Maybridge4_001422 N#Cc1sc2nc3ccccc3n2c1/N=C/N4CCOCC4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 A15 compound treatment 0.104 0.0342 8.8 0.105 0.0327 9.1 12.6611 0.9999 3178647 Maybridge4_001423 FC(F)(F)c1ccnc(n1)N2CCC(CC2)C(=O)Oc3ccccc3N4CCCCC4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 A16 compound treatment 0.116 0.0462 11.89 0.109 0.0367 10.22 15.6335 0.9971 1004868 Maybridge4_001424 Sc1ncnc2n(ncc12)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 A17 compound treatment 0.077 0.00719 1.85 0.078 0.00569 1.58 2.4286 0.997 1225276 Maybridge4_001425 COc1ccc(NC(=O)CC2N(CCNC2=O)C(=O)c3ccc(cc3)C(C)(C)C)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 A18 compound treatment 0.11 0.0402 10.35 0.114 0.0417 11.61 15.5258 0.9984 1212340 Maybridge4_001426 COc1ccc(cc1)C(=O)Nc2ccc(nc2)N3CCN(CC3)C(=O)OC(C)(C)C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 A19 compound treatment 0.158 0.0882 22.71 0.164 0.0917 25.53 34.1108 0.9983 1490823 Maybridge4_001427 Fc1ccc(cc1)c2cn3cccc(OCc4ccc(Cl)c(Cl)c4)c3n2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 A20 compound treatment 0.153 0.0832 21.42 0.151 0.0787 21.91 30.6405 0.9999 1164040 Maybridge4_001428 Oc1ccccc1C(=O)Nc2ccc(NC(=O)Nc3ccccc3)cc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 A21 compound treatment 0.146 0.0762 19.62 0.153 0.0807 22.47 29.76 0.9977 1589639 Maybridge4_001429 O=C(Nc1ccc(OCc2ccccc2)cc1)N3CCN(CC3)c4ccccn4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 A22 compound treatment 0.074 0.00419 1.08 0.076 0.00369 1.03 1.4885 0.9997 1548910 Maybridge4_001430 CCOC(=O)Cc1csc(NS(=O)(=O)c2cn(C)cn2)n1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 A23 mock treatment 0.072 0.00219 0.56 0.077 0.00469 1.31 1.3213 0.9294 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 A24 positive control 0.076 0.00619 1.59 0.079 0.00669 1.86 2.4434 0.997 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 B01 compound treatment 0.079 0.00919 2.37 0.085 0.0127 3.53 4.1711 0.981 3178648 Maybridge4_001431 Clc1ccc2c(Oc3ccc(NS(=O)(=O)c4ccc(s4)c5ccccn5)cn3)ncnc2c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 B02 compound treatment 0.297 0.227 58.49 0.371 0.299 83.18 100.1805 0.9852 3178649 Maybridge4_001432 O=C(c1sc(Nc2ccc3OCCOc3c2)nc1c4ccccc4)c5ccccc5 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 B03 compound treatment 0.152 0.0822 21.16 0.17 0.0977 27.21 34.2 0.9923 1669153 Maybridge4_001433 CCc1ccc(cc1)C(=O)Nc2ccc(cc2)S(=O)(=O)N 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 B04 compound treatment 0.073 0.00319 0.82 0.075 0.00269 0.75 1.1095 0.9989 3178650 Maybridge4_001434 O=C(NCc1ccsc1)c2ccc3OCCCOc3c2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 B05 compound treatment 0.118 0.0482 12.41 0.117 0.0447 12.45 17.573 1.0 3063628 Maybridge4_001435 CCc1c(nnc2cc(C)nn12)C(=O)OC 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 B06 compound treatment 0.072 0.00219 0.56 0.076 0.00369 1.03 1.1244 0.96 1347207 Maybridge4_001436 COc1ccc(Cn2cnc3n(C)c(=O)n(C)c(=O)c23)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 B07 compound treatment 0.124 0.0542 13.95 0.136 0.0637 17.74 22.407 0.9929 1134750 Maybridge4_001437 CC(=O)Nc1ccc(NC(=O)Nc2ccccc2)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 B08 compound treatment 0.084 0.0142 3.65 0.086 0.0137 3.81 5.2784 0.9998 1513237 Maybridge4_001438 CSc1c2CCCCc2c(C#N)c3nc4ccccc4n13 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 B09 compound treatment 0.115 0.0452 11.63 0.114 0.0417 11.61 16.4361 1.0 3178651 Maybridge4_001439 Fc1ccc(cc1)S(=O)(=O)CCSc2nnc(OC(=O)c3cccs3)n2C4CC4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 B10 compound treatment 0.075 0.00519 1.34 0.079 0.00669 1.86 2.2614 0.9867 3063629 Maybridge4_001440 N#Cc1c(/N=C/N2CCCCC2)nc3CCCCc3c1c4ccccc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 B11 compound treatment 0.146 0.0762 19.62 0.149 0.0767 21.36 28.9723 0.9991 3178652 Maybridge4_001441 COC(=O)c1sccc1S(=O)(=O)N2CCN(CC2)C3c4ccccc4-c5ccccc35 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 B12 compound treatment 0.093 0.0232 5.97 0.101 0.0287 7.99 9.8708 0.9897 3063630 Maybridge4_001442 O=C(CN1C(=O)c2ccccc2S1(=O)=O)c3ccc4OCCCOc4c3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 B13 compound treatment 0.081 0.0112 2.88 0.082 0.00969 2.7 3.9445 0.9995 1504288 Maybridge4_001443 COc1ccc(cc1)C(=O)Nc2ccc3[nH]ccc3c2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 B14 compound treatment 0.069 -8.12E-4 -0.21 0.072 -3.13E-4 -0.09 -0.2095 -0.9245 1589222 Maybridge4_001444 OC(=O)CCC(=O)NCC1COc2ccccc2O1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 B15 compound treatment 0.079 0.00919 2.37 0.081 0.00869 2.42 3.3834 0.9999 1127725 Maybridge4_001445 CCOC(=O)c1nn(c2ccccc2)c3nc(Nc4ccc(C)cc4)cc(=O)n13 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 B16 compound treatment 0.134 0.0642 16.53 0.146 0.0737 20.52 26.1968 0.9942 1720808 Maybridge4_001446 O=C(CSc1ccccc1)N2c3ccccc3Sc4ccccc24 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 B17 compound treatment 0.139 0.0692 17.81 0.137 0.0647 18.02 25.3348 1.0 1598554 Maybridge4_001447 COc1ccc(cc1)C(=O)c2c(NC(=O)C)sc3CN(CCc23)C(=O)OC(C)(C)C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 B18 compound treatment 0.073 0.00319 0.82 0.078 0.00569 1.58 1.7003 0.9531 3063652 Maybridge4_001448 C/C(=N\O)/C(C)(C)Nc1cc(cc(c1)C(F)(F)F)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 B19 compound treatment 0.137 0.0672 17.3 0.151 0.0787 21.91 27.7276 0.9931 3063653 Maybridge4_001449 Oc1nnc(SCC(=O)c2ccc(cc2)N3CCOCC3)n1C4CC4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 B20 compound treatment 0.13 0.0602 15.5 0.127 0.0547 15.23 21.727 1.0 3063654 Maybridge4_001450 FC(F)(F)c1cc(cc(c1)C(F)(F)F)c2ccc(COC(=O)Nc3ccccc3)o2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 B21 compound treatment 0.075 0.00519 1.34 0.079 0.00669 1.86 2.2614 0.9867 3063655 Maybridge4_001451 Cc1cc2c(NC(=O)COCC(=O)O)cccc2nn1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 B22 compound treatment 0.069 -8.12E-4 -0.21 0.073 6.87E-4 0.19 -0.0125 -0.0442 3178653 Maybridge4_001452 CCOC(=O)N1CCC(CC1)NC(=O)c2snnc2C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 B23 mock treatment 0.071 0.00119 0.31 0.073 6.87E-4 0.19 0.3516 0.9746 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 B24 positive control 0.074 0.00419 1.08 0.077 0.00469 1.31 1.6855 0.9955 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 C01 compound treatment 0.103 0.0332 8.54 0.108 0.0357 9.94 13.0698 0.9972 3178654 Maybridge4_001453 COc1ccc(cc1)n2ccc(nc2=S)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 C02 compound treatment 0.072 0.00219 0.56 0.075 0.00269 0.75 0.9275 0.9902 1547772 Maybridge4_001454 Cc1c(cnn1c2ccc(F)cc2)C(=O)NC3CCN(Cc4ccccc4)CC3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 C03 compound treatment 0.08 0.0102 2.62 0.085 0.0127 3.53 4.3532 0.9892 1661624 Maybridge4_001455 Cc1ccc(cc1)C(=O)Nc2ccc3ccccc3n2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 C04 compound treatment 0.191 0.121 31.2 0.196 0.124 34.45 46.4204 0.9988 1628233 Maybridge4_001456 CCCCN1Cc2c(C1=O)n(CC(=O)c3ccc(OC)cc3)c4cc(nn4c2=O)c5ccccc5 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 C05 compound treatment 0.074 0.00419 1.08 0.077 0.00469 1.31 1.6855 0.9955 1204335 Maybridge4_001457 O=C1N(CNc2ccccc2)C(=O)C3=C1CCCC3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 C06 compound treatment 0.08 0.0102 2.62 0.084 0.0117 3.25 4.1563 0.9943 3178655 Maybridge4_001458 COc1ccccc1C2CCN(Cc3sc4ccccc4c3C)CC2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 C07 compound treatment 0.083 0.0132 3.4 0.083 0.0107 2.98 4.5055 0.9978 1326929 Maybridge4_001459 Cc1ccc(cc1C)C(=O)Nc2ccc(CN3CCS(=O)(=O)CC3)cc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 C08 compound treatment 0.073 0.00319 0.82 0.073 6.87E-4 0.19 0.7157 0.8493 1479015 Maybridge4_001460 O=C(Nc1ccccc1N2CCOCC2)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 C09 compound treatment 0.09 0.0202 5.2 0.091 0.0187 5.2 7.3553 1.0 1487787 Maybridge4_001461 CCCc1cnc(nc1)N2CCN(CC2)S(=O)(=O)c3cccs3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 C10 compound treatment 0.075 0.00519 1.34 0.08 0.00769 2.14 2.4583 0.9742 3063656 Maybridge4_001462 Cn1cc(c(n1)C(F)(F)F)S(=O)(=O)Nc2ccccc2N3CCOCC3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 C11 compound treatment 0.092 0.0222 5.71 0.101 0.0287 7.99 9.6887 0.9865 3178656 Maybridge4_001463 COc1ccc(cc1)n2nc(cc2c3cccs3)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 C12 compound treatment 0.235 0.165 42.53 0.228 0.156 43.36 60.7326 1.0 3063657 Maybridge4_001464 C(/N=C/1\S/C(=N/c2ccccc2)/C/3=C1/CCCC3)c4ccccc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 C13 compound treatment 0.072 0.00219 0.56 0.073 6.87E-4 0.19 0.5336 0.8971 1606533 Maybridge4_001465 OC(=O)CC(CC(=O)Nc1ccc(Oc2ccccc2)cc1)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 C14 compound treatment 0.137 0.0672 17.3 0.149 0.0767 21.36 27.3337 0.9945 3178742 Maybridge4_001466 Clc1ccc(/C=N/n2cnc3n(ncc3c2=N)c4ccccc4)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 C15 compound treatment 0.085 0.0152 3.91 0.087 0.0147 4.09 5.6573 0.9997 1551950 Maybridge4_001467 CCOC(=O)c1cn(nc1N)C(=O)CCSc2ccc(OC)cc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 C16 compound treatment 0.183 0.113 29.14 0.178 0.106 29.43 41.4193 1.0 1274385 Maybridge4_001468 CCOC(=O)C1=C(N)Oc2c(C1c3ccccc3)c(=O)oc4ccccc24 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 C17 compound treatment 0.072 0.00219 0.56 0.075 0.00269 0.75 0.9275 0.9902 1585094 Maybridge4_001469 O=S(=O)(N(CCC#N)Cc1ccccc1)c2ccccc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 C18 compound treatment 0.129 0.0592 15.24 0.128 0.0557 15.51 21.7419 1.0 1144333 Maybridge4_001470 CC(C)(C)OC(=O)N1CCN(CC1)c2ccc(NS(=O)(=O)c3ccc(Cl)cc3)cn2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 C19 compound treatment 0.067 -0.00281 -0.72 0.071 -0.00131 -0.37 -0.7705 -0.9499 1395168 Maybridge4_001471 OC(=O)c1ccccc1C(=O)NC2CCCCNC2=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 C20 compound treatment 0.096 0.0262 6.74 0.1 0.0277 7.71 10.22 0.9978 3178743 Maybridge4_001472 Oc1nnc(SCC(=O)c2ccc3OCCOc3c2)n1c4ccccc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 C21 compound treatment 0.153 0.0832 21.42 0.152 0.0797 22.19 30.8375 0.9998 1500505 Maybridge4_001473 CCOC(=O)c1cc(C)nc(N2CCC(CC2)C(=O)N)c1C#N 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 C22 compound treatment 0.102 0.0322 8.29 0.1 0.0277 7.71 11.3124 0.9994 3178744 Maybridge4_001474 CCOC(=O)c1cnn(C(=O)c2snnc2C)c1N 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 C23 mock treatment 0.069 -8.12E-4 -0.21 0.072 -3.13E-4 -0.09 -0.2095 -0.9245 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 C24 positive control 0.078 0.00819 2.11 0.079 0.00669 1.86 2.8075 0.9981 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 D01 compound treatment 0.078 0.00819 2.11 0.082 0.00969 2.7 3.3983 0.9926 1160532 Maybridge4_001475 Clc1ccc2c(Oc3ccc(NC(=O)Nc4ccccc4)cn3)ncnc2c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 D02 compound treatment 0.078 0.00819 2.11 0.081 0.00869 2.42 3.2014 0.9976 3063658 Maybridge4_001476 Oc1ccc(cc1O)C(=O)CN2C(=O)c3ccccc3S2(=O)=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 D03 compound treatment 0.128 0.0582 14.98 0.139 0.0667 18.57 23.726 0.9943 1237081 Maybridge4_001477 CN(C1CCCCC1)S(=O)(=O)c2ccc3ccccc3c2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 D04 compound treatment 0.129 0.0592 15.24 0.132 0.0597 16.62 22.5295 0.9991 3063659 Maybridge4_001478 OC(CN1CCN(CC1)C2c3ccccc3-c4ccccc24)c5ccccc5 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 D05 compound treatment 0.158 0.0882 22.71 0.16 0.0877 24.42 33.3231 0.9993 1413068 Maybridge4_001479 COC(=O)c1nn(c2ccccc2)c(=O)c3c(N)sc(C)c13 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 D06 compound treatment 0.09 0.0202 5.2 0.094 0.0217 6.04 7.9461 0.9972 3178745 Maybridge4_001480 C(On1nnc2ccccc12)c3ccccc3COn4nnc5ccccc45 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 D07 compound treatment 0.077 0.00719 1.85 0.078 0.00569 1.58 2.4286 0.997 3063660 Maybridge4_001481 CCN(C(=O)c1ccc2OCCc2c1)c3cccc4ccccc34 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 D08 compound treatment 0.104 0.0342 8.8 0.104 0.0317 8.82 12.4642 1.0 1525376 Maybridge4_001482 CC(=O)N(C(=O)C)c1cc(C)c(C#N)c2nc3ccccc3n12 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 D09 compound treatment 0.114 0.0442 11.38 0.123 0.0507 14.12 18.0263 0.9943 3063661 Maybridge4_001483 Cc1nnsc1c2nnc(SCC(=O)c3ccc(C)cc3)n2C4CC4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 D10 compound treatment 0.13 0.0602 15.5 0.137 0.0647 18.02 23.6962 0.9972 1489082 Maybridge4_001484 Cn1c2ccccc2n3c(=O)cc(c(C#N)c13)c4ccccc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 D11 compound treatment 0.072 0.00219 0.56 0.076 0.00369 1.03 1.1244 0.96 1735545 Maybridge4_001485 CN(CCc1ccccn1)C(=O)Nc2ccccc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 D12 compound treatment 0.106 0.0362 9.32 0.106 0.0337 9.38 13.2222 1.0 3178746 Maybridge4_001486 Oc1ccccc1C(=O)NC(=O)c2ccccc2Cl 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 D13 compound treatment 0.141 0.0712 18.33 0.139 0.0667 18.57 26.0927 1.0 3178747 Maybridge4_001487 C1CCC(CC1)/N=C/2\S/C(=N\c3ccccc3)/C/4=C2/CCCC4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 D14 compound treatment 0.068 -0.00181 -0.47 0.075 0.00269 0.75 0.1993 0.2259 3063662 Maybridge4_001488 OC(=O)CCCC(=O)N1CCN(CC1)c2ncccn2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 D15 compound treatment 0.228 0.158 40.73 0.219 0.147 40.85 57.6858 1.0 1539797 Maybridge4_001489 CCOC(=O)C1=NN(c2ccccc2)C3(C1c4ccc(C)cc4)C(=O)c5ccccc5C3=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 D16 compound treatment 0.117 0.0472 12.15 0.125 0.0527 14.67 18.9664 0.9956 1582785 Maybridge4_001490 Cc1cc(C)c2c(n1)sc3c(=O)n(CC(=O)c4ccccc4)cnc32 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 D17 compound treatment 0.073 0.00319 0.82 0.076 0.00369 1.03 1.3065 0.9938 3178748 Maybridge4_001491 OC(=O)c1ccc(cc1)c2cn3cccnc3n2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 D18 compound treatment 0.072 0.00219 0.56 0.074 0.00169 0.47 0.7306 0.996 3063663 Maybridge4_001492 C/C(=N\O)/C(C)(C)Nc1ccc(Cl)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 D19 compound treatment 0.273 0.203 52.31 0.305 0.233 64.8 82.814 0.9944 1236138 Maybridge4_001493 Cc1nc(Nc2ccccc2)sc1C(=O)c3cc4ccccc4s3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 D20 compound treatment 0.068 -0.00181 -0.47 0.071 -0.00131 -0.37 -0.5884 -0.9927 3063664 Maybridge4_001494 FC(F)(F)c1ccccc1NS(=O)(=O)c2ccc3OCCc3c2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 D21 compound treatment 0.068 -0.00181 -0.47 0.071 -0.00131 -0.37 -0.5884 -0.9927 3178749 Maybridge4_001495 O=C(NCCN1CCNC1=O)c2ccc3nccnc3c2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 D22 compound treatment 0.241 0.171 44.08 0.238 0.166 46.14 63.7942 0.9997 3178750 Maybridge4_001496 Cc1nc(cs1)c2ccc(s2)S(=O)(=O)N3CCCc4ccccc34 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 D23 mock treatment 0.069 -8.12E-4 -0.21 0.072 -3.13E-4 -0.09 -0.2095 -0.9245 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 D24 positive control 0.079 0.00919 2.37 0.08 0.00769 2.14 3.1865 0.9988 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 E01 compound treatment 0.154 0.0842 21.68 0.174 0.102 28.32 35.3519 0.9913 3063665 Maybridge4_001497 Cc1ccc(cc1)c2ccn(c3ccc(C)c(Cl)c3)c(=S)n2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 E02 compound treatment 0.077 0.00719 1.85 0.083 0.0107 2.98 3.4132 0.9739 1172555 Maybridge4_001498 O=C(Nc1ccc(cc1)c2cn3CCSc3n2)c4ccco4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 E03 compound treatment 0.069 -8.12E-4 -0.21 0.073 6.87E-4 0.19 -0.0125 -0.0442 1326393 Maybridge4_001499 OC(=O)c1ccccc1C(=O)N2CCN(Cc3ccncc3)CC2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 E04 compound treatment 0.07 1.88E-4 0.05 0.073 6.87E-4 0.19 0.1695 0.8585 1616068 Maybridge4_001500 Clc1ccccc1N2CCN(CC2)C3=Cc4ccccc4CC3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 E05 compound treatment 0.071 0.00119 0.31 0.074 0.00169 0.47 0.5485 0.9783 1429251 Maybridge4_001501 O=C(NC1CCCc2ccccc12)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 E06 compound treatment 0.139 0.0692 17.81 0.142 0.0697 19.41 26.3194 0.9991 1274546 Maybridge4_001502 Cc1c(CN2CCc3ccccc3C2)sc4ccccc14 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 E07 compound treatment 0.075 0.00519 1.34 0.079 0.00669 1.86 2.2614 0.9867 1237910 Maybridge4_001503 O=C(Nc1ccc(CN2CCS(=O)(=O)CC2)cc1)c3ccco3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 E08 compound treatment 0.073 0.00319 0.82 0.073 6.87E-4 0.19 0.7157 0.8493 1710600 Maybridge4_001504 Cn1cnc(c1)S(=O)(=O)Nc2ccccc2N3CCOCC3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 E09 compound treatment 0.072 0.00219 0.56 0.073 6.87E-4 0.19 0.5336 0.8971 1424693 Maybridge4_001505 Cc1ccc(NC(=O)N(CCC(=O)O)Cc2ccccc2)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 E10 compound treatment 0.089 0.0192 4.94 0.088 0.0157 4.37 6.5825 0.9981 1251028 Maybridge4_001506 CC(C)(C)c1cn2cccc(OCc3ccc(Cl)c(Cl)c3)c2n1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 E11 compound treatment 0.086 0.0162 4.17 0.098 0.0257 7.15 8.0056 0.9669 1143941 Maybridge4_001507 O=S(=O)(NC1CCCc2ccccc12)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 E12 compound treatment 0.143 0.0732 18.84 0.141 0.0687 19.13 26.8507 1.0 3178751 Maybridge4_001508 Nc1c(cnn1c2ccccc2)c3n[nH]c(=S)n3c4ccc(Cl)cc4Cl 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 E13 compound treatment 0.123 0.0532 13.69 0.125 0.0527 14.67 20.0587 0.9994 3063666 Maybridge4_001509 FC(F)(F)c1ccn(n1)c2ccc(NC(=O)Nc3ccccc3)cc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 E14 compound treatment 0.122 0.0522 13.44 0.134 0.0617 17.18 21.649 0.9926 3178752 Maybridge4_001510 CCOC(=O)COc1nc(cc(c1C#N)c2ccccc2)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 E15 compound treatment 0.071 0.00119 0.31 0.07 -0.00231 -0.64 -0.2392 -0.3355 1607723 Maybridge4_001511 CCOC(=O)c1cnn(C(=O)c2c(C)nc3ccccn23)c1N 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 E16 compound treatment 0.073 0.00319 0.82 0.075 0.00269 0.75 1.1095 0.9989 1572679 Maybridge4_001512 Cc1nn(c2ccccc2)c3[nH]c(=O)c(C#N)c(c4cccs4)c13 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 E17 compound treatment 0.074 0.00419 1.08 0.076 0.00369 1.03 1.4885 0.9997 1609957 Maybridge4_001513 O=S(=O)(N(CCC#N)CCc1ccccn1)c2ccc3OCCc3c2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 E18 compound treatment 0.107 0.0372 9.57 0.107 0.0347 9.66 13.6011 1.0 1377637 Maybridge4_001514 S=C(Nc1ccc2OCCOc2c1)Nc3ccccc3N4CCOCC4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 E19 compound treatment 0.07 1.88E-4 0.05 0.071 -0.00131 -0.37 -0.2243 -0.6084 1175800 Maybridge4_001515 OC(=O)CCC(=O)NC1CCCCNC1=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 E20 compound treatment 0.204 0.134 34.55 0.202 0.13 36.12 49.9687 0.9998 1593716 Maybridge4_001516 CC(c1ccccc1)n2c(O)nnc2SCc3cc(=O)oc4cc(O)ccc34 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 E21 compound treatment 0.068 -0.00181 -0.47 0.071 -0.00131 -0.37 -0.5884 -0.9927 1417192 Maybridge4_001517 CCOC(=O)C1CCN(CC1)C(=O)c2ccc(CC)cc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 E22 compound treatment 0.157 0.0872 22.45 0.162 0.0897 24.98 33.5349 0.9986 3063667 Maybridge4_001518 Cc1nnsc1c2nnc(SCC(=O)N(C3CCCCC3)c4ccccc4)n2C5CC5 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 E23 mock treatment 0.068 -0.00181 -0.47 0.072 -3.13E-4 -0.09 -0.3915 -0.8248 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 E24 positive control 0.081 0.0112 2.88 0.079 0.00669 1.86 3.3537 0.9777 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 F01 compound treatment 0.136 0.0662 17.04 0.148 0.0757 21.08 26.9548 0.9944 1399434 Maybridge4_001519 Cc1ccc(cc1)C(O)COC2=NCNc3cc(Cl)ccc23 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 F02 compound treatment 0.093 0.0232 5.97 0.095 0.0227 6.32 8.6892 0.9996 3063693 Maybridge4_001520 Clc1ccc(c(Cl)c1)S(=O)(=O)CCN2C(=O)c3ccccc3S2(=O)=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 F03 compound treatment 0.07 1.88E-4 0.05 0.076 0.00369 1.03 0.7603 0.7395 1228123 Maybridge4_001521 COC(=O)c1cc(oc1C)S(=O)(=O)N(C)C2CCCCC2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 F04 compound treatment 0.095 0.0252 6.49 0.098 0.0257 7.15 9.6441 0.9988 3063694 Maybridge4_001522 Cc1nc(sc1c2nnc(o2)c3cccc4ccccc34)c5ccccc5 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 F05 compound treatment 0.104 0.0342 8.8 0.106 0.0337 9.38 12.858 0.9995 1500694 Maybridge4_001523 CC(=O)Nc1cc(nn(c2ccccc2)c1=O)C(=O)c3ccc(Cl)cc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 F06 compound treatment 0.076 0.00619 1.59 0.078 0.00569 1.58 2.2465 1.0 3063695 Maybridge4_001524 S=c1[nH]nc(c2ccncc2)n1/N=C/c3cccnc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 F07 compound treatment 0.121 0.0512 13.18 0.125 0.0527 14.67 19.6946 0.9986 1217417 Maybridge4_001525 CCOC(=O)c1cc2cc(OCc3ccccc3)ccc2n1C(=O)c4ccccc4C(=O)O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 F08 compound treatment 0.078 0.00819 2.11 0.08 0.00769 2.14 3.0045 1.0 1688932 Maybridge4_001526 NNC(=O)Cn1nc(c2ccccc2)c(c(C#N)c1=O)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 F09 compound treatment 0.21 0.14 36.09 0.229 0.157 43.64 56.378 0.9956 3178837 Maybridge4_001527 CCc1cc(C(=O)c2ccc(OC)cc2)c(NC(=O)c3ccc(cc3)C(F)(F)F)s1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 F10 compound treatment 0.215 0.145 37.38 0.172 0.0997 27.76 46.0636 0.9893 1686628 Maybridge4_001528 NNC(=O)c1oc2nc(cc(c3ccccc3)c2c1N)c4ccccc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 F11 compound treatment 0.067 -0.00281 -0.72 0.073 6.87E-4 0.19 -0.3767 -0.5029 1119276 Maybridge4_001529 CN(CCc1ccccn1)C(=O)NS(=O)(=O)c2ccc(C)cc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 F12 compound treatment 0.074 0.00419 1.08 0.074 0.00169 0.47 1.0947 0.9307 3063696 Maybridge4_001530 Fc1ccc(cc1)C(=O)CN2C(=O)c3ccccc3C2=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 F13 compound treatment 0.07 1.88E-4 0.05 0.066 -0.00631 -1.76 -1.209 -0.6874 1398696 Maybridge4_001531 Cn1c(SCc2n[nH]c(=S)n2CC=C)nnc1c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 F14 compound treatment 0.067 -0.00281 -0.72 0.075 0.00269 0.75 0.0172 0.0165 3063697 Maybridge4_001532 OC(=O)c1ccccc1C(=O)N2CCN(CC2)c3ncccn3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 F15 compound treatment 0.07 1.88E-4 0.05 0.073 6.87E-4 0.19 0.1695 0.8585 3178838 Maybridge4_001533 Fc1ccc(cc1)C(=O)COc2nnc(SCCS(=O)(=O)c3ccc(F)cc3)n2C4CC4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 F16 compound treatment 0.159 0.0892 22.96 0.168 0.0957 26.65 35.0806 0.9973 3063698 Maybridge4_001534 O=C/1N(Cc2ccccc2)c3ccccc3\C1=N\c4ccccc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 F17 compound treatment 0.296 0.226 58.24 0.315 0.243 67.59 88.9706 0.9973 3178839 Maybridge4_001535 CCOC(=O)C1=NN(C(=C2C(=O)c3ccccc3C2=O)C1c4cccs4)c5ccccc5 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 F18 compound treatment 0.104 0.0342 8.8 0.105 0.0327 9.1 12.6611 0.9999 3063699 Maybridge4_001536 COc1ccc(cc1OC)C(=O)NC(=O)c2ccccc2O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 F19 compound treatment 0.072 0.00219 0.56 0.073 6.87E-4 0.19 0.5336 0.8971 1600649 Maybridge4_001537 O=C(N1CCOCC1)c2ccc3OCCCOc3c2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 F20 compound treatment 0.114 0.0442 11.38 0.125 0.0527 14.67 18.4202 0.9921 3063700 Maybridge4_001538 CCN(c1cccc2ccccc12)S(=O)(=O)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 F21 compound treatment 0.068 -0.00181 -0.47 0.071 -0.00131 -0.37 -0.5884 -0.9927 3178840 Maybridge4_001539 O=C(NCCc1ccccn1)c2ccc3nccnc3c2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 F22 compound treatment 0.068 -0.00181 -0.47 0.071 -0.00131 -0.37 -0.5884 -0.9927 3178841 Maybridge4_001540 CC(C)(C)OC(=O)N1CCCN(CC1)C(=O)c2cccnc2Oc3ccc(Cl)cc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 F23 mock treatment 0.068 -0.00181 -0.47 0.071 -0.00131 -0.37 -0.5884 -0.9927 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 F24 positive control 0.08 0.0102 2.62 0.077 0.00469 1.31 2.7778 0.9481 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 G01 compound treatment 0.141 0.0712 18.33 0.14 0.0677 18.85 26.2897 0.9999 3063701 Maybridge4_001541 COc1ccc(cc1n2ccc(nc2=S)c3ccc(C)cc3)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 G02 compound treatment 0.126 0.0562 14.47 0.126 0.0537 14.95 20.8018 0.9999 1377005 Maybridge4_001542 Cc1ccc(cc1C)C(=O)Nc2ccc(cc2)c3cn4CCSc4n3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 G03 compound treatment 0.134 0.0642 16.53 0.154 0.0817 22.75 27.7722 0.9877 1733649 Maybridge4_001543 CC(C)c1ccc(NC(=O)CSCc2csc3ccccc23)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 G04 compound treatment 0.12 0.0502 12.92 0.128 0.0557 15.51 20.1033 0.9959 1177034 Maybridge4_001544 Cc1ccc(cc1)n2nnnc2c3c[nH]c4cc(Cl)c(F)cc34 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 G05 compound treatment 0.133 0.0632 16.27 0.131 0.0587 16.34 23.0609 1.0 3178842 Maybridge4_001545 Clc1ccc2OCC(=Cc2c1)C(=O)NC3CCCc4ccccc34 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 G06 compound treatment 0.14 0.0702 18.07 0.149 0.0767 21.36 27.8799 0.9965 1406389 Maybridge4_001546 CCCCc1ccc(NC(=O)Nc2ccc(cc2)N3CCCCC3)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 G07 compound treatment 0.077 0.00719 1.85 0.08 0.00769 2.14 2.8224 0.9974 1501125 Maybridge4_001547 Cc1nnsc1C(=O)Nc2ccc(CN3CCS(=O)(=O)CC3)cc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 G08 compound treatment 0.101 0.0312 8.03 0.099 0.0267 7.43 10.9334 0.9993 3063702 Maybridge4_001548 CCN(CC)S(=O)(=O)c1ccc(cc1)c2cc(sc2C(F)(F)F)C(=O)OC 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 G09 compound treatment 0.07 1.88E-4 0.05 0.073 6.87E-4 0.19 0.1695 0.8585 1046775 Maybridge4_001549 O=C1CCN(Cc2ccccc2)C(=O)N1c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 G10 compound treatment 0.071 0.00119 0.31 0.074 0.00169 0.47 0.5485 0.9783 1245508 Maybridge4_001550 Clc1ccc(Cl)c(NC(=O)CC2N(CCNC2=O)C(=O)Nc3ccccc3)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 G11 compound treatment 0.087 0.0172 4.43 0.086 0.0137 3.81 5.8245 0.9972 3063703 Maybridge4_001551 COc1ccc(OCC2CN=C(Nc3ccc(C)cc3)S2)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 G12 compound treatment 0.089 0.0192 4.94 0.091 0.0187 5.2 7.1733 0.9997 3178843 Maybridge4_001552 Clc1ccc(/C=N/n2cnc3n(ncc3c2=O)c4ccccc4)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 G13 compound treatment 0.071 0.00119 0.31 0.07 -0.00231 -0.64 -0.2392 -0.3355 3063704 Maybridge4_001553 CC(C)N(CCC#N)C(=O)Nc1ccccc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 G14 compound treatment 0.272 0.202 52.06 0.267 0.195 54.22 75.1488 0.9998 1165894 Maybridge4_001554 Cn1c(SCC=C)nnc1c2oc3nc(cc(c4ccccc4)c3c2N)c5ccccc5 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 G15 compound treatment 0.073 0.00319 0.82 0.076 0.00369 1.03 1.3065 0.9938 3063705 Maybridge4_001555 Cc1ccc(cc1)C(O)CSc2nnc(c3ccc4ccccc4c3)n2C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 G16 compound treatment 0.071 0.00119 0.31 0.074 0.00169 0.47 0.5485 0.9783 3178844 Maybridge4_001556 CC1CCc2c(C1)sc3ncn(CC=C)c(=O)c23 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 G17 compound treatment 0.141 0.0712 18.33 0.143 0.0707 19.69 26.8804 0.9994 1415511 Maybridge4_001557 CC(C)c1ccc(NC(=O)COc2ncnc3cc(Cl)ccc23)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 G18 compound treatment 0.072 0.00219 0.56 0.073 6.87E-4 0.19 0.5336 0.8971 3063706 Maybridge4_001558 CN(C1CCCCC1)C(=O)c2ccccc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 G19 compound treatment 0.072 0.00219 0.56 0.076 0.00369 1.03 1.1244 0.96 1222950 Maybridge4_001559 COc1ccc(Cc2nnc(SCC3CC3)n2c4ccc(F)cc4)cc1OC 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 G20 compound treatment 0.227 0.157 40.47 0.233 0.161 44.75 60.2607 0.9987 3063707 Maybridge4_001560 Oc1nnc(SCc2cc(=O)oc3cc(O)ccc23)n1Cc4ccco4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 G21 compound treatment 0.1 0.0302 7.77 0.105 0.0327 9.1 11.9329 0.9969 1138850 Maybridge4_001561 CCOC(=O)C1CCN(CC1)C(=O)C2Cc3ccccc3N2C(=O)OCc4ccccc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 G22 compound treatment 0.069 -8.12E-4 -0.21 0.069 -0.00331 -0.92 -0.8002 -0.846 3063708 Maybridge4_001562 O=S(=O)(Nc1ccccc1C#N)c2ccccc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 G23 mock treatment 0.069 -8.12E-4 -0.21 0.071 -0.00131 -0.37 -0.4064 -0.9649 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 G24 positive control 0.084 0.0142 3.65 0.078 0.00569 1.58 3.703 0.93 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 H01 compound treatment 0.072 0.00219 0.56 0.08 0.00769 2.14 1.9121 0.8637 3178845 Maybridge4_001563 Oc1nnc(SCCS(=O)(=O)c2ccc(F)cc2)n1Cc3ccco3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 H02 compound treatment 0.092 0.0222 5.71 0.095 0.0227 6.32 8.5072 0.9987 3063709 Maybridge4_001564 Cc1noc(C)c1c2nc(CN3C(=O)c4ccccc4S3(=O)=O)no2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 H03 compound treatment 0.071 0.00119 0.31 0.075 0.00269 0.75 0.7454 0.922 3178846 Maybridge4_001565 OC(=O)COCC(=O)Nc1ccc(Oc2cccc(c2)C(F)(F)F)nc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 H04 compound treatment 0.069 -8.12E-4 -0.21 0.073 6.87E-4 0.19 -0.0125 -0.0442 1968939 Maybridge4_001566 CC(C)(CC(=O)O)CC(=O)N1CCN(CC1)C2c3ccccc3-c4ccccc24 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 H05 compound treatment 0.179 0.109 28.11 0.179 0.107 29.71 40.888 0.9996 3178847 Maybridge4_001567 COC(=O)C1N(N=C(C=C1C(=O)OC)C(=O)c2ccccc2)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 H06 compound treatment 0.147 0.0772 19.87 0.153 0.0807 22.47 29.942 0.9981 1661945 Maybridge4_001568 Clc1cccc(NC(=O)N2CCCn3c(SCC=C)nnc23)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 H07 compound treatment 0.074 0.00419 1.08 0.08 0.00769 2.14 2.2762 0.9496 3178848 Maybridge4_001569 Oc1nnc(SCC(=O)Nc2ccccc2)n1Cc3ccco3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 H08 compound treatment 0.15 0.0802 20.65 0.182 0.11 30.55 36.199 0.9818 1169532 Maybridge4_001570 NNC(=O)CN1c2ccccc2Sc3ccccc13 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 H09 compound treatment 0.186 0.116 29.91 0.192 0.12 33.33 44.7224 0.9985 3178849 Maybridge4_001571 Clc1cc(Cl)cc(Oc2ccc(o2)C(=O)NC3Cc4ccccc4C3)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 H10 compound treatment 0.183 0.113 29.14 0.193 0.121 33.61 44.3731 0.9975 3063710 Maybridge4_001572 N#Cc1sc2nc3ccccc3n2c1/N=C/c4cccs4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 H11 compound treatment 0.146 0.0762 19.62 0.141 0.0687 19.13 27.3969 0.9999 1394169 Maybridge4_001573 O=C(Nc1ccc(OCc2ccccc2)cc1)N3CCN(CC3)C(=O)C4COc5ccccc5O4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 H12 compound treatment 0.073 0.00319 0.82 0.076 0.00369 1.03 1.3065 0.9938 3063711 Maybridge4_001574 O=C1Nc2ccccc2C1Cc3ccccn3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 H13 compound treatment 0.158 0.0882 22.71 0.147 0.0747 20.8 30.7631 0.999 1163008 Maybridge4_001575 S=C(Nc1ccccc1)C(C#N)c2nc3ccccc3[nH]2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 H14 compound treatment 0.086 0.0162 4.17 0.09 0.0177 4.93 6.4302 0.9965 3063712 Maybridge4_001576 NS(=O)(=O)c1ccc(cc1)N(S(=O)(=O)c2ccccc2)S(=O)(=O)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 H15 compound treatment 0.074 0.00419 1.08 0.08 0.00769 2.14 2.2762 0.9496 3178934 Maybridge4_001577 CC(C)(C)c1ccc(cc1)c2noc(CSc3nnc(O)n3c4cccnc4)n2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 H16 compound treatment 0.143 0.0732 18.84 0.149 0.0767 21.36 28.4261 0.9981 1688554 Maybridge4_001578 CCNc1nc(SCC(=O)OCC)nc2sc3CC(C)CCc3c12 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 H17 compound treatment 0.076 0.00619 1.59 0.079 0.00669 1.86 2.4434 0.997 1408340 Maybridge4_001579 O=C1c2ccccc2-c3c1cnc4c(cnn34)c5ccccc5 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 H18 compound treatment 0.07 1.88E-4 0.05 0.073 6.87E-4 0.19 0.1695 0.8585 3063713 Maybridge4_001580 O=C(NCC1CC1)Nc2ccccc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 H19 compound treatment 0.168 0.0982 25.28 0.172 0.0997 27.76 37.5068 0.9989 1279297 Maybridge4_001581 Cc1ccc(Oc2ncccc2NC(=O)Nc3ccccc3)c4CCCc41 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 H20 compound treatment 0.069 -8.12E-4 -0.21 0.07 -0.00231 -0.64 -0.6033 -0.891 3178935 Maybridge4_001582 Cn1cnc(c1)S(=O)(=O)N(Cc2ccccc2)Cc3ccccc3N4CCC(CC4)C(=O)O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 H21 compound treatment 0.145 0.0752 19.36 0.152 0.0797 22.19 29.381 0.9977 3063714 Maybridge4_001583 CC(c1ccccc1)n2c(O)nnc2SCC(=O)c3csc4ccccc34 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 H22 compound treatment 0.128 0.0582 14.98 0.131 0.0587 16.34 22.1506 0.9991 3178936 Maybridge4_001584 C1C(=Nc2ccccc2N=C1c3ccccc3)c4ccccc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 H23 mock treatment 0.068 -0.00181 -0.47 0.072 -3.13E-4 -0.09 -0.3915 -0.8248 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 H24 positive control 0.081 0.0112 2.88 0.078 0.00569 1.58 3.1568 0.9603 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 I01 compound treatment 0.092 0.0222 5.71 0.099 0.0267 7.43 9.2949 0.9916 3063715 Maybridge4_001585 Fc1ccc(cc1)c2oncc2c3nnnn3c4ccc(Cl)cc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 I02 compound treatment 0.103 0.0332 8.54 0.11 0.0377 10.5 13.4637 0.9948 1145291 Maybridge4_001586 O=C(Nc1ccc(cc1)c2cn3CCSc3n2)c4ccc5nonc5c4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 I03 compound treatment 0.068 -0.00181 -0.47 0.073 6.87E-4 0.19 -0.1946 -0.3858 1583736 Maybridge4_001587 Cc1ccc(cc1)S(=O)(=O)NC(=O)NC2CCCc3ccccc23 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 I04 compound treatment 0.067 -0.00281 -0.72 0.07 -0.00231 -0.64 -0.9674 -0.9983 1281751 Maybridge4_001588 CN(CC(=O)O)c1ncc(c2nnnn2c3ccccc3)c(n1)c4ccccc4Cl 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 I05 compound treatment 0.093 0.0232 5.97 0.098 0.0257 7.15 9.28 0.996 3178937 Maybridge4_001589 Cc1nc(ccc1C(=O)Oc2ccccc2N3CCCCC3)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 I06 compound treatment 0.092 0.0222 5.71 0.095 0.0227 6.32 8.5072 0.9987 1529830 Maybridge4_001590 Clc1cccc(NC(=O)Nc2ccc(cc2)N3CCCCC3)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 I07 compound treatment 0.077 0.00719 1.85 0.08 0.00769 2.14 2.8224 0.9974 1741796 Maybridge4_001591 Cc1cc(no1)C(=O)Nc2ccc(CN3CCS(=O)(=O)CC3)cc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 I08 compound treatment 0.159 0.0892 22.96 0.173 0.101 28.04 36.0652 0.9951 1155868 Maybridge4_001592 CC(C)N(Cc1ccccc1)S(=O)(=O)c2ccc3ccccc3c2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 I09 compound treatment 0.072 0.00219 0.56 0.071 -0.00131 -0.37 0.1398 0.2082 1382929 Maybridge4_001593 COc1ccc(cc1)C(=O)N2CCc3cc(OC)c(OC)cc3C2C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 I10 compound treatment 0.123 0.0532 13.69 0.124 0.0517 14.39 19.8618 0.9997 3178938 Maybridge4_001594 CC(C)(C)c1cc(NC(=O)Nc2ccccc2)no1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 I11 compound treatment 0.067 -0.00281 -0.72 0.07 -0.00231 -0.64 -0.9674 -0.9983 3063716 Maybridge4_001595 Cc1nc(ccc1C(=O)NCC(O)c2ccccc2)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 I12 compound treatment 0.072 0.00219 0.56 0.076 0.00369 1.03 1.1244 0.96 3178939 Maybridge4_001596 Cn1c(CSc2nnc(c3ccccc3)n2CC=C)nnc1SCc4ccc(F)cc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 I13 compound treatment 0.071 0.00119 0.31 0.073 6.87E-4 0.19 0.3516 0.9746 3063717 Maybridge4_001597 CC(C)N1CCC(=O)N(C1=O)c2ccccc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 I14 compound treatment 0.067 -0.00281 -0.72 0.071 -0.00131 -0.37 -0.7705 -0.9499 1303953 Maybridge4_001598 O=c1[nH]cnc2n(c3ccccc3)c(=S)sc12 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 I15 compound treatment 0.07 1.88E-4 0.05 0.073 6.87E-4 0.19 0.1695 0.8585 1733519 Maybridge4_001599 Cc1nc2ccccn2c1c3ccnc(SCC(=O)N(C4CCCCC4)c5ccccc5)n3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 I16 compound treatment 0.108 0.0382 9.83 0.107 0.0347 9.66 13.7832 1.0 1465542 Maybridge4_001600 Cc1ccc(cc1)C(=O)CN(Cc2ccccc2)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 I17 compound treatment 0.072 0.00219 0.56 0.075 0.00269 0.75 0.9275 0.9902 3063736 Maybridge4_001601 OC(=O)CC(CC(=O)Oc1ccccc1N2CCOCC2)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 I18 compound treatment 0.084 0.0142 3.65 0.084 0.0117 3.25 4.8845 0.9983 3063737 Maybridge4_001602 CC(C)N(Cc1ccccc1)C(=O)Nc2ccc(cc2)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 I19 compound treatment 0.071 0.00119 0.31 0.074 0.00169 0.47 0.5485 0.9783 1622159 Maybridge4_001603 COc1ccc(Cc2nnc(SCC(=O)NC(C)C)n2c3ccc(F)cc3)cc1OC 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 I20 compound treatment 0.071 0.00119 0.31 0.071 -0.00131 -0.37 -0.0423 -0.0887 3063738 Maybridge4_001604 Cc1cc(C)c(c(C)c1)n2c(O)nnc2SCCS(=O)(=O)c3ccc(F)cc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 I21 compound treatment 0.068 -0.00181 -0.47 0.07 -0.00231 -0.64 -0.7854 -0.9875 1522253 Maybridge4_001605 CCOC(=O)C1CCN(CC1)C(=O)c2sc(nc2C)c3ccc4OCCc4c3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 I22 compound treatment 0.084 0.0142 3.65 0.087 0.0147 4.09 5.4753 0.9984 3063739 Maybridge4_001606 O=S(=O)(Nc1ccccc1N2CCCCC2)c3cccc4nonc34 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 I23 mock treatment 0.068 -0.00181 -0.47 0.071 -0.00131 -0.37 -0.5884 -0.9927 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 I24 positive control 0.078 0.00819 2.11 0.077 0.00469 1.31 2.4137 0.9735 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 J01 compound treatment 0.111 0.0412 10.6 0.108 0.0357 9.94 14.5263 0.9995 1381618 Maybridge4_001607 CC(C)c1ccc(NC(=O)CSc2nnc(O)n2C(C)c3ccccc3)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 J02 compound treatment 0.08 0.0102 2.62 0.085 0.0127 3.53 4.3532 0.9892 3063740 Maybridge4_001608 Cc1onc(c1CN2C(=O)c3ccccc3S2(=O)=O)c4ccccc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 J03 compound treatment 0.181 0.111 28.63 0.197 0.125 34.72 44.7967 0.9954 1310898 Maybridge4_001609 Clc1cccc(NC(=O)Nc2ccccc2N3CCCCC3)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 J04 compound treatment 0.07 1.88E-4 0.05 0.073 6.87E-4 0.19 0.1695 0.8585 1473794 Maybridge4_001610 Fc1cn(Cc2c(Cl)cccc2Cl)c(=O)[nH]c1=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 J05 compound treatment 0.191 0.121 31.2 0.191 0.119 33.05 45.4358 0.9996 1148553 Maybridge4_001611 CCOC(=O)c1nn(c2ccccc2)c(=O)c3c(N)c(C#N)c(cc13)c4ccco4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 J06 compound treatment 0.195 0.125 32.23 0.207 0.135 37.51 49.3148 0.9971 2101411 Maybridge4_001612 O=C(Oc1c(C#N)sc2n(c3ccccc3)c(=S)n(c4ccccc4)c(=O)c12)c5cccs5 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 J07 compound treatment 0.092 0.0222 5.71 0.097 0.0247 6.88 8.901 0.9958 1624521 Maybridge4_001613 CC(c1ccccc1)n2c(OC(=O)N(C)C)nnc2SCC(=O)c3ccc4OCCOc4c3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 J08 compound treatment 0.083 0.0132 3.4 0.082 0.00969 2.7 4.3086 0.9935 3063741 Maybridge4_001614 CCOC(=O)c1cnn(c1NC(=O)Nc2cccc(Cl)c2)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 J09 compound treatment 0.109 0.0392 10.09 0.111 0.0387 10.77 14.753 0.9995 3063742 Maybridge4_001615 Cc1cc(C)cc(OC(=O)c2ccc(Oc3cc(Cl)cc(Cl)c3)o2)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 J10 compound treatment 0.072 0.00219 0.56 0.075 0.00269 0.75 0.9275 0.9902 1606613 Maybridge4_001616 COc1cc(OC)c2nc(C)c3CN(Cc3c2c1)C(=O)Nc4ccccc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 J11 compound treatment 0.118 0.0482 12.41 0.124 0.0517 14.39 18.9515 0.9973 3178940 Maybridge4_001617 CN(C(=O)c1nn(nc1C)c2ccccc2)c3nnc(s3)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 J12 compound treatment 0.153 0.0832 21.42 0.158 0.0857 23.86 32.019 0.9985 3063743 Maybridge4_001618 Cc1sc(nc1c2ccccc2)c3ccc(cc3)c4csnn4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 J13 compound treatment 0.124 0.0542 13.95 0.124 0.0517 14.39 20.0439 0.9999 3178941 Maybridge4_001619 S=c1[nH]nc(CCCCc2n[nH]c(=S)[nH]2)[nH]1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 J14 compound treatment 0.071 0.00119 0.31 0.076 0.00369 1.03 0.9424 0.8795 3063744 Maybridge4_001620 O=C(Nc1ccccc1N2CCOCC2)C3=NNC(=O)CC3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 J15 compound treatment 0.098 0.0282 7.26 0.097 0.0247 6.88 9.9934 0.9996 3178942 Maybridge4_001621 Cc1c(sc2ccc(Cl)cc12)C(=O)CSc3nnc(O)n3C4CC4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 J16 compound treatment 0.097 0.0272 7.0 0.096 0.0237 6.6 9.6144 0.9996 1671368 Maybridge4_001622 O=C(CSc1nnc(o1)c2ccncc2)N3c4ccccc4Sc5ccccc35 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 J17 compound treatment 0.117 0.0472 12.15 0.121 0.0487 13.56 18.1787 0.9985 3178943 Maybridge4_001623 CC(C)(C)c1cc(N/C=C/C(=O)c2ccc(Cl)cc2)no1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 J18 compound treatment 0.143 0.0732 18.84 0.153 0.0807 22.47 29.2138 0.9962 3178944 Maybridge4_001624 O=C(C1=NOC2(C1c3ccccc3)C(=O)c4ccccc4C2=O)c5ccccc5 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 J19 compound treatment 0.072 0.00219 0.56 0.074 0.00169 0.47 0.7306 0.996 1576744 Maybridge4_001625 Cc1ccc(Oc2ncccc2NC(=O)CC(CC(=O)O)c3ccccc3)c4CCCc41 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 J20 compound treatment 0.07 1.88E-4 0.05 0.074 0.00169 0.47 0.3664 0.7757 1506454 Maybridge4_001626 CCOC(=O)N1CCC(CC1)NS(=O)(=O)c2cccs2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 J21 compound treatment 0.098 0.0282 7.26 0.099 0.0267 7.43 10.3872 0.9999 3178945 Maybridge4_001627 Cc1cc(C)c(c(C)c1)n2c(O)nnc2SCC(=O)c3ccc(C#N)cc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 J22 compound treatment 0.067 -0.00281 -0.72 0.069 -0.00331 -0.92 -1.1644 -0.9928 3063745 Maybridge4_001628 OC(=O)CSCC(=O)Nc1n[nH]c(SCc2ccc(Cl)cc2)n1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 J23 mock treatment 0.069 -8.12E-4 -0.21 0.072 -3.13E-4 -0.09 -0.2095 -0.9245 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 J24 positive control 0.076 0.00619 1.59 0.08 0.00769 2.14 2.6403 0.9894 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 K01 compound treatment 0.074 0.00419 1.08 0.079 0.00669 1.86 2.0793 0.9662 3178946 Maybridge4_001629 Cc1ccccc1c2oncc2c3nnnn3c4ccccc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 K02 compound treatment 0.106 0.0362 9.32 0.116 0.0437 12.17 15.1914 0.9913 1125361 Maybridge4_001630 COC(=O)c1sccc1S(=O)(=O)Nc2ccc(cc2)c3cn4CCSc4n3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 K03 compound treatment 0.151 0.0812 20.9 0.152 0.0797 22.19 30.4733 0.9996 1429606 Maybridge4_001631 CC(C)(C)c1ccc(NC(=O)NC2CCCc3ccccc23)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 K04 compound treatment 0.087 0.0172 4.43 0.094 0.0217 6.04 7.3999 0.9883 1237562 Maybridge4_001632 CCOC(=O)C1CCCN(C1)C(=O)S(=O)(=O)c2ccc(s2)c3ccccn3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 K05 compound treatment 0.071 0.00119 0.31 0.077 0.00469 1.31 1.1393 0.8497 3063746 Maybridge4_001633 Cc1ccc(cc1)S(=O)(=O)NC(=O)Oc2ccccc2N3CCOCC3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 K06 compound treatment 0.078 0.00819 2.11 0.081 0.00869 2.42 3.2014 0.9976 1225155 Maybridge4_001634 O=S(=O)(Nc1ccc(cc1)N2CCCCC2)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 K07 compound treatment 0.068 -0.00181 -0.47 0.073 6.87E-4 0.19 -0.1946 -0.3858 1255708 Maybridge4_001635 Nc1ccccc1C(=O)NCCN2CCNC2=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 K08 compound treatment 0.096 0.0262 6.74 0.094 0.0217 6.04 9.0385 0.9985 1132174 Maybridge4_001636 CC(C)N(Cc1ccccc1)S(=O)(=O)c2ccc3OCCc3c2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 K09 compound treatment 0.098 0.0282 7.26 0.095 0.0227 6.32 9.5995 0.9976 1685251 Maybridge4_001637 COc1cc2CCN(C(C)c2cc1OC)C(=O)c3nn(nc3C)c4ccccc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 K10 compound treatment 0.072 0.00219 0.56 0.074 0.00169 0.47 0.7306 0.996 1481631 Maybridge4_001638 COc1ccc(cc1)C(=O)Nc2ccc(Oc3ncnc4cc(Cl)ccc34)nc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 K11 compound treatment 0.068 -0.00181 -0.47 0.071 -0.00131 -0.37 -0.5884 -0.9927 1418693 Maybridge4_001639 OC(CNS(=O)(=O)c1ccccc1)c2ccccc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 K12 compound treatment 0.11 0.0402 10.35 0.112 0.0397 11.05 15.1319 0.9995 3179042 Maybridge4_001640 Clc1ccc(cc1)C(=O)CSc2nnc(CSc3nnc(c4ccccc4)n3CC=C)o2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 K13 compound treatment 0.069 -8.12E-4 -0.21 0.074 0.00169 0.47 0.1844 0.3584 1429598 Maybridge4_001641 C(N1CCN(CC1)c2ccccn2)c3c[nH]c(n3)c4ccccc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 K14 compound treatment 0.069 -8.12E-4 -0.21 0.074 0.00169 0.47 0.1844 0.3584 1175807 Maybridge4_001642 C1Cc2nc3ncnn3c(N4CCN(CC4)c5ccccc5)c2C1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 K15 compound treatment 0.126 0.0562 14.47 0.13 0.0577 16.07 21.5895 0.9986 1227234 Maybridge4_001643 CCOC(=O)c1cc(=O)c2ccc(OCC(=O)Nc3ccccc3)cc2o1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 K16 compound treatment 0.07 1.88E-4 0.05 0.075 0.00269 0.75 0.5634 0.7512 3179043 Maybridge4_001644 Cc1onc(NC(=O)CSCC(=O)O)c1Br 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 K17 compound treatment 0.07 1.88E-4 0.05 0.073 6.87E-4 0.19 0.1695 0.8585 1228665 Maybridge4_001645 O=C(Oc1ccccc1N2CCOCC2)c3ccco3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 K18 compound treatment 0.091 0.0212 5.46 0.095 0.0227 6.32 8.3251 0.9973 3179044 Maybridge4_001646 CN(C1CCCCC1)C(=O)Nc2ccccc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 K19 compound treatment 0.072 0.00219 0.56 0.076 0.00369 1.03 1.1244 0.96 3179045 Maybridge4_001647 COc1ccc(Cc2nnc(SCC(=O)C(C)(C)C)n2c3ccc(F)cc3)cc1OC 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 K20 compound treatment 0.07 1.88E-4 0.05 0.073 6.87E-4 0.19 0.1695 0.8585 3063747 Maybridge4_001648 COc1cccc(NC(=O)NCCN2CCN=C2C)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 K21 compound treatment 0.067 -0.00281 -0.72 0.071 -0.00131 -0.37 -0.7705 -0.9499 1463967 Maybridge4_001649 Cc1ccc(cc1)C(=O)NC2CCCCNC2=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 K22 compound treatment 0.11 0.0402 10.35 0.114 0.0417 11.61 15.5258 0.9984 1183986 Maybridge4_001650 O=C(Nc1cccs1)Nc2nnc(s2)C3CC3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 K23 mock treatment 0.071 0.00119 0.31 0.072 -3.13E-4 -0.09 0.1547 0.4865 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 K24 positive control 0.077 0.00719 1.85 0.081 0.00869 2.42 3.0193 0.9912 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 L01 compound treatment 0.072 0.00219 0.56 0.082 0.00969 2.7 2.306 0.8367 3179046 Maybridge4_001651 CC(C)c1ccc(NC(=O)CSc2nnc(O)n2C3CC3)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 L02 compound treatment 0.077 0.00719 1.85 0.081 0.00869 2.42 3.0193 0.9912 3063748 Maybridge4_001652 CC(C)(CC(=O)Nc1ccc(F)cc1)Sc2ccc(Cl)cc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 L03 compound treatment 0.085 0.0152 3.91 0.096 0.0237 6.6 7.4297 0.9688 1296513 Maybridge4_001653 Cc1ccccc1NC(=O)Nc2ccccc2N3CCCCC3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 L04 compound treatment 0.071 0.00119 0.31 0.075 0.00269 0.75 0.7454 0.922 3179047 Maybridge4_001654 O=c1[nH]cc(N2CCN(Cc3ccccc3)CC2)c(=O)[nH]1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 L05 compound treatment 0.127 0.0572 14.72 0.13 0.0577 16.07 21.7716 0.9991 1703134 Maybridge4_001655 CC(C)(C)c1ccc(Oc2ccc(NC(=O)c3ccccc3)cn2)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 L06 compound treatment 0.08 0.0102 2.62 0.081 0.00869 2.42 3.5655 0.9992 3179048 Maybridge4_001656 Cc1nc2n(CC=C)c(=S)sc2c(=O)n1/N=C/c3ccc(Cl)cc3Cl 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 L07 compound treatment 0.104 0.0342 8.8 0.116 0.0437 12.17 14.8273 0.9874 3063749 Maybridge4_001657 CN(C)C(=O)Oc1nnc(SCC(=O)c2ccc3OCCOc3c2)n1C4Cc5ccccc5C4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 L08 compound treatment 0.124 0.0542 13.95 0.12 0.0477 13.28 19.2562 0.9997 1284108 Maybridge4_001658 C1CCc2c(C1)sc3ncnc(Oc4ccccc4)c23 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 L09 compound treatment 0.132 0.0622 16.01 0.13 0.0577 16.07 22.6819 1.0 1451783 Maybridge4_001659 Cc1ccc2cc(OC(=O)c3ccc(Oc4cc(Cl)cc(Cl)c4)o3)ccc2n1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 L10 compound treatment 0.087 0.0172 4.43 0.091 0.0187 5.2 6.8092 0.9967 3063750 Maybridge4_001660 C=CCNC(=S)Nc1sc2CCCCc2c1C#N 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 L11 compound treatment 0.069 -8.12E-4 -0.21 0.072 -3.13E-4 -0.09 -0.2095 -0.9245 1501773 Maybridge4_001661 CC(C)N(Cc1ccccc1)C(=O)Nc2c(C)onc2c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 L12 compound treatment 0.097 0.0272 7.0 0.103 0.0307 8.55 10.9929 0.9951 3063751 Maybridge4_001662 Clc1ccc(cc1)C2CCC(CC2)C(=O)NCc3cccnc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 L13 compound treatment 0.069 -8.12E-4 -0.21 0.075 0.00269 0.75 0.3813 0.4907 3179049 Maybridge4_001663 Cc1nc2n(CC=C)c(=S)sc2c(=O)[nH]1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 L14 compound treatment 0.067 -0.00281 -0.72 0.071 -0.00131 -0.37 -0.7705 -0.9499 3063752 Maybridge4_001664 COC(=O)c1cccc(NC(=O)C2=NNC(=O)CC2)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 L15 compound treatment 0.068 -0.00181 -0.47 0.071 -0.00131 -0.37 -0.5884 -0.9927 1342676 Maybridge4_001665 Cc1noc(C)c1c2nc(CSc3nnc(O)n3C4CC4)no2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 L16 compound treatment 0.164 0.0942 24.25 0.166 0.0937 26.09 35.597 0.9993 3179050 Maybridge4_001666 FC(F)(F)c1ccnc(SCn2c(=S)sc3ccccc23)n1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 L17 compound treatment 0.11 0.0402 10.35 0.116 0.0437 12.17 15.9196 0.9967 3063753 Maybridge4_001667 Cc1ccnc(SCn2c(=S)sc3ccccc23)n1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 L18 compound treatment 0.088 0.0182 4.68 0.094 0.0217 6.04 7.582 0.9921 3179051 Maybridge4_001668 CCOC(=O)C1=NN(C(=C2C(=O)c3ccccc3C2=O)S1)c4ccccc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 L19 compound treatment 0.162 0.0922 23.74 0.179 0.107 29.71 37.793 0.9938 3063754 Maybridge4_001669 Cc1ccc(Oc2ncccc2NC(=O)c3ccc4OCCCOc4c3)c5CCCc51 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 L20 compound treatment 0.07 1.88E-4 0.05 0.072 -3.13E-4 -0.09 -0.0274 -0.2753 3179052 Maybridge4_001670 CCOC(=O)N1CCC(CC1)NS(=O)(=O)c2ccc(C)c(Cl)c2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 L21 compound treatment 0.071 0.00119 0.31 0.074 0.00169 0.47 0.5485 0.9783 3179053 Maybridge4_001671 Cc1cc(C)c(c(C)c1)n2c(O)nnc2SCC(=O)Nc3ccccc3Cl 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 L22 compound treatment 0.09 0.0202 5.2 0.09 0.0177 4.93 7.1584 0.9996 3063755 Maybridge4_001672 Fc1ccc(cc1)S(=O)(=O)Nc2n[nH]c(SCc3ccc(Cl)cc3)n2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 L23 mock treatment 0.071 0.00119 0.31 0.072 -3.13E-4 -0.09 0.1547 0.4865 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 L24 positive control 0.076 0.00619 1.59 0.079 0.00669 1.86 2.4434 0.997 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 M01 compound treatment 0.074 0.00419 1.08 0.08 0.00769 2.14 2.2762 0.9496 1161393 Maybridge4_001673 Cc1c(cnc2cc3OCOc3cc12)c4nnnn4c5ccc(F)cc5 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 M02 compound treatment 0.2 0.13 33.52 0.195 0.123 34.17 47.862 1.0 3063756 Maybridge4_001674 Cc1cc(C)c2cc([nH]c2c1)C(=O)N3CCN(CC3)c4ncccc4C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 M03 compound treatment 0.123 0.0532 13.69 0.124 0.0517 14.39 19.8618 0.9997 1702105 Maybridge4_001675 Fc1ccccc1NC(=O)NC2CCCc3ccccc23 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 M04 compound treatment 0.07 1.88E-4 0.05 0.074 0.00169 0.47 0.3664 0.7757 1481828 Maybridge4_001676 OC(=O)c1ccc2nc3ccsc3c(=O)n2c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 M05 compound treatment 0.108 0.0382 9.83 0.104 0.0317 8.82 13.1924 0.9985 3063779 Maybridge4_001677 FC(F)(F)c1ccc(nc1)N2CCN(Cc3c[nH]nc3c4ccccc4)CC2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 M06 compound treatment 0.085 0.0152 3.91 0.087 0.0147 4.09 5.6573 0.9997 3063780 Maybridge4_001678 O=S(=O)(N1CCC2(CC1)OCCO2)c3ccc(s3)c4ccccn4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 M07 compound treatment 0.094 0.0242 6.23 0.1 0.0277 7.71 9.8559 0.9944 3063781 Maybridge4_001679 Cc1c(cnn1c2ccc(F)cc2)C(=O)Nc3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 M08 compound treatment 0.131 0.0612 15.75 0.135 0.0627 17.46 23.4844 0.9987 1213448 Maybridge4_001680 O=C(Nc1csc2ccccc12)Nc3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 M09 compound treatment 0.17 0.1 25.8 0.166 0.0937 26.09 36.6894 1.0 1543617 Maybridge4_001681 COc1cc2CCN(C(C)c2cc1OC)S(=O)(=O)c3ccc(s3)c4ccccn4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 M10 compound treatment 0.122 0.0522 13.44 0.122 0.0497 13.84 19.2859 0.9999 1698439 Maybridge4_001682 Fc1ccc(cc1)C(=O)COc2ncnc3cc(Cl)ccc23 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 M11 compound treatment 0.141 0.0712 18.33 0.147 0.0747 20.8 27.6681 0.998 1129209 Maybridge4_001683 CC(C)(C)c1ccc(NC(=O)Nc2ccc3OCCOc3c2)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 M12 compound treatment 0.08 0.0102 2.62 0.082 0.00969 2.7 3.7624 0.9999 1441238 Maybridge4_001684 CC(=O)N(C(=O)C)n1c(C)nc2c(sc3nnc(c4ccccc4)c(c5ccccc5)c32)c1=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 M13 compound treatment 0.073 0.00319 0.82 0.079 0.00669 1.86 1.8972 0.9322 1158309 Maybridge4_001685 O=C(Nc1ccccc1)Oc2ccccc2N3CCCCC3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 M14 compound treatment 0.075 0.00519 1.34 0.078 0.00569 1.58 2.0644 0.9964 1618806 Maybridge4_001686 C(N(Cc1ccccc1)c2c3CCCc3nc4ncnn24)c5ccccc5 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 M15 compound treatment 0.176 0.106 27.34 0.198 0.126 35.0 44.0833 0.9925 1328356 Maybridge4_001687 Clc1ccc(cc1)C(=O)Nc2ccc3ccccc3n2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 M16 compound treatment 0.189 0.119 30.69 0.194 0.122 33.89 45.6624 0.9988 1356245 Maybridge4_001688 Cc1cc(C)c2cc([nH]c2c1)C(=O)N3CCC(Cc4ccccc4)CC3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 M17 compound treatment 0.161 0.0912 23.48 0.172 0.0997 27.76 36.2324 0.9965 3063782 Maybridge4_001689 Clc1ccc(Sc2ncccc2C(=O)Oc3ccccc3N4CCOCC4)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 M18 compound treatment 0.117 0.0472 12.15 0.124 0.0517 14.39 18.7694 0.9964 1407054 Maybridge4_001690 CN(C1CCCCC1)S(=O)(=O)c2ccc(s2)S(=O)(=O)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 M19 compound treatment 0.099 0.0292 7.51 0.103 0.0307 8.55 11.357 0.9979 1657796 Maybridge4_001691 Cc1ccc(cc1)S(=O)(=O)Nc2ccccc2Oc3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 M20 compound treatment 0.07 1.88E-4 0.05 0.073 6.87E-4 0.19 0.1695 0.8585 3179139 Maybridge4_001692 CC1=NCCN1CCNC(=O)Nc2ccc(cc2)C(C)(C)C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 M21 compound treatment 0.07 1.88E-4 0.05 0.073 6.87E-4 0.19 0.1695 0.8585 1606643 Maybridge4_001693 O=C1N(CCCN2CCOCC2)C(Nc3ccccc13)c4ccccc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 M22 compound treatment 0.067 -0.00281 -0.72 0.071 -0.00131 -0.37 -0.7705 -0.9499 1220768 Maybridge4_001694 OC(=O)COCC(=O)Nc1nnc(s1)C2CC2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 M23 mock treatment 0.072 0.00219 0.56 0.072 -3.13E-4 -0.09 0.3367 0.5908 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 M24 positive control 0.076 0.00619 1.59 0.08 0.00769 2.14 2.6403 0.9894 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 N01 compound treatment 0.105 0.0352 9.06 0.113 0.0407 11.33 14.4186 0.9939 1585891 Maybridge4_001695 CCc1cccc(C)c1NC(=O)N(Cc2ccccc2)C(C)C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 N02 compound treatment 0.11 0.0402 10.35 0.114 0.0417 11.61 15.5258 0.9984 3063783 Maybridge4_001696 CC1CC(=O)Nc2ccccc2N1S(=O)(=O)c3ccc(s3)c4cc(on4)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 N03 compound treatment 0.087 0.0172 4.43 0.093 0.0207 5.76 7.203 0.9915 1262463 Maybridge4_001697 O=C(Nc1cccs1)Nc2ccccc2N3CCCCC3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 N04 compound treatment 0.095 0.0252 6.49 0.098 0.0257 7.15 9.6441 0.9988 3179140 Maybridge4_001698 Fc1cn(CC2CC(=NO2)c3ccccc3)c(=O)n(CC4CC(=NO4)c5ccccc5)c1=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 N05 compound treatment 0.14 0.0702 18.07 0.135 0.0627 17.46 25.123 0.9999 1190724 Maybridge4_001699 CC(C)(C)c1ccc(Oc2ccc(NC(=O)Nc3cccs3)cn2)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 N06 compound treatment 0.147 0.0772 19.87 0.157 0.0847 23.58 30.7297 0.9964 3179141 Maybridge4_001700 COc1cc(/C=N/n2cnc3n(C)c(=S)sc3c2=O)ccc1O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 N07 compound treatment 0.07 1.88E-4 0.05 0.075 0.00269 0.75 0.5634 0.7512 3063784 Maybridge4_001701 CN(C)C(=O)Oc1nnc(SCCS(=O)(=O)c2ccc(F)cc2)n1c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 N08 compound treatment 0.145 0.0752 19.36 0.148 0.0757 21.08 28.5933 0.9991 3179142 Maybridge4_001702 CCOC(=O)c1c(SC)n(c2ccccc2)c(=S)n(c3ccccc3)c1=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 N09 compound treatment 0.105 0.0352 9.06 0.112 0.0397 11.05 14.2216 0.9951 1226040 Maybridge4_001703 CC(=O)N1CCN(CC1)c2ccc(OC(=O)c3ccc(Oc4cc(Cl)cc(Cl)c4)o3)cc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 N10 compound treatment 0.116 0.0462 11.89 0.122 0.0497 13.84 18.1935 0.9972 3063785 Maybridge4_001704 CN(C)/C=N\c1cc(C)c(C#N)c2nc3ccccc3n12 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 N11 compound treatment 0.068 -0.00181 -0.47 0.071 -0.00131 -0.37 -0.5884 -0.9927 1109792 Maybridge4_001705 OC(CN1CCOCC1)c2ccccc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 N12 compound treatment 0.114 0.0442 11.38 0.112 0.0397 11.05 15.8602 0.9999 3179143 Maybridge4_001706 O=C(Cn1cc(nc1SCc2ccccc2)c3ccccc3)c4ccccc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 N13 compound treatment 0.114 0.0442 11.38 0.122 0.0497 13.84 17.8294 0.9953 1537386 Maybridge4_001707 C=CCn1c(Sc2ncnc3n(ncc23)c4ccccc4)nnc1c5ccncc5 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 N14 compound treatment 0.07 1.88E-4 0.05 0.074 0.00169 0.47 0.3664 0.7757 3063786 Maybridge4_001708 Fc1cc(F)cc(NC(=O)C2=NNC(=O)CC2)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 N15 compound treatment 0.067 -0.00281 -0.72 0.072 -3.13E-4 -0.09 -0.5736 -0.7864 1514475 Maybridge4_001709 CN(CCc1ccccn1)C(=O)c2c(C)onc2c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 N16 compound treatment 0.105 0.0352 9.06 0.122 0.0497 13.84 16.1909 0.9789 1207655 Maybridge4_001710 CCOc1ncc(c2nnnn2c3ccc(C)cc3)c(n1)c4cccc(Cl)c4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 N17 compound treatment 0.086 0.0162 4.17 0.094 0.0217 6.04 7.2179 0.9836 3179144 Maybridge4_001711 COc1ccc(cc1)C(=O)CSc2nnc(O)n2Cc3ccco3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 N18 compound treatment 0.099 0.0292 7.51 0.107 0.0347 9.66 12.1447 0.9923 3063787 Maybridge4_001712 CC1CN(CC(C)O1)c2ccc3nnc(c4ccc(cc4)C(F)(F)F)n3n2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 N19 compound treatment 0.103 0.0332 8.54 0.108 0.0357 9.94 13.0698 0.9972 3179145 Maybridge4_001713 FC(F)(F)c1ccc(cc1)C(=O)n2ccc(n2)c3cccs3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 N20 compound treatment 0.071 0.00119 0.31 0.074 0.00169 0.47 0.5485 0.9783 3179146 Maybridge4_001714 CCCc1c(cnn1c2ccccc2)C(=O)NC3CCN(CC3)C(=O)OCC 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 N21 compound treatment 0.13 0.0602 15.5 0.128 0.0557 15.51 21.9239 1.0 3063788 Maybridge4_001715 Cc1cc(C)c(c(C)c1)n2c(O)nnc2SCc3nc4ccccc4s3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 N22 compound treatment 0.069 -8.12E-4 -0.21 0.07 -0.00231 -0.64 -0.6033 -0.891 3179147 Maybridge4_001716 O=C(Nc1ccccc1)N2CCN(CC2)c3ncccn3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 N23 mock treatment 0.071 0.00119 0.31 0.072 -3.13E-4 -0.09 0.1547 0.4865 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 N24 positive control 0.075 0.00519 1.34 0.079 0.00669 1.86 2.2614 0.9867 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 O01 compound treatment 0.072 0.00219 0.56 0.081 0.00869 2.42 2.109 0.849 3063789 Maybridge4_001717 NC(=O)C1CCN(CC(O)(c2ccccc2)c3ccccc3)CC1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 O02 compound treatment 0.071 0.00119 0.31 0.075 0.00269 0.75 0.7454 0.922 1354647 Maybridge4_001718 O=C1N(Cc2ccccc2)Cc3c1[nH]c4cc(nn4c3=O)c5ccccc5 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 O03 compound treatment 0.132 0.0622 16.01 0.143 0.0707 19.69 25.2419 0.9947 1618786 Maybridge4_001719 O=C(NC1CCCc2ccccc12)Nc3ccc(OCc4ccccc4)cc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 O04 compound treatment 0.073 0.00319 0.82 0.076 0.00369 1.03 1.3065 0.9938 1669773 Maybridge4_001720 NC(=O)c1ccc2nc3ccsc3c(=O)n2c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 O05 compound treatment 0.076 0.00619 1.59 0.079 0.00669 1.86 2.4434 0.997 1411321 Maybridge4_001721 COc1ccc(cc1)c2n[nH]cc2CN3CCC(CC3)c4ccccc4OC 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 O06 compound treatment 0.071 0.00119 0.31 0.074 0.00169 0.47 0.5485 0.9783 1472712 Maybridge4_001722 Cc1cc(=O)oc2cc(NC(=O)CC(CC(=O)O)c3ccccc3)ccc12 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 O07 compound treatment 0.072 0.00219 0.56 0.075 0.00269 0.75 0.9275 0.9902 1310764 Maybridge4_001723 Fc1ccc(cc1)N2CCN(CC2)C(=O)Nc3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 O08 compound treatment 0.172 0.102 26.31 0.181 0.109 30.27 40.0074 0.9976 1239250 Maybridge4_001724 O=C(Nc1csc2ccccc12)N3CCN(CC3)C(c4ccccc4)c5ccccc5 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 O09 compound treatment 0.072 0.00219 0.56 0.072 -3.13E-4 -0.09 0.3367 0.5908 1699746 Maybridge4_001725 COc1cc2CCN(C(C)c2cc1OC)C(=O)Nc3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 O10 compound treatment 0.07 1.88E-4 0.05 0.074 0.00169 0.47 0.3664 0.7757 1354931 Maybridge4_001726 Cc1cc(no1)c2nc(CCn3c(=O)oc4ccc(C)cc34)no2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 O11 compound treatment 0.075 0.00519 1.34 0.082 0.00969 2.7 2.8521 0.9474 1136980 Maybridge4_001727 O=C(Nc1cccs1)Nc2ccc3OCCOc3c2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 O12 compound treatment 0.222 0.152 39.18 0.222 0.15 41.69 57.1842 0.9995 3179148 Maybridge4_001728 Clc1ccc(CS/C(=N\c2ccccc2)/C(C#N)c3nc4ccccc4[nH]3)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 O13 compound treatment 0.101 0.0312 8.03 0.109 0.0367 10.22 12.9026 0.9929 1462458 Maybridge4_001729 Clc1ccsc1C(=O)Oc2ccccc2N3CCCCC3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 O14 compound treatment 0.062 -0.00781 -2.01 0.067 -0.00531 -1.48 -2.4685 -0.9886 3179149 Maybridge4_001730 Cn1c(Sc2c3CCCc3nc4ncnn24)nnc1c5ccccc5 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 O15 compound treatment 0.069 -8.12E-4 -0.21 0.072 -3.13E-4 -0.09 -0.2095 -0.9245 1250957 Maybridge4_001731 Cn1nccc1NC(=O)COCC(=O)O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 O16 compound treatment 0.129 0.0592 15.24 0.144 0.0717 19.96 24.8926 0.9911 1424513 Maybridge4_001732 COc1cc2CCN(C(C)c2cc1OC)C(=O)c3cc4c(C)cc(C)cc4[nH]3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 O17 compound treatment 0.085 0.0152 3.91 0.089 0.0167 4.65 6.0512 0.9963 3063791 Maybridge4_001733 Cc1c(CN2CCN(CC2)c3ccccn3)sc4ccccc14 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 O18 compound treatment 0.071 0.00119 0.31 0.074 0.00169 0.47 0.5485 0.9783 1224470 Maybridge4_001734 CN(CCc1ccccn1)C(=O)c2cccnc2Oc3ccc(Cl)cc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 O19 compound treatment 0.131 0.0612 15.75 0.131 0.0587 16.34 22.6967 0.9998 1228387 Maybridge4_001735 O=S(=O)(Nc1ccccc1Oc2ccccc2)c3ccc(s3)c4ccon4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 O20 compound treatment 0.071 0.00119 0.31 0.075 0.00269 0.75 0.7454 0.922 3179150 Maybridge4_001736 CC1=NCCN1CCNC(=O)Nc2cc(C)cc(C)c2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 O21 compound treatment 0.071 0.00119 0.31 0.076 0.00369 1.03 0.9424 0.8795 1638495 Maybridge4_001737 O=C1NCCN1CCN2C(Nc3ccccc3C2=O)c4ccccc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 O22 compound treatment 0.076 0.00619 1.59 0.074 0.00169 0.47 1.4588 0.8783 3063793 Maybridge4_001738 Cc1nn(nc1c2nnc(o2)c3cccc4ccccc34)c5ccccc5 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 O23 mock treatment 0.07 1.88E-4 0.05 0.073 6.87E-4 0.19 0.1695 0.8585 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 O24 positive control 0.075 0.00519 1.34 0.078 0.00569 1.58 2.0644 0.9964 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 P01 compound treatment 0.073 0.00319 0.82 0.084 0.0117 3.25 2.8819 0.8585 1685839 Maybridge4_001739 CN(C1CCCCC1)C(=O)NS(=O)(=O)c2ccc(C)cc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 P02 compound treatment 0.089 0.0192 4.94 0.093 0.0207 5.76 7.5671 0.9971 3063794 Maybridge4_001740 CC(C)c1ccc(NC(=O)C2=NNC(=O)CC2)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 P03 compound treatment 0.136 0.0662 17.04 0.15 0.0777 21.64 27.3486 0.993 1248453 Maybridge4_001741 Oc1cc2c(coc2c3ccccc13)C(=O)c4ccc(Cl)cc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 P04 compound treatment 0.075 0.00519 1.34 0.079 0.00669 1.86 2.2614 0.9867 1427084 Maybridge4_001742 S=C(Nc1ccccc1)N2CCCCC2c3cccnc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 P05 compound treatment 0.077 0.00719 1.85 0.082 0.00969 2.7 3.2163 0.9831 1556607 Maybridge4_001743 CC(C)(C)c1ccc(Oc2ccc(NC(=O)CC(C)(C)CC(=O)O)cn2)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 P06 compound treatment 0.089 0.0192 4.94 0.09 0.0177 4.93 6.9764 1.0 1313218 Maybridge4_001744 N#Cc1c2CCCc2c(N3CCCCC3)n4c5ccccc5nc14 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 P07 compound treatment 0.084 0.0142 3.65 0.091 0.0187 5.2 6.263 0.985 3063820 Maybridge4_001745 O=C(CSc1nnc(OC(=O)c2cccs2)n1C3CC3)c4ccc5OCCOc5c4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 P08 compound treatment 0.081 0.0112 2.88 0.085 0.0127 3.53 4.5353 0.9949 3063821 Maybridge4_001746 Cc1nn(cc1C2C=C(N=C3SCC(=O)N23)c4ccc(Cl)cc4)c5ccccc5 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 P09 compound treatment 0.077 0.00719 1.85 0.078 0.00569 1.58 2.4286 0.997 3063822 Maybridge4_001747 Cc1nc(cn1C)S(=O)(=O)N2CCN(CC2)C3c4ccccc4-c5ccccc35 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 P10 compound treatment 0.071 0.00119 0.31 0.074 0.00169 0.47 0.5485 0.9783 3063823 Maybridge4_001748 O=C1N(Cc2ccc3nonc3c2)S(=O)(=O)c4ccccc14 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 P11 compound treatment 0.075 0.00519 1.34 0.081 0.00869 2.42 2.6552 0.9608 1323976 Maybridge4_001749 Fc1ccc(cc1)C(=O)Nc2ccc3[nH]ccc3c2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 P12 compound treatment 0.112 0.0422 10.86 0.12 0.0477 13.28 17.0715 0.995 3179235 Maybridge4_001750 Cc1ccccc1C(=O)Nc2n[nH]c(SCc3ccc(Cl)cc3)n2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 P13 compound treatment 0.071 0.00119 0.31 0.08 0.00769 2.14 1.7301 0.8 1141633 Maybridge4_001751 Cc1cc(NC(=O)Nc2ccccc2)n(n1)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 P14 compound treatment 0.141 0.0712 18.33 0.155 0.0827 23.03 29.2435 0.9936 3179236 Maybridge4_001752 Cc1c(/C=N/N2C(=O)CNC2=S)c(=O)n3c4ccccc4[nH]c3c1C#N 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 P15 compound treatment 0.118 0.0482 12.41 0.126 0.0537 14.95 19.3454 0.9957 3063825 Maybridge4_001753 O=C(NCCc1cccs1)N2CCN(CC2)C3c4ccccc4-c5ccccc35 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 P16 compound treatment 0.08 0.0102 2.62 0.088 0.0157 4.37 4.944 0.9702 3179237 Maybridge4_001754 O=C(Nc1ccc2OCCOc2c1)C3Cc4ccccc4N3C(=O)OCc5ccccc5 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 P17 compound treatment 0.074 0.00419 1.08 0.078 0.00569 1.58 1.8824 0.9824 3179238 Maybridge4_001755 Cc1noc(C)c1CSc2nnc(O)n2Cc3ccco3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 P18 compound treatment 0.212 0.142 36.61 0.218 0.146 40.57 54.576 0.9987 3063826 Maybridge4_001756 NNC(=O)C1N(N=C(C=C1C(=O)NN)C(=O)c2cccs2)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 P19 compound treatment 0.074 0.00419 1.08 0.075 0.00269 0.75 1.2916 0.9841 3179239 Maybridge4_001757 Cc1cc(C(=O)n2ccc(n2)c3cccs3)c(C)o1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 P20 compound treatment 0.07 1.88E-4 0.05 0.075 0.00269 0.75 0.5634 0.7512 1543173 Maybridge4_001758 CCOC(=O)N1CCC(CC1)NC(=O)c2cc(C)on2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 P21 compound treatment 0.071 0.00119 0.31 0.073 6.87E-4 0.19 0.3516 0.9746 3179240 Maybridge4_001759 COc1ccc(NC(=O)COCC(=O)O)cc1OC 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 P22 compound treatment 0.073 0.00319 0.82 0.072 -3.13E-4 -0.09 0.5188 0.6286 3179241 Maybridge4_001760 Cc1onc(c1C(=O)NCC2COc3ccccc3O2)c4ccccc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 P23 mock treatment 0.071 0.00119 0.31 0.073 6.87E-4 0.19 0.3516 0.9746 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2053 P24 positive control 0.077 0.00719 1.85 0.079 0.00669 1.86 2.6255 1.0 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 A01 compound treatment 0.078 0.00975 2.51 0.081 0.0121 3.36 4.1505 0.9897 3063827 Maybridge4_001761 Cc1noc(C)c1S(=O)(=O)NCC2COc3ccccc3O2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 A02 compound treatment 0.108 0.0398 10.23 0.111 0.0421 11.71 15.52 0.9977 3179242 Maybridge4_001762 COc1ccc(cc1)C2C3CCc4ccccc4C3=NN2C(=O)c5cccs5 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 A03 compound treatment 0.085 0.0168 4.31 0.082 0.0131 3.64 5.6218 0.9964 3063828 Maybridge4_001763 COc1ccc(cc1)c2nnsc2N3C(=O)c4ccccc4C3=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 A04 compound treatment 0.093 0.0248 6.37 0.09 0.0211 5.87 8.6537 0.9991 3179243 Maybridge4_001764 CCn1c(Cn2nnc3ccccc23)nnc1SCC(=O)c4ccc(Br)cc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 A05 compound treatment 0.156 0.0877 22.59 0.163 0.0941 26.2 34.4989 0.9973 3179244 Maybridge4_001765 C1Cc2cc(ccc2O1)C3Nc4ccccc4-c5cccn35 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 A06 compound treatment 0.1 0.0318 8.17 0.107 0.0381 10.6 13.2758 0.9918 3063829 Maybridge4_001766 S=C(Nc1ccccc1)N2c3ccccc3Sc4ccccc24 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 A07 compound treatment 0.128 0.0597 15.38 0.123 0.0541 15.06 21.5243 0.9999 3179245 Maybridge4_001767 O=S(=O)(NCc1ccco1)c2ccc(Oc3c(C#N)cccc3C#N)cc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 A08 compound treatment 0.074 0.00575 1.48 0.074 0.00506 1.41 2.0438 0.9997 3063830 Maybridge4_001768 Nc1nc(Sc2nnc(c3ccncc3)n2c4ccccc4)ncc1C#N 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 A09 compound treatment 0.121 0.0527 13.58 0.124 0.0551 15.33 20.4468 0.9982 3179246 Maybridge4_001769 Clc1ccc(COC(=O)c2ccc3ccccc3n2)c(Cl)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 A10 compound treatment 0.107 0.0388 9.98 0.121 0.0521 14.5 17.3072 0.9834 3063831 Maybridge4_001770 O=C(CSc1nnc(o1)c2ccncc2)NC(=O)Nc3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 A11 compound treatment 0.069 7.5E-4 0.19 0.069 6.25E-5 0.02 0.1489 0.7677 1526124 Maybridge4_001771 S=c1[nH]nc(c2ccncc2)n1Cc3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 A12 compound treatment 0.12 0.0517 13.32 0.12 0.0511 14.22 19.477 0.9995 3179247 Maybridge4_001772 S=c1[nH]c(=S)c2cnc(nc2[nH]1)N3CCc4ccccc34 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 A13 compound treatment 0.079 0.0107 2.77 0.077 0.00806 2.25 3.5448 0.9946 3063832 Maybridge4_001773 Cc1cc(C)c2c(n1)sc3c(=O)n(/N=C/c4ccccc4)cnc32 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 A14 compound treatment 0.093 0.0248 6.37 0.091 0.0221 6.14 8.8506 0.9998 3179248 Maybridge4_001774 Fc1ccc(Cn2nc3sc4ccccc4n3c(=O)c2=O)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 A15 compound treatment 0.074 0.00575 1.48 0.078 0.00906 2.52 2.8315 0.9677 3063833 Maybridge4_001775 Clc1ccccc1Cn2nnc3c(=S)[nH]cnc23 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 A16 compound treatment 0.125 0.0568 14.61 0.137 0.0681 18.95 23.735 0.9917 3179249 Maybridge4_001776 CCOC(=O)c1c(C)c(C)sc1NC(=S)Nc2cc(C)nn2c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 A17 compound treatment 0.081 0.0127 3.28 0.092 0.0231 6.42 6.8628 0.9514 3063834 Maybridge4_001777 CCOC(=O)c1nnn2c1nc(N(CC)CC)c3ccccc32 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 A18 compound treatment 0.078 0.00975 2.51 0.079 0.0101 2.8 3.7566 0.9985 3179250 Maybridge4_001778 Cc1cc(C)c2c(n1)sc3c(=O)n(NC(=O)Nc4ccccc4)c(C)nc32 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 A19 compound treatment 0.084 0.0158 4.06 0.089 0.0201 5.59 6.8182 0.9876 3063835 Maybridge4_001779 CCOC(=O)c1nn(c2ccccc2)c3nc(=O)c(C#N)c(c4ccccc4)n13 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 A20 compound treatment 0.1 0.0318 8.17 0.1 0.0311 8.65 11.8973 0.9996 3179251 Maybridge4_001780 O=C(Cn1c(=O)n(c2ccccc2)c(=O)c3cc(sc13)c4ccccc4)c5cccs5 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 A21 compound treatment 0.073 0.00475 1.22 0.075 0.00606 1.69 2.0586 0.9875 3179252 Maybridge4_001781 COc1ccc(cc1)n2ncc(NC(=O)NCc3ccccn3)c2C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 A22 compound treatment 0.093 0.0248 6.37 0.094 0.0251 6.98 9.4414 0.999 3063836 Maybridge4_001782 COc1ccc(/C=C/2\N=C(N(/N=C/c3cccnc3)C2=O)c4ccccc4)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 A23 mock treatment 0.071 0.00275 0.71 0.072 0.00306 0.85 1.1037 0.9957 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 A24 positive control 0.075 0.00675 1.74 0.075 0.00606 1.69 2.4228 0.9999 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 B01 compound treatment 0.074 0.00575 1.48 0.079 0.0101 2.8 3.0284 0.9555 3179253 Maybridge4_001783 OC(=O)CSc1nnc([nH]1)c2cccs2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 B02 compound treatment 0.161 0.0927 23.88 0.163 0.0941 26.2 35.4092 0.9989 3063837 Maybridge4_001784 O=c1oc2=C(c3ccccc3)S(=O)(=O)C(=c2o1)c4ccccc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 B03 compound treatment 0.155 0.0867 22.34 0.153 0.0841 23.41 32.3476 0.9997 3179254 Maybridge4_001785 Cc1cc(C)c2c3NC(=O)CN(C(=O)c3sc2n1)c4ccccc4C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 B04 compound treatment 0.447 0.379 97.52 0.429 0.36 100.28 139.86 0.9999 1701942 Maybridge4_001786 COc1ccc(cc1)N2C(=O)Cc3ccc(OC)cc3C2=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 B05 compound treatment 0.071 0.00275 0.71 0.07 0.00106 0.3 0.7099 0.9251 3179255 Maybridge4_001787 Clc1ccc(cc1)n2c(=N)c3cnc(nc3[nH]c2=O)N4CCCC4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 B06 compound treatment 0.14 0.0717 18.47 0.139 0.0701 19.51 26.8598 0.9996 1588538 Maybridge4_001788 Cc1oc2cc(O)ccc2c(=O)c1Oc3ccc(Cl)cc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 B07 compound treatment 0.103 0.0348 8.95 0.11 0.0411 11.44 14.4128 0.9926 3179256 Maybridge4_001789 COc1ccc(cc1)n/2c(cs\c2=N/Cc3cccnc3)c4cccc(OC)c4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 B08 compound treatment 0.093 0.0248 6.37 0.096 0.0271 7.54 9.8352 0.9965 3179257 Maybridge4_001790 O=C(c1ccccc1)c2cccc(NC=C3C(=O)NC(=O)NC3=O)c2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 B09 compound treatment 0.076 0.00775 2.0 0.076 0.00706 1.97 2.8017 1.0 1289329 Maybridge4_001791 O=C1C(=C(c2ccccc2)S(=O)(=O)c3ccccc13)Cc4ccc(cc4)c5nnn[nH]5 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 B10 compound treatment 0.07 0.00175 0.45 0.071 0.00206 0.57 0.7248 0.9928 1270319 Maybridge4_001792 O=C(c1ccccn1)c2ccc3ccccc3n2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 B11 compound treatment 0.073 0.00475 1.22 0.074 0.00506 1.41 1.8617 0.9975 1356935 Maybridge4_001793 C1C2CC3CC1CC(C2)(C3)c4cn5ccccc5n4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 B12 compound treatment 0.147 0.0788 20.28 0.147 0.0781 21.74 29.7096 0.9994 1489551 Maybridge4_001794 Cc1cc(c(Cl)cc1Cl)S(=O)(=O)N2CCC(CC2)NC(=O)Cc3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 B13 compound treatment 0.072 0.00375 0.97 0.07 0.00106 0.3 0.892 0.8833 3063861 Maybridge4_001795 CC(=O)O[C@@H]1[C@H]2CO[C@H](O2)[C@H](OC(=O)C)[C@H]1OC(=O)C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 B14 compound treatment 0.073 0.00475 1.22 0.07 0.00106 0.3 1.074 0.8536 1649672 Maybridge4_001796 COc1cc(C(=O)CCC(=O)O)c(OC)cc1C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 B15 compound treatment 0.086 0.0177 4.57 0.089 0.0201 5.59 7.1823 0.995 1471910 Maybridge4_001797 Cc1ccc(NC(=O)N2C(=O)C3(OCCO3)c4ccccc24)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 B16 compound treatment 0.073 0.00475 1.22 0.072 0.00306 0.85 1.4679 0.9845 1205899 Maybridge4_001798 CCOC(=O)C1=C(C)N(C)C(=O)N(C)C1c2ccccc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 B17 compound treatment 0.083 0.0147 3.8 0.08 0.0111 3.08 4.8638 0.9946 3063863 Maybridge4_001799 CC(=O)Nc1ccc2oc(cc(=O)c2c1)c3ccc(C#N)cc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 B18 compound treatment 0.16 0.0917 23.62 0.151 0.0821 22.85 32.864 0.9999 3179258 Maybridge4_001800 Cc1c(sc2nc(C)cc(C)c12)C(=O)NN 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 B19 compound treatment 0.068 -2.5E-4 -0.06 0.068 -9.37E-4 -0.26 -0.2301 -0.8558 3063864 Maybridge4_001801 CC(O)/C=C\c1cc[n+](C)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 B20 compound treatment 0.133 0.0648 16.67 0.134 0.0651 18.12 24.6007 0.9991 3179259 Maybridge4_001802 O=C(NC(=S)NC1(CC2CC3CC(C2)C1)C3)c4ccccc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 B21 compound treatment 0.226 0.158 40.62 0.219 0.15 41.79 58.2708 0.9999 1176828 Maybridge4_001803 COC(=O)C1C(C(C(=O)OC)S(=O)(=O)CS1(=O)=O)c2ccc(OC)cc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 B22 compound treatment 0.069 7.5E-4 0.19 0.068 -9.37E-4 -0.26 -0.0481 -0.148 1288189 Maybridge4_001804 COC(=O)C1=C(C)NC(=C(C1)C(=O)OC)C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 B23 mock treatment 0.069 7.5E-4 0.19 0.069 6.25E-5 0.02 0.1489 0.7677 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 B24 positive control 0.072 0.00375 0.97 0.074 0.00506 1.41 1.6797 0.9829 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 C01 compound treatment 0.112 0.0437 11.26 0.113 0.0441 12.27 16.6421 0.9991 3179260 Maybridge4_001805 O=S(=O)(NCC1COc2ccccc2O1)c3ccc(s3)S(=O)(=O)c4ccccc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 C02 compound treatment 0.161 0.0927 23.88 0.16 0.0911 25.36 34.8184 0.9995 3063865 Maybridge4_001806 Fc1ccc(cc1)C2C3CCc4ccccc4C3=NN2C(=O)c5ccco5 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 C03 compound treatment 0.072 0.00375 0.97 0.074 0.00506 1.41 1.6797 0.9829 3179353 Maybridge4_001807 COc1ccc(cc1OC)C(=O)NCc2ccc(C#N)cc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 C04 compound treatment 0.156 0.0877 22.59 0.157 0.0881 24.52 33.3173 0.9992 3063866 Maybridge4_001808 O=C(Oc1c(c2ccccc2)c(=O)n3CCc4cccc1c43)c5ccccc5 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 C05 compound treatment 0.071 0.00275 0.71 0.073 0.00406 1.13 1.3007 0.9745 3179354 Maybridge4_001809 FC(F)(F)c1ccc(cc1)c2nnc(SCc3ccncc3)n2Cc4ccco4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 C06 compound treatment 0.086 0.0177 4.57 0.085 0.0161 4.47 6.3946 0.9999 3063867 Maybridge4_001810 CCOC(=O)c1nnn2c1nc(Sc3nc4ccccc4o3)c5ccccc52 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 C07 compound treatment 0.084 0.0158 4.06 0.082 0.0131 3.64 5.4398 0.9985 3179355 Maybridge4_001811 COc1cccc(Cc2nnc(o2)c3c(C)onc3c4ccccc4)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 C08 compound treatment 0.204 0.136 34.95 0.2 0.131 36.5 50.5239 0.9998 3179356 Maybridge4_001812 C=CCn1c(=S)sc2c(Sc3nnc(o3)c4ccco4)ncnc12 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 C09 compound treatment 0.162 0.0938 24.14 0.175 0.106 29.54 37.9543 0.995 3063868 Maybridge4_001813 Clc1ccc(Cn2c(=O)n(Cc3ccc(Cl)cc3)c4ccccc4c2=O)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 C10 compound treatment 0.158 0.0897 23.11 0.157 0.0881 24.52 33.6815 0.9996 3179357 Maybridge4_001814 Nc1nc(SCC(=O)NC(=O)Nc2ccccc2)ncc1C#N 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 C11 compound treatment 0.116 0.0478 12.29 0.122 0.0531 14.78 19.1426 0.9958 2099392 Maybridge4_001815 Cc1nc2ccc(F)cc2c3N(CCc31)c4ccc(Cl)cc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 C12 compound treatment 0.546 0.478 123.01 0.542 0.473 131.75 180.1363 0.9994 3179358 Maybridge4_001816 C=CCSc1ncc2c(=S)[nH]c(=S)[nH]c2n1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 C13 compound treatment 0.08 0.0118 3.03 0.076 0.00706 1.97 3.53 0.9783 3179359 Maybridge4_001817 Cc1cc(C)c2c(n1)sc3c(SCC(=O)c4ccc(Br)cc4)ncnc32 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 C14 compound treatment 0.07 0.00175 0.45 0.073 0.00406 1.13 1.1186 0.9185 3063869 Maybridge4_001818 C=CCn1nc2sc3ccccc3n2c(=O)c1=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 C15 compound treatment 0.096 0.0278 7.14 0.1 0.0311 8.65 11.1691 0.9955 3179360 Maybridge4_001819 COc1ccc(Nc2ncnc3n(Cc4ccccc4Cl)nnc23)c(OC)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 C16 compound treatment 0.109 0.0408 10.49 0.108 0.0391 10.88 15.1113 0.9998 3063871 Maybridge4_001820 CCOC(=O)c1c(C)c(C)sc1NC(=S)N2CCOCC2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 C17 compound treatment 0.12 0.0517 13.32 0.12 0.0511 14.22 19.477 0.9995 3179361 Maybridge4_001821 CCOC(=O)c1nnn2c1nc(N3CCN(CC3)c4ccccc4)c5ccccc52 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 C18 compound treatment 0.155 0.0867 22.34 0.156 0.0871 24.25 32.9384 0.9992 3063872 Maybridge4_001822 Cc1cc(C)c2c(=O)n(sc2n1)C(=O)c3cccs3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 C19 compound treatment 0.201 0.133 34.18 0.203 0.134 37.34 50.5685 0.999 3179362 Maybridge4_001823 COc1ccc(cc1)C2C(=C(N)N3CCc4cc(OC)c(OC)cc4C3=C2C#N)C#N 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 C20 compound treatment 0.085 0.0168 4.31 0.083 0.0141 3.92 5.8187 0.9988 3063873 Maybridge4_001824 CNC(=O)NC(=O)Cn1cnc2sc(cc2c1=O)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 C21 compound treatment 0.074 0.00575 1.48 0.077 0.00806 2.25 2.6345 0.9796 3179363 Maybridge4_001825 COc1cc2CCN3C(N(N=C3C(=O)c4cccs4)c5ccccc5)c2cc1OC 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 C22 compound treatment 0.144 0.0757 19.5 0.145 0.0761 21.18 28.7695 0.9991 3063874 Maybridge4_001826 Fc1ccc(/C=N/N2C(=O)/C(=C/c3ccco3)/N=C2c4ccccc4)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 C23 mock treatment 0.065 -0.00325 -0.84 0.069 6.25E-5 0.02 -0.5794 -0.6922 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 C24 positive control 0.076 0.00775 2.0 0.076 0.00706 1.97 2.8017 1.0 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 D01 compound treatment 0.078 0.00975 2.51 0.078 0.00906 2.52 3.5597 1.0 3179364 Maybridge4_001827 CCOC(=O)CSc1nc(Nc2ccc(OC)cc2)c3cnc(nc3n1)N(CC)CC 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 D02 compound treatment 0.071 0.00275 0.71 0.076 0.00706 1.97 1.8914 0.9048 1016783 Maybridge4_001828 CSc1ncnc2[nH]cnc12 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 D03 compound treatment 0.073 0.00475 1.22 0.076 0.00706 1.97 2.2556 0.9739 3179365 Maybridge4_001829 CCOC(=O)CSc1nc(Nc2ccccc2)c3cnc(nc3n1)N4CCOCC4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 D04 compound treatment 0.069 7.5E-4 0.19 0.071 0.00206 0.57 0.5427 0.8956 3063875 Maybridge4_001830 CCn1c(C)[n+](CC)c2ccccc12 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 D05 compound treatment 0.13 0.0617 15.9 0.137 0.0681 18.95 24.6453 0.9962 3179366 Maybridge4_001831 Nc1c(C#N)c(cc2c3ccccc3oc(=O)c12)c4ccccc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 D06 compound treatment 0.085 0.0168 4.31 0.089 0.0201 5.59 7.0003 0.9918 1156367 Maybridge4_001832 CC(=O)Oc1ccc2c(=O)c(Oc3ccc(Cl)cc3)c(C)oc2c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 D07 compound treatment 0.095 0.0267 6.89 0.094 0.0251 6.98 9.8055 1.0 3179367 Maybridge4_001833 CC(/C=N/N1C(=O)c2ccccc2C1=O)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 D08 compound treatment 0.09 0.0217 5.6 0.087 0.0181 5.03 7.5167 0.9986 3063876 Maybridge4_001834 COC(=O)c1sc(=S)sc1C(=O)OC 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 D09 compound treatment 0.105 0.0367 9.46 0.099 0.0301 8.37 12.6107 0.9981 1027030 Maybridge4_001835 Clc1ccc2OC(CC(=O)c2c1)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 D10 compound treatment 0.067 -0.00125 -0.32 0.068 -9.37E-4 -0.26 -0.4122 -0.9946 1567173 Maybridge4_001836 C=CCN1C(=O)NC2(CCCCC2)C1=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 D11 compound treatment 0.157 0.0887 22.85 0.157 0.0881 24.52 33.4994 0.9994 1014811 Maybridge4_001837 O=C(N(C(=O)c1ccccc1)C(=O)c2ccccc2)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 D12 compound treatment 0.071 0.00275 0.71 0.071 0.00206 0.57 0.9068 0.9946 1422860 Maybridge4_001838 O=C(Cc1ccccc1)NC2CCN(CC2)C(=O)c3ccco3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 D13 compound treatment 0.073 0.00475 1.22 0.072 0.00306 0.85 1.4679 0.9845 3063327 Maybridge4_001839 CCOc1ccc2nc(S/C=C/C(=O)c3ccc(Cl)cc3)sc2c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 D14 compound treatment 0.081 0.0127 3.28 0.084 0.0151 4.19 5.2874 0.9926 1403045 Maybridge4_001840 COc1cc(c(OC)cc1C)c2cc(OC)c(C)cc2OC 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 D15 compound treatment 0.067 -0.00125 -0.32 0.067 -0.00194 -0.54 -0.6091 -0.9695 1267535 Maybridge4_001841 OC(=O)C(Sc1ccccc1C(=O)O)c2ccccc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 D16 compound treatment 0.072 0.00375 0.97 0.071 0.00206 0.57 1.0889 0.9692 3063328 Maybridge4_001842 CC(C)(C)[C@H]1COC(=N1)CC2=N[C@H](CO2)C(C)(C)C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 D17 compound treatment 0.077 0.00875 2.25 0.078 0.00906 2.52 3.3776 0.9984 1035033 Maybridge4_001843 O=C(C1=NNCC1c2ccccc2)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 D18 compound treatment 0.073 0.00475 1.22 0.072 0.00306 0.85 1.4679 0.9845 1414609 Maybridge4_001844 CC(=O)Oc1ccc2c(=O)c(c3nc4ccccc4n3C)c(C)oc2c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 D19 compound treatment 0.069 7.5E-4 0.19 0.068 -9.37E-4 -0.26 -0.0481 -0.148 3063329 Maybridge4_001845 CC1=CC(=O)OC(C1)c2ccccc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 D20 compound treatment 0.073 0.00475 1.22 0.073 0.00406 1.13 1.6648 0.9992 1054135 Maybridge4_001846 CCc1c(O)nc2ccccn2c1=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 D21 compound treatment 0.072 0.00375 0.97 0.073 0.00406 1.13 1.4827 0.9969 1416442 Maybridge4_001847 CCN(CC)CCC1S(=O)(=O)CC(CS1(=O)=O)c2ccccc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 D22 compound treatment 0.119 0.0508 13.07 0.117 0.0481 13.39 18.7042 0.9999 3179368 Maybridge4_001848 C(/N=C/c1cn(nc1c2ccccc2)c3ccccc3)c4ccco4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 D23 mock treatment 0.064 -0.00425 -1.09 0.069 6.25E-5 0.02 -0.7614 -0.6958 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 D24 positive control 0.074 0.00575 1.48 0.077 0.00806 2.25 2.6345 0.9796 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 E01 compound treatment 0.075 0.00675 1.74 0.079 0.0101 2.8 3.2105 0.9736 3063330 Maybridge4_001849 O=C(Nc1cccs1)N2CCN(CC2)C(=O)C3CCCO3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 E02 compound treatment 0.166 0.0978 25.17 0.165 0.0961 26.75 36.7133 0.9995 3179369 Maybridge4_001850 Clc1ccc(NC(=O)N2N=C3C(CCc4ccccc34)C2c5cccs5)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 E03 compound treatment 0.125 0.0568 14.61 0.13 0.0611 17.01 22.3566 0.9971 3063331 Maybridge4_001851 CC(C)(C)c1cc(C(=O)NCc2ccc(C#N)cc2)n(Cc3ccccc3)n1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 E04 compound treatment 0.243 0.175 44.99 0.248 0.179 49.87 67.0766 0.9987 3179370 Maybridge4_001852 C1Cc2ccccc2N1c3nnc(c4ccccc4)c(n3)c5ccccc5 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 E05 compound treatment 0.092 0.0238 6.11 0.091 0.0221 6.14 8.6685 1.0 3179371 Maybridge4_001853 Cn1nc(cc1C(F)(F)F)c2ccc(s2)S(=O)(=O)N3CCCN(CC3)C(=O)OC(C)(C)C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 E06 compound treatment 0.081 0.0127 3.28 0.08 0.0111 3.08 4.4997 0.9995 3063332 Maybridge4_001854 CCOC(=O)c1nnn2c1nc(Sc3nnc(c4ccncc4)n3C)c5ccccc52 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 E07 compound treatment 0.072 0.00375 0.97 0.071 0.00206 0.57 1.0889 0.9692 3179372 Maybridge4_001855 Cc1ccc(cc1)S(=O)(=O)NC(=O)N2CCCN(CC2)C(=O)OC(C)(C)C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 E08 compound treatment 0.08 0.0118 3.03 0.079 0.0101 2.8 4.1207 0.9993 1566406 Maybridge4_001856 CNc1nc(=S)[nH]c2sc3CCCCc3c12 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 E09 compound treatment 0.07 0.00175 0.45 0.071 0.00206 0.57 0.7248 0.9928 3179373 Maybridge4_001857 OC[C@@H]1O[C@@H](C[C@H]1O)n2cnc3c(=O)[nH]cnc23 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 E10 compound treatment 0.113 0.0447 11.52 0.112 0.0431 11.99 16.6272 0.9998 3063334 Maybridge4_001858 COc1ccc(Nc2ncc(C#N)c(N)n2)c(OC)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 E11 compound treatment 0.333 0.265 68.17 0.344 0.275 76.6 102.3667 0.9983 3179374 Maybridge4_001859 CCNc1nc(=S)[nH]c2n(ncc12)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 E12 compound treatment 0.336 0.268 68.94 0.318 0.249 69.36 97.7928 1.0 3063335 Maybridge4_001860 CCN(CC)c1ncc2c(=S)[nH]c(=S)[nH]c2n1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 E13 compound treatment 0.075 0.00675 1.74 0.069 6.25E-5 0.02 1.2412 0.7142 3179375 Maybridge4_001861 Cc1cc(C)c2c(n1)sc3c(Sc4nnc(o4)c5ccncc5)ncnc32 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 E14 compound treatment 0.121 0.0527 13.58 0.132 0.0631 17.56 22.0222 0.9919 3179376 Maybridge4_001862 CCOC(=O)N1CCc2c(C1)sc3ncn(Cc4ccc(Cl)cc4)c(=O)c23 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 E15 compound treatment 0.184 0.116 29.8 0.186 0.117 32.6 44.1258 0.999 3063336 Maybridge4_001863 Clc1ccccc1C2C3CCc4ccccc4C3=NN2C(=S)NCC=C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 E16 compound treatment 0.088 0.0198 5.09 0.088 0.0191 5.31 7.3495 0.9998 1616264 Maybridge4_001864 CC1=NN(C(=O)C1)c2ncnc3sc4CCCCc4c23 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 E17 compound treatment 0.189 0.121 31.09 0.191 0.122 33.99 46.0207 0.999 3179377 Maybridge4_001865 CCOC(=O)c1nnn2c1nc(N(Cc3ccccc3)Cc4ccccc4)c5ccccc52 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 E18 compound treatment 0.071 0.00275 0.71 0.071 0.00206 0.57 0.9068 0.9946 3063337 Maybridge4_001866 NNC(=O)/C(=C\c1ccccc1)/NC(=O)c2ccccc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 E19 compound treatment 0.206 0.138 35.47 0.212 0.143 39.84 53.2511 0.9983 3179378 Maybridge4_001867 Cc1ccc(Cc2nn3c(nn(c4ccc(Cl)cc4)c3nc2=O)C(=O)c5cccs5)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 E20 compound treatment 0.11 0.0418 10.75 0.1 0.0311 8.65 13.7179 0.9942 3063338 Maybridge4_001868 Fc1ccc(Cn2nc3CSc4ccccc4-n3c2=O)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 E21 compound treatment 0.097 0.0288 7.4 0.098 0.0291 8.09 10.9573 0.999 3063339 Maybridge4_001869 Cc1ccc2nc(C)c3CCN(c3c2c1)c4ccccc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 E22 compound treatment 0.242 0.174 44.74 0.23 0.161 44.85 63.3499 1.0 3179379 Maybridge4_001870 Fc1ccc(/C=C\2/N=C(N(CC(=O)c3ccco3)C2=O)c4ccccc4)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 E23 mock treatment 0.066 -0.00225 -0.58 0.068 -9.37E-4 -0.26 -0.5942 -0.9352 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 E24 positive control 0.076 0.00775 2.0 0.077 0.00806 2.25 2.9987 0.9983 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 F01 compound treatment 0.09 0.0217 5.6 0.092 0.0231 6.42 8.5014 0.9977 3179475 Maybridge4_001871 Cc1cc(nc2oc3C(=O)N(CC(=O)Nc3c12)c4ccccc4)c5ccccc5 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 F02 compound treatment 0.071 0.00275 0.71 0.072 0.00306 0.85 1.1037 0.9957 1429948 Maybridge4_001872 CC1(C)C(NC(=O)C2CCCCC2)[C@]3(C)CCC1C3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 F03 compound treatment 0.189 0.121 31.09 0.174 0.105 29.26 42.673 0.9995 3179476 Maybridge4_001873 CCN(CC)c1ncc2c(NCc3ccccc3)nc(SCc4ccccc4)nc2n1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 F04 compound treatment 0.075 0.00675 1.74 0.075 0.00606 1.69 2.4228 0.9999 1050962 Maybridge4_001874 NC(=O)CCCCC1CCSS1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 F05 compound treatment 0.088 0.0198 5.09 0.087 0.0181 5.03 7.1526 1.0 3179477 Maybridge4_001875 O=C(CN1CCc2ccccc12)Nc3scc4c3c(=O)oc5ccccc45 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 F06 compound treatment 0.071 0.00275 0.71 0.071 0.00206 0.57 0.9068 0.9946 3063341 Maybridge4_001876 CC1(C)C2CCC1(C)c3noc(c23)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 F07 compound treatment 0.073 0.00475 1.22 0.072 0.00306 0.85 1.4679 0.9845 1040822 Maybridge4_001877 Cc1ccc(NC(=O)N)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 F08 compound treatment 0.095 0.0267 6.89 0.089 0.0201 5.59 8.8209 0.9946 1502018 Maybridge4_001878 COc1ccc2oc(cc(=O)c2c1)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 F09 compound treatment 0.138 0.0698 17.96 0.141 0.0721 20.07 26.8895 0.9985 3063363 Maybridge4_001879 O=C1/C(=C/c2ccc(cc2)c3nnn[nH]3)/C(Oc4ccccc14)c5ccccc5 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 F10 compound treatment 0.067 -0.00125 -0.32 0.068 -9.37E-4 -0.26 -0.4122 -0.9946 3063364 Maybridge4_001880 CC1(C)NC(=O)N(CC=C)C1=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 F11 compound treatment 0.124 0.0558 14.35 0.132 0.0631 17.56 22.5683 0.995 3063365 Maybridge4_001881 Clc1ccccc1CNC(=S)NC2(CC3CC4CC(C3)C2)C4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 F12 compound treatment 0.113 0.0447 11.52 0.114 0.0451 12.55 17.0211 0.9991 3063366 Maybridge4_001882 Fc1ccc(cc1)N(Cc2ccc(Br)cc2)C(=O)c3cccs3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 F13 compound treatment 0.068 -2.5E-4 -0.06 0.068 -9.37E-4 -0.26 -0.2301 -0.8558 1687915 Maybridge4_001883 CC1(C)CC(=O)C=C(C1)Sc2nc3ccccc3o2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 F14 compound treatment 0.062 -0.00625 -1.61 0.071 0.00206 0.57 -0.7317 -0.4282 3063367 Maybridge4_001884 C[n+]1ccc(CCc2cc[n+](C)cc2)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 F15 compound treatment 0.067 -0.00125 -0.32 0.069 6.25E-5 0.02 -0.2153 -0.6679 1612566 Maybridge4_001885 CCC(=O)N1N(C(=O)CC)c2cc(Cl)ccc2-n3c1nn(C(=O)CC)c3=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 F16 compound treatment 0.068 -2.5E-4 -0.06 0.069 6.25E-5 0.02 -0.0332 -0.498 1406161 Maybridge4_001886 CC(=O)Oc1c(I)c(=O)n(C)c2ccccc12 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 F17 compound treatment 0.073 0.00475 1.22 0.074 0.00506 1.41 1.8617 0.9975 3179478 Maybridge4_001887 CCSC(=O)NC1CCCCC1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 F18 compound treatment 0.089 0.0208 5.34 0.089 0.0201 5.59 7.7285 0.9997 3179479 Maybridge4_001888 C1C(=CC(=NN=C1c2ccccc2)c3ccccc3)c4ccccc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 F19 compound treatment 0.178 0.11 28.26 0.177 0.108 30.09 41.2611 0.9995 1002179 Maybridge4_001889 Clc1ccc(cc1)c2ccc(Cl)cc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 F20 compound treatment 0.063 -0.00525 -1.35 0.062 -0.00694 -1.93 -2.322 -0.9847 3063368 Maybridge4_001890 CCC(C)Sc1nnc(S)s1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 F21 compound treatment 0.068 -2.5E-4 -0.06 0.069 6.25E-5 0.02 -0.0332 -0.498 3179480 Maybridge4_001891 COC(=O)/C(=C/c1ccccc1)/c2ccccc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 F22 compound treatment 0.088 0.0198 5.09 0.087 0.0181 5.03 7.1526 1.0 1172572 Maybridge4_001892 O=c1[nH]cc(NCc2ccccc2)c(=O)[nH]1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 F23 mock treatment 0.066 -0.00225 -0.58 0.068 -9.37E-4 -0.26 -0.5942 -0.9352 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 F24 positive control 0.077 0.00875 2.25 0.075 0.00606 1.69 2.7869 0.9899 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 G01 compound treatment 0.071 0.00275 0.71 0.073 0.00406 1.13 1.3007 0.9745 3179481 Maybridge4_001893 CCOC(=O)N1CCC(CC1)NC(=O)CCCC(=O)O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 G02 compound treatment 0.128 0.0597 15.38 0.127 0.0581 16.17 22.312 0.9997 3179482 Maybridge4_001894 O=C1CSC2=NC3=C(CCc4ccccc34)C(N12)c5cccs5 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 G03 compound treatment 0.069 7.5E-4 0.19 0.069 6.25E-5 0.02 0.1489 0.7677 3063369 Maybridge4_001895 CCOC(=O)c1ncn(Cc2ccccc2)c1N 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 G04 compound treatment 0.068 -2.5E-4 -0.06 0.066 -0.00294 -0.82 -0.624 -0.7604 3063370 Maybridge4_001896 S=c1[nH]nc(Cn2nnc3ccccc23)o1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 G05 compound treatment 0.116 0.0478 12.29 0.126 0.0571 15.89 19.9303 0.992 3179483 Maybridge4_001897 COc1cccc(Cc2nnc(o2)c3ccc(s3)c4cccs4)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 G06 compound treatment 0.11 0.0418 10.75 0.114 0.0451 12.55 16.4749 0.997 3063371 Maybridge4_001898 Cn1nc2c3ccccc3n(Cc4ccccc4)c2nc1=S 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 G07 compound treatment 0.116 0.0478 12.29 0.113 0.0441 12.27 17.3703 1.0 3179484 Maybridge4_001899 CCOC(=O)c1cnn(C(=O)Cc2cccc(OC)c2)c1N 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 G08 compound treatment 0.105 0.0367 9.46 0.106 0.0371 10.32 13.9892 0.9991 1696254 Maybridge4_001900 COc1cc(OC)c2nc(C)c3CCSc3c2c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 G09 compound treatment 0.094 0.0257 6.63 0.096 0.0271 7.54 10.0173 0.998 3179485 Maybridge4_001901 CC(=O)Nc1ccccc1OCC2CC(=NO2)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 G10 compound treatment 0.089 0.0208 5.34 0.091 0.0221 6.14 8.1224 0.9976 3179486 Maybridge4_001902 C1Sc2nnc(c3ccccc3)n2N=C1c4cccs4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 G11 compound treatment 0.244 0.176 45.25 0.239 0.17 47.36 65.4863 0.9997 3063373 Maybridge4_001903 S=c1nc(Nc2ccccc2)c3cnn(c4ccccc4)c3[nH]1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 G12 compound treatment 0.174 0.106 27.23 0.17 0.101 28.15 39.1544 0.9999 3179487 Maybridge4_001904 CN1CCN(CC1)c2ncc3c(=S)[nH]c(=S)[nH]c3n2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 G13 compound treatment 0.078 0.00975 2.51 0.078 0.00906 2.52 3.5597 1.0 3063374 Maybridge4_001905 CCn1c(Sc2ncnc3c2sc4nc(C)cc(C)c43)nnc1c5cccs5 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 G14 compound treatment 0.066 -0.00225 -0.58 0.074 0.00506 1.41 0.5873 0.3853 3179488 Maybridge4_001906 CCOC(=O)N1CCc2c(C(=O)OCC)c(NC(=S)N3CCc4ccccc34)sc2C1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 G15 compound treatment 0.147 0.0788 20.28 0.139 0.0701 19.51 28.1342 0.9998 3179489 Maybridge4_001907 CCNC(=S)N1N=C2C(CCc3ccccc23)C1c4ccc(F)cc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 G16 compound treatment 0.081 0.0127 3.28 0.081 0.0121 3.36 4.6967 0.9999 1303898 Maybridge4_001908 CC1=NN(C(=O)C1)c2nc3ccccc3s2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 G17 compound treatment 0.075 0.00675 1.74 0.075 0.00606 1.69 2.4228 0.9999 3063375 Maybridge4_001909 CCOC(=O)C1=NN(C2N1CCc3cc(OC)c(OC)cc23)c4ccccc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 G18 compound treatment 0.184 0.116 29.8 0.184 0.115 32.04 43.732 0.9993 3179490 Maybridge4_001910 COc1cc(/C=C\2/N=C(N(C)C2=O)c3ccccc3)cc(OC)c1OC 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 G19 compound treatment 0.136 0.0678 17.44 0.135 0.0661 18.4 25.3438 0.9996 3063377 Maybridge4_001911 Cc1c(C)c(=O)n(Cc2ccc(Br)cc2)c(=O)n1Cc3ccc(Br)cc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 G20 compound treatment 0.119 0.0508 13.07 0.118 0.0491 13.66 18.9011 0.9998 3179491 Maybridge4_001912 O=C(Cn1nc2CSc3ccccc3-n2c1=O)NC(=O)Nc4ccccc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 G21 compound treatment 0.093 0.0248 6.37 0.091 0.0221 6.14 8.8506 0.9998 3179492 Maybridge4_001913 CCOC(=O)c1sc2nc(C)cc(C)c2c1NC(=O)Nc3ccc(Cl)cc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 G22 compound treatment 0.161 0.0927 23.88 0.151 0.0821 22.85 33.0461 0.9998 1150256 Maybridge4_001914 N(c1ccccc1)c2ncnc3sc(cc23)c4ccccc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 G23 mock treatment 0.066 -0.00225 -0.58 0.068 -9.37E-4 -0.26 -0.5942 -0.9352 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 G24 positive control 0.076 0.00775 2.0 0.076 0.00706 1.97 2.8017 1.0 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 H01 compound treatment 0.072 0.00375 0.97 0.074 0.00506 1.41 1.6797 0.9829 3179493 Maybridge4_001915 COc1cc(cc(OC)c1OC)c2nnc(SCC(=O)c3ccco3)n2C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 H02 compound treatment 0.097 0.0288 7.4 0.1 0.0311 8.65 11.3512 0.997 1202312 Maybridge4_001916 Clc1ccc(OC2CN(C2)C(=O)N3CC(C3)Oc4ccc(Cl)cc4)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 H03 compound treatment 0.093 0.0248 6.37 0.11 0.0411 11.44 12.5922 0.9619 3179494 Maybridge4_001917 O=C(CN1CCc2ccccc12)Nc3nnc(s3)c4cccs4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 H04 compound treatment 0.096 0.0278 7.14 0.118 0.0491 13.66 14.7138 0.9543 1178262 Maybridge4_001918 COc1ccc(cc1)c2nc3cc4Nc5ccccc5Oc4cc3o2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 H05 compound treatment 0.135 0.0668 17.19 0.141 0.0721 20.07 26.3433 0.997 3063402 Maybridge4_001919 O=C(Nc1scc2c1c(=O)oc3ccccc23)c4ccccc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 H06 compound treatment 0.068 -2.5E-4 -0.06 0.07 0.00106 0.3 0.1637 0.5406 3179495 Maybridge4_001920 FC(F)(F)C(NC(=O)c1cccnc1)(N2CCCC2=O)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 H07 compound treatment 0.072 0.00375 0.97 0.074 0.00506 1.41 1.6797 0.9829 1117011 Maybridge4_001921 COc1cccc(NC(=O)N)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 H08 compound treatment 0.072 0.00375 0.97 0.071 0.00206 0.57 1.0889 0.9692 3063403 Maybridge4_001922 NC(=O)c1cc(Cl)c(Cl)cc1C(=O)N 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 H09 compound treatment 0.117 0.0488 12.55 0.115 0.0461 12.83 17.9462 0.9999 3179496 Maybridge4_001923 O[C@H]1[C@@H](Oc2ccccc2C1=O)c3ccc(Cl)cc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 H10 compound treatment 0.067 -0.00125 -0.32 0.068 -9.37E-4 -0.26 -0.4122 -0.9946 3063404 Maybridge4_001924 COc1ncnc(OC)c1C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 H11 compound treatment 0.168 0.0998 25.68 0.171 0.102 28.42 38.259 0.9987 1558852 Maybridge4_001925 CC1=C(C(C2=C(N1)c3ccccc3C2=O)c4ccccc4)C(=O)Nc5ccccc5 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 H12 compound treatment 0.07 0.00175 0.45 0.071 0.00206 0.57 0.7248 0.9928 1698244 Maybridge4_001926 O=C(Cc1ccccc1)NC2CCN(CC2)C(=O)c3cccs3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 H13 compound treatment 0.067 -0.00125 -0.32 0.068 -9.37E-4 -0.26 -0.4122 -0.9946 1372400 Maybridge4_001927 O=c1c(c[nH]c2ccccc12)c3nnnn3c4ccccc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 H14 compound treatment 0.065 -0.00325 -0.84 0.073 0.00406 1.13 0.2083 0.148 3179497 Maybridge4_001928 N1[C@H]([C@H](N=C1c2ccccc2)c3ccccc3)c4ccccc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 H15 compound treatment 0.069 7.5E-4 0.19 0.072 0.00306 0.85 0.7396 0.8458 3063405 Maybridge4_001929 CO[C@H]1O[C@H](COC(=O)c2ccccc2)[C@@H](O)[C@H](O)[C@H]1OC(=O)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 H16 compound treatment 0.067 -0.00125 -0.32 0.07 0.00106 0.3 -0.0183 -0.042 1081881 Maybridge4_001930 COC(=O)CSc1nc2ccccc2[nH]1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 H17 compound treatment 0.071 0.00275 0.71 0.071 0.00206 0.57 0.9068 0.9946 3063406 Maybridge4_001931 CC(C)N(C(C)C)C(=O)NCc1ccccc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 H18 compound treatment 0.215 0.147 37.78 0.21 0.141 39.29 54.4958 0.9998 3179498 Maybridge4_001932 Clc1ccc(cc1)c2nc(SCc3ccccc3)[nH]c(=S)c2C#N 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 H19 compound treatment 0.07 0.00175 0.45 0.07 0.00106 0.3 0.5278 0.9792 3063407 Maybridge4_001933 OC(=O)c1cc(F)cc(c1)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 H20 compound treatment 0.066 -0.00225 -0.58 0.067 -0.00194 -0.54 -0.7912 -0.9994 1198061 Maybridge4_001934 CC(Oc1ccc(Cl)cc1Cl)c2n[nH]c(=S)n2CC=C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 H21 compound treatment 0.068 -2.5E-4 -0.06 0.069 6.25E-5 0.02 -0.0332 -0.498 3179499 Maybridge4_001935 FC(F)(F)C(NC1CCCCC1)(NC(=O)c2ccccc2)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 H22 compound treatment 0.099 0.0308 7.92 0.096 0.0271 7.54 10.9276 0.9997 1345621 Maybridge4_001936 O=c1[nH][nH]c(=O)n1CCCc2cc3cccc4ccc5cccc2c5c43 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 H23 mock treatment 0.068 -2.5E-4 -0.06 0.068 -9.37E-4 -0.26 -0.2301 -0.8558 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 H24 positive control 0.079 0.0107 2.77 0.075 0.00606 1.69 3.151 0.9719 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 I01 compound treatment 0.104 0.0357 9.2 0.103 0.0341 9.49 13.2164 0.9999 3179500 Maybridge4_001937 NC(=O)c1ccccc1NCC(=O)c2ccc(F)cc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 I02 compound treatment 0.07 0.00175 0.45 0.07 0.00106 0.3 0.5278 0.9792 1786031 Maybridge4_001938 S=c1[nH]nc(Cc2ccccc2)n1Cc3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 I03 compound treatment 0.067 -0.00125 -0.32 0.07 0.00106 0.3 -0.0183 -0.042 1416652 Maybridge4_001939 Cc1ccc(cc1)S(=O)(=O)NC(=O)Nc2cccnc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 I04 compound treatment 0.068 -2.5E-4 -0.06 0.072 0.00306 0.85 0.5576 0.6519 3179586 Maybridge4_001940 CNC(=O)NC(=O)CSc1nnc(Cc2ccccc2)n1c3ccc(Cl)cc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 I05 compound treatment 0.12 0.0517 13.32 0.115 0.0461 12.83 18.4924 0.9998 3063409 Maybridge4_001941 Cn1cc(cn1)S(=O)(=O)Nc2ccc(Oc3c(Cl)cccc3Cl)nc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 I06 compound treatment 0.088 0.0198 5.09 0.086 0.0171 4.75 6.9557 0.9994 3179587 Maybridge4_001942 Clc1ccccc1CC(C(=O)N2CCc3ccccc23)C(=O)N4CCc5ccccc45 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 I07 compound treatment 0.122 0.0537 13.84 0.129 0.0601 16.73 21.6135 0.9956 3063410 Maybridge4_001943 CCOC(=O)c1cnn(C(=O)c2ccc(cc2)n3c(C)ccc3C)c1N 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 I08 compound treatment 0.124 0.0558 14.35 0.114 0.0451 12.55 19.0237 0.9978 1500802 Maybridge4_001944 NC(=O)c1nnc2ccc(Cl)cc2c1N 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 I09 compound treatment 0.088 0.0198 5.09 0.086 0.0171 4.75 6.9557 0.9994 1103360 Maybridge4_001945 FC(F)(F)c1ccc(cc1)C(=O)CN2C(=O)c3ccccc3C2=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 I10 compound treatment 0.067 -0.00125 -0.32 0.067 -0.00194 -0.54 -0.6091 -0.9695 3179588 Maybridge4_001946 O=C(CSc1nnc2NCCCn12)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 I11 compound treatment 0.069 7.5E-4 0.19 0.07 0.00106 0.3 0.3458 0.9786 1721477 Maybridge4_001947 Cc1nn(c2NC3=C(C(c12)c4cccnc4)C(=O)CC(C)(C)C3)c5ccccc5 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 I12 compound treatment 0.071 0.00275 0.71 0.07 0.00106 0.3 0.7099 0.9251 1444715 Maybridge4_001948 Cc1nc2cc(C)ccn2c1c3nnco3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 I13 compound treatment 0.07 0.00175 0.45 0.071 0.00206 0.57 0.7248 0.9928 3063411 Maybridge4_001949 Cc1cc(C)c(C#N)c(Sc2ncnc3c2sc4nc(C)cc(C)c43)n1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 I14 compound treatment 0.091 0.0227 5.86 0.09 0.0211 5.87 8.2896 1.0 3179589 Maybridge4_001950 COc1ccc(cc1)n2c(n[nH]c2=S)c3ccc(Cl)cc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 I15 compound treatment 0.133 0.0648 16.67 0.142 0.0731 20.35 26.1761 0.9951 3179590 Maybridge4_001951 CNC(=S)N1N=C2C(CCc3ccccc23)C1c4ccc(OC)cc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 I16 compound treatment 0.074 0.00575 1.48 0.078 0.00906 2.52 2.8315 0.9677 3063412 Maybridge4_001952 CCOC(=O)N1CCc2c(C1)sc3[nH]c(=S)n(c4ccccc4)c(=O)c23 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 I17 compound treatment 0.087 0.0187 4.83 0.087 0.0181 5.03 6.9706 0.9998 3179591 Maybridge4_001953 COc1cc2CCn3c(C(=O)c4cccs4)c(c(C#N)c3-c2cc1OC)c5ccc(C)cc5 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 I18 compound treatment 0.233 0.165 42.42 0.189 0.12 33.44 53.6375 0.9931 3063413 Maybridge4_001954 Fc1ccc(CN2C(=O)/C(=C\c3ccc(F)cc3)/N=C2c4ccccc4)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 I19 compound treatment 0.069 7.5E-4 0.19 0.069 6.25E-5 0.02 0.1489 0.7677 3179592 Maybridge4_001955 CCC(C)[C@H](NC(=O)c1ccco1)C(=O)O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 I20 compound treatment 0.301 0.233 59.93 0.299 0.23 64.07 87.6792 0.9994 3179593 Maybridge4_001956 COc1cccc(c1)C(=O)c2sc3nsc(SCc4ccccc4)c3c2N 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 I21 compound treatment 0.084 0.0158 4.06 0.083 0.0141 3.92 5.6367 0.9998 3063414 Maybridge4_001957 Cc1cc(C)c2c(N)c(sc2n1)c3nnc(SCC(=O)c4ccccc4)n3CC=C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 I22 compound treatment 0.067 -0.00125 -0.32 0.068 -9.37E-4 -0.26 -0.4122 -0.9946 3179594 Maybridge4_001958 C=CCn1nc2CSc3ccccc3-n2c1=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 I23 mock treatment 0.067 -0.00125 -0.32 0.068 -9.37E-4 -0.26 -0.4122 -0.9946 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 I24 positive control 0.077 0.00875 2.25 0.076 0.00706 1.97 2.9838 0.9977 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 J01 compound treatment 0.089 0.0208 5.34 0.089 0.0201 5.59 7.7285 0.9997 3179595 Maybridge4_001959 CCOC(=O)CSc1nc(CN2c3ccccc3Sc4ccccc24)n[nH]1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 J02 compound treatment 0.068 -2.5E-4 -0.06 0.071 0.00206 0.57 0.3606 0.624 1402836 Maybridge4_001960 NS(=O)(=O)c1ccc(Cl)cc1Sc2ccccc2C(=O)O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 J03 compound treatment 0.08 0.0118 3.03 0.072 0.00306 0.85 2.7423 0.8724 3179596 Maybridge4_001961 CCOC(=O)Cn1c(nc(c1c2ccccc2)c3ccccc3)c4cccnc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 J04 compound treatment 0.068 -2.5E-4 -0.06 0.069 6.25E-5 0.02 -0.0332 -0.498 1114912 Maybridge4_001962 NNC(=O)CNC(=O)c1ccccc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 J05 compound treatment 0.167 0.0988 25.43 0.155 0.0861 23.97 34.9261 0.9996 3179597 Maybridge4_001963 Fc1ccc(COc2nc(cc(c3ccco3)c2C#N)c4cccs4)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 J06 compound treatment 0.076 0.00775 2.0 0.072 0.00306 0.85 2.014 0.9281 3063348 Maybridge4_001964 FC(F)(F)C(NCc1ccccn1)(NC(=O)c2cccnc2)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 J07 compound treatment 0.136 0.0678 17.44 0.138 0.0691 19.23 25.9346 0.9988 3179598 Maybridge4_001965 COc1ccc(/N=C/c2cn(cc2\C=N\c3ccc(OC)cc3)c4ccc(OC)cc4)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 J08 compound treatment 0.073 0.00475 1.22 0.074 0.00506 1.41 1.8617 0.9975 1550362 Maybridge4_001966 OC(=O)c1ccccc1NC(=O)OCC2c3ccccc3-c4ccccc24 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 J09 compound treatment 0.095 0.0267 6.89 0.095 0.0261 7.26 10.0024 0.9997 3179599 Maybridge4_001967 CC1(C)CC(=O)C=C(C1)Sc2nc3cc(Cl)ccc3s2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 J10 compound treatment 0.077 0.00875 2.25 0.076 0.00706 1.97 2.9838 0.9977 1156147 Maybridge4_001968 COc1ccc2nc3n(C)c(=O)n(C)c(=O)c3cc2c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 J11 compound treatment 0.174 0.106 27.23 0.172 0.103 28.7 39.5483 0.9997 3179600 Maybridge4_001969 O=C1C2=C(NC(=S)NC2c3ccccc3)c4ccccc14 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 J12 compound treatment 0.072 0.00375 0.97 0.073 0.00406 1.13 1.4827 0.9969 1727811 Maybridge4_001970 COc1cc(CCC(C)NC(=O)c2ccco2)ccc1OC(=O)c3ccco3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 J13 compound treatment 0.069 7.5E-4 0.19 0.071 0.00206 0.57 0.5427 0.8956 3063350 Maybridge4_001971 COc1ccc(C#N)cc1Br 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 J14 compound treatment 0.067 -0.00125 -0.32 0.07 0.00106 0.3 -0.0183 -0.042 1014022 Maybridge4_001972 O=S(=O)(Cc1ccccc1)c2ccccc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 J15 compound treatment 0.071 0.00275 0.71 0.068 -9.37E-4 -0.26 0.316 0.4188 3179601 Maybridge4_001973 Nc1n/c(=N\c2ccccc2)/n(c3ccccc3)c(=N)[nH]1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 J16 compound treatment 0.101 0.0328 8.43 0.106 0.0371 10.32 13.2609 0.995 3063351 Maybridge4_001974 FC(F)(F)c1ccccc1/N=C/2\CCCc3ccccc23 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 J17 compound treatment 0.07 0.00175 0.45 0.071 0.00206 0.57 0.7248 0.9928 3179602 Maybridge4_001975 COCOc1ccc(cc1OC)C(=O)O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 J18 compound treatment 0.084 0.0158 4.06 0.088 0.0191 5.31 6.6213 0.9912 1465673 Maybridge4_001976 CC(Nc1ccccc1)(C#N)c2ccc(F)cc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 J19 compound treatment 0.125 0.0568 14.61 0.12 0.0511 14.22 20.3873 0.9999 3179603 Maybridge4_001977 c1ccc(cc1)c2nnc(o2)c3cccc4ccccc34 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 J20 compound treatment 0.071 0.00275 0.71 0.071 0.00206 0.57 0.9068 0.9946 1519121 Maybridge4_001978 CC(Oc1ccccc1c2ccccc2)c3n[nH]c(=S)n3c4ccccc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 J21 compound treatment 0.065 -0.00325 -0.84 0.068 -9.37E-4 -0.26 -0.7763 -0.8856 3063353 Maybridge4_001979 COC(NC(=O)c1ccccc1)(C(F)(F)F)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 J22 compound treatment 0.066 -0.00225 -0.58 0.066 -0.00294 -0.82 -0.9881 -0.9857 1009264 Maybridge4_001980 CC(NC(=O)C)c1ccccc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 J23 mock treatment 0.068 -2.5E-4 -0.06 0.069 6.25E-5 0.02 -0.0332 -0.498 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 J24 positive control 0.075 0.00675 1.74 0.076 0.00706 1.97 2.6197 0.9981 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 K01 compound treatment 0.072 0.00375 0.97 0.076 0.00706 1.97 2.0735 0.9463 3179604 Maybridge4_001981 OC(=O)CSCC(=O)N1CCCN(CC1)c2ccc(cn2)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 K02 compound treatment 0.074 0.00575 1.48 0.076 0.00706 1.97 2.4376 0.9902 3063380 Maybridge4_001982 CCOC(=O)c1nnn2c1nc(SCC(=O)N)c3ccccc32 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 K03 compound treatment 0.068 -2.5E-4 -0.06 0.069 6.25E-5 0.02 -0.0332 -0.498 3179605 Maybridge4_001983 COc1ccc(NC(=O)c2ccc(CN3CCS(=O)(=O)CC3)cc2)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 K04 compound treatment 0.067 -0.00125 -0.32 0.068 -9.37E-4 -0.26 -0.4122 -0.9946 3063381 Maybridge4_001984 CNC(=O)NC(=O)CSc1nnc(c2ccncc2)n1Cc3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 K05 compound treatment 0.082 0.0138 3.54 0.083 0.0141 3.92 5.2726 0.9987 3179606 Maybridge4_001985 S=C(NCC1CC(=NO1)c2ccccc2)NCc3ccco3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 K06 compound treatment 0.077 0.00875 2.25 0.074 0.00506 1.41 2.5899 0.9745 3179607 Maybridge4_001986 CCOc1nc-2c(Cc3ccccc32)c(c4ccco4)c1C#N 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 K07 compound treatment 0.067 -0.00125 -0.32 0.072 0.00306 0.85 0.3755 0.4119 3063383 Maybridge4_001987 Sc1nnc(Cc2ccsc2)n1Cc3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 K08 compound treatment 0.279 0.211 54.26 0.274 0.205 57.11 78.7508 0.9997 3179608 Maybridge4_001988 O=c1[nH]c-2c(CCc3ccccc32)c(c1C#N)c4cccnc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 K09 compound treatment 0.178 0.11 28.26 0.17 0.101 28.15 39.8827 1.0 3063384 Maybridge4_001989 C=CCSc1c2CCCc2c(C#N)c3nc4ccccc4n13 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 K10 compound treatment 0.063 -0.00525 -1.35 0.067 -0.00194 -0.54 -1.3373 -0.9189 3179609 Maybridge4_001990 O=C(N1CCCn2c(SCc3ccccc3)nnc12)c4cccs4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 K11 compound treatment 0.152 0.0838 21.56 0.149 0.0801 22.3 31.0137 0.9999 3063386 Maybridge4_001991 CCNC(=S)Nc1sc2CC(C)CCc2c1C#N 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 K12 compound treatment 0.142 0.0737 18.99 0.127 0.0581 16.17 24.8608 0.9968 3179610 Maybridge4_001992 Cc1sc2nc3SCC(=Nn3c(=O)c2c1C)c4ccc(F)cc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 K13 compound treatment 0.228 0.16 41.13 0.225 0.156 43.46 59.8165 0.9996 3063387 Maybridge4_001993 CCOC(=O)c1oc2nc(cc(c3ccco3)c2c1N)c4ccco4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 K14 compound treatment 0.068 -2.5E-4 -0.06 0.07 0.00106 0.3 0.1637 0.5406 3179611 Maybridge4_001994 C1Sc2ccccc2-n3c(nnc13)c4cccs4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 K15 compound treatment 0.078 0.00975 2.51 0.078 0.00906 2.52 3.5597 1.0 3179694 Maybridge4_001995 CCOC(=O)c1nnn2c1n(C)c(=O)c3ccccc32 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 K16 compound treatment 0.092 0.0238 6.11 0.094 0.0251 6.98 9.2593 0.9978 3063389 Maybridge4_001996 O=c1c(nnc2sc3ccccc3n12)N4CCOCC4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 K17 compound treatment 0.104 0.0357 9.2 0.105 0.0361 10.04 13.6102 0.9991 3179695 Maybridge4_001997 CCOC(=O)C1=NN(C2C1c3cccc4cccc2c34)c5ccc(C)cc5 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 K18 compound treatment 0.192 0.124 31.86 0.23 0.161 44.85 54.247 0.986 3063390 Maybridge4_001998 Clc1ccccc1/C=C\2/N=C(N(CC=C)C2=O)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 K19 compound treatment 0.094 0.0257 6.63 0.093 0.0241 6.7 9.4265 1.0 3179696 Maybridge4_001999 O=C(NCC1COc2ccccc2O1)Nc3csc4ccccc34 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 K20 compound treatment 0.095 0.0267 6.89 0.086 0.0171 4.75 8.2301 0.9836 3179697 Maybridge4_002000 CNC(=O)NC(=O)CSc1ncnc2sc(cc12)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 K21 compound treatment 0.087 0.0187 4.83 0.088 0.0191 5.31 7.1675 0.9989 3063391 Maybridge4_002001 Cc1cc(C)c2c(N)c(sc2n1)c3nnc(SCc4ccc(Cl)cc4)n3C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 K22 compound treatment 0.094 0.0257 6.63 0.094 0.0251 6.98 9.6234 0.9997 3179698 Maybridge4_002002 S=c1[nH]nc(CSc2nc(cn2c3ccccc3)c4ccccc4)n1c5ccccc5 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 K23 mock treatment 0.069 7.5E-4 0.19 0.069 6.25E-5 0.02 0.1489 0.7677 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 K24 positive control 0.076 0.00775 2.0 0.077 0.00806 2.25 2.9987 0.9983 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 L01 compound treatment 0.108 0.0398 10.23 0.12 0.0511 14.22 17.2923 0.987 3063422 Maybridge4_002003 CCOC(=O)CSc1nc(SCC(=O)OCC)c2c3CCCc3sc2n1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 L02 compound treatment 0.07 0.00175 0.45 0.072 0.00306 0.85 0.9217 0.9555 1536081 Maybridge4_002004 OC(=O)c1ccccc1Sc2ccccc2S(=O)(=O)NC3CCCCC3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 L03 compound treatment 0.107 0.0388 9.98 0.112 0.0431 11.99 15.5349 0.9958 3179699 Maybridge4_002005 C=CCn1c(nc(c1c2ccccc2)c3ccccc3)c4cccs4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 L04 compound treatment 0.073 0.00475 1.22 0.074 0.00506 1.41 1.8617 0.9975 1430538 Maybridge4_002006 COC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)c2cccc(Cl)c2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 L05 compound treatment 0.078 0.00975 2.51 0.077 0.00806 2.25 3.3628 0.9985 3179700 Maybridge4_002007 N=c1n(Nc2ccccc2)cnc3sc4CCCc4c13 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 L06 compound treatment 0.071 0.00275 0.71 0.07 0.00106 0.3 0.7099 0.9251 3063426 Maybridge4_002008 Cc1ccc(cc1)C(=O)NC(NCc2ccco2)(C(F)(F)F)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 L07 compound treatment 0.109 0.0408 10.49 0.11 0.0411 11.44 15.5051 0.9991 3179701 Maybridge4_002009 Brc1ccc(s1)c2ccc(Br)s2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 L08 compound treatment 0.11 0.0418 10.75 0.111 0.0421 11.71 15.8841 0.9991 1371799 Maybridge4_002010 CCOC(=O)C(C)Oc1ccc2c(cc(=O)oc2c1)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 L09 compound treatment 0.103 0.0348 8.95 0.099 0.0301 8.37 12.2466 0.9994 1134767 Maybridge4_002011 C1C(=Cc2ccccc12)N3CCOCC3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 L10 compound treatment 0.066 -0.00225 -0.58 0.067 -0.00194 -0.54 -0.7912 -0.9994 1364288 Maybridge4_002012 O=C(NC1CCN(CC1)C(=O)C2CCC2)C3CCCCC3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 L11 compound treatment 0.071 0.00275 0.71 0.069 6.25E-5 0.02 0.513 0.7243 1570440 Maybridge4_002013 Oc1cc(Cc2ccccc2)cnc1CN3CCOCC3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 L12 compound treatment 0.105 0.0367 9.46 0.106 0.0371 10.32 13.9892 0.9991 1227426 Maybridge4_002014 CC(C)C1CCC(C)CC1N(Cc2ccccc2)C(=O)c3cccs3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 L13 compound treatment 0.069 7.5E-4 0.19 0.071 0.00206 0.57 0.5427 0.8956 1583701 Maybridge4_002015 N[C@@H](CO)CSCc1ccccc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 L14 compound treatment 0.084 0.0158 4.06 0.089 0.0201 5.59 6.8182 0.9876 1368346 Maybridge4_002016 COc1cc(CCc2cc(OC)c(C)cc2OC)c(OC)cc1C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 L15 compound treatment 0.067 -0.00125 -0.32 0.068 -9.37E-4 -0.26 -0.4122 -0.9946 3063428 Maybridge4_002017 FC(F)(F)C(NC(=O)c1ccccc1)(Nc2ccccc2)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 L16 compound treatment 0.122 0.0537 13.84 0.129 0.0601 16.73 21.6135 0.9956 1023708 Maybridge4_002018 COc1ccc(cc1)c2nc3ccccc3s2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 L17 compound treatment 0.073 0.00475 1.22 0.074 0.00506 1.41 1.8617 0.9975 1344186 Maybridge4_002019 CC(=O)N1C(C(=O)NC1=S)c2ccccc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 L18 compound treatment 0.102 0.0338 8.69 0.098 0.0291 8.09 11.8676 0.9994 3179703 Maybridge4_002020 CC(C)C(C)(Nc1ccccc1)C#N 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 L19 compound treatment 0.069 7.5E-4 0.19 0.071 0.00206 0.57 0.5427 0.8956 1047316 Maybridge4_002021 OC(=O)c1ccc(s1)C(=O)O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 L20 compound treatment 0.105 0.0367 9.46 0.105 0.0361 10.04 13.7923 0.9996 3179704 Maybridge4_002022 Brc1ccccc1C(=O)c2ccc-3c(c2)C(=O)c4ccccc43 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 L21 compound treatment 0.066 -0.00225 -0.58 0.067 -0.00194 -0.54 -0.7912 -0.9994 3063451 Maybridge4_002023 FC(F)(F)C(NC(=O)c1ccccc1)(OCc2ccccc2)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 L22 compound treatment 0.072 0.00375 0.97 0.072 0.00306 0.85 1.2858 0.9981 3179705 Maybridge4_002024 CCOC(=O)CSc1nncc(=O)[nH]1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 L23 mock treatment 0.069 7.5E-4 0.19 0.069 6.25E-5 0.02 0.1489 0.7677 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 L24 positive control 0.075 0.00675 1.74 0.076 0.00706 1.97 2.6197 0.9981 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 M01 compound treatment 0.105 0.0367 9.46 0.104 0.0351 9.76 13.5953 0.9999 3063453 Maybridge4_002025 Cc1ccc(CNC(=O)Nc2ccccc2)n1C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 M02 compound treatment 0.108 0.0398 10.23 0.109 0.0401 11.16 15.1261 0.9991 3179706 Maybridge4_002026 CCOC(=O)c1nnn2c1nc(SCc3ccc(F)cc3)c4ccccc42 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 M03 compound treatment 0.091 0.0227 5.86 0.092 0.0231 6.42 8.6834 0.9989 3179707 Maybridge4_002027 O=C(Nc1ccc(OCc2ccccc2)cc1)OCC3CN(Cc4ccccc4)CCO3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 M04 compound treatment 0.165 0.0968 24.91 0.151 0.0821 22.85 33.7743 0.9991 3063456 Maybridge4_002028 O=C(CC(C(=O)N1CCc2ccccc12)C(=O)N3CCc4ccccc34)c5ccccc5 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 M05 compound treatment 0.111 0.0428 11.01 0.106 0.0371 10.32 15.0815 0.9995 3179708 Maybridge4_002029 O=C(OCC1CC(=NO1)c2ccccc2)c3cccc(n3)C(=O)OCC4CC(=NO4)c5ccccc5 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 M06 compound treatment 0.069 7.5E-4 0.19 0.069 6.25E-5 0.02 0.1489 0.7677 3063457 Maybridge4_002030 CC1=Nn2c(Cn3nnc4ccccc34)nnc2SC1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 M07 compound treatment 0.084 0.0158 4.06 0.083 0.0141 3.92 5.6367 0.9998 3179709 Maybridge4_002031 C/C(=N\O)/C(C)(C)Nc1ccc(cc1)C(C)(C)C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 M08 compound treatment 0.156 0.0877 22.59 0.153 0.0841 23.41 32.5296 0.9998 3063458 Maybridge4_002032 O=C(Oc1cc(=O)oc2c3cccc4CCn(c(=O)c12)c43)c5ccccc5 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 M09 compound treatment 0.112 0.0437 11.26 0.109 0.0401 11.16 15.8544 1.0 2096080 Maybridge4_002033 CCOC(=O)c1sc2n(c3ccccc3)c(=S)n(c4ccccc4)c(=O)c2c1O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 M10 compound treatment 0.11 0.0418 10.75 0.107 0.0381 10.6 15.0964 1.0 3179710 Maybridge4_002034 CCOC(=O)N1CCc2c(C#N)c(NC(=O)CN3CCc4ccccc34)sc2C1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 M11 compound treatment 0.188 0.12 30.83 0.176 0.107 29.82 42.8848 0.9999 3063459 Maybridge4_002035 O=C(COc1nc(cc(c2cccs2)c1C#N)c3ccccc3)c4ccccc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 M12 compound treatment 0.068 -2.5E-4 -0.06 0.071 0.00206 0.57 0.3606 0.624 3063460 Maybridge4_002036 O=c1n(CN2CCOCC2)nc3sc4ccccc4n3c1=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 M13 compound treatment 0.133 0.0648 16.67 0.136 0.0671 18.68 24.9946 0.9984 3179711 Maybridge4_002037 Nc1c(oc2nc(cc(c3cccs3)c12)c4ccco4)C(=O)c5ccc(Cl)cc5 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 M14 compound treatment 0.123 0.0548 14.1 0.122 0.0531 14.78 20.417 0.9997 3063486 Maybridge4_002038 Cc1nc2n(ncc2c(=O)n1NC(=O)Nc3ccc(Cl)c(Cl)c3)c4ccccc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 M15 compound treatment 0.086 0.0177 4.57 0.084 0.0151 4.19 6.1977 0.9991 3179712 Maybridge4_002039 CCOC(=O)c1nnn2c1n(CC=C)c(=O)c3ccccc32 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 M16 compound treatment 0.423 0.355 91.34 0.376 0.307 85.52 125.0535 0.9995 3063487 Maybridge4_002040 COC(=O)C1=C(C)N=C2SC(=C(N)N2C1c3cccs3)C#N 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 M17 compound treatment 0.308 0.24 61.73 0.31 0.241 67.13 91.1198 0.9991 3179713 Maybridge4_002041 O=C/1NN=C(\C1=C\2/OC(=CS2)c3ccccc3)c4ccccc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 M18 compound treatment 0.26 0.192 49.37 0.24 0.171 47.64 68.5962 0.9998 3179714 Maybridge4_002042 Clc1ccc(CN2C(=O)/C(=C\c3cccs3)/N=C2c4ccccc4)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 M19 compound treatment 0.075 0.00675 1.74 0.075 0.00606 1.69 2.4228 0.9999 3063489 Maybridge4_002043 COc1ccc(cc1)n2ncc(NC(=O)N3CCOCC3)c2C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 M20 compound treatment 0.121 0.0527 13.58 0.119 0.0501 13.94 19.4621 0.9999 3179715 Maybridge4_002044 O=c1c(nc(nn1CN2CCOCC2)c3ccccc3)C(CN4CCOCC4)c5ccccc5 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 M21 compound treatment 0.241 0.173 44.48 0.234 0.165 45.97 63.9555 0.9999 3063490 Maybridge4_002045 Clc1ccccc1C2C3CCc4ccccc4C3=NN2C(=O)c5cccs5 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 M22 compound treatment 0.067 -0.00125 -0.32 0.068 -9.37E-4 -0.26 -0.4122 -0.9946 3179716 Maybridge4_002046 CCOC(=O)c1cnc(nc1N)N2CCOCC2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 M23 mock treatment 0.071 0.00275 0.71 0.07 0.00106 0.3 0.7099 0.9251 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 M24 positive control 0.076 0.00775 2.0 0.077 0.00806 2.25 2.9987 0.9983 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 N01 compound treatment 0.073 0.00475 1.22 0.079 0.0101 2.8 2.8463 0.9309 3063492 Maybridge4_002047 O=C1CSc2nnc(c3ccccc3)n12 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 N02 compound treatment 0.072 0.00375 0.97 0.072 0.00306 0.85 1.2858 0.9981 1229835 Maybridge4_002048 OC(=O)c1ccccc1Sc2ccccc2S(=O)(=O)NC3(CC4CC5CC(C4)C3)C5 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 N03 compound treatment 0.138 0.0698 17.96 0.135 0.0661 18.4 25.7079 0.9999 1256899 Maybridge4_002049 c1csc(c1)c2nc(c([nH]2)c3ccccc3)c4ccccc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 N04 compound treatment 0.139 0.0707 18.22 0.129 0.0601 16.73 24.7084 0.9991 3178130 Maybridge4_002050 CCCc1cc(O)nc(SC/C=C/c2ccccc2)n1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 N05 compound treatment 0.105 0.0367 9.46 0.105 0.0361 10.04 13.7923 0.9996 3178131 Maybridge4_002051 CCNc1nc(SCC(=O)NC(=O)NCc2ccccc2)nc3sc4CN(C)CCc4c13 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 N06 compound treatment 0.121 0.0527 13.58 0.116 0.0471 13.11 18.8714 0.9998 3063494 Maybridge4_002052 CC1CN=C(S1)N(C2CCCCC2)C(=O)Nc3cccc(Cl)c3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 N07 compound treatment 0.086 0.0177 4.57 0.086 0.0171 4.75 6.5916 0.9998 3178132 Maybridge4_002053 Cc1ccc(OC(=O)OCSc2nnn[nH]2)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 N08 compound treatment 0.072 0.00375 0.97 0.072 0.00306 0.85 1.2858 0.9981 1423044 Maybridge4_002054 CC(Oc1ccc2c(cc(=O)oc2c1)c3ccccc3)C(=O)O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 N09 compound treatment 0.081 0.0127 3.28 0.08 0.0111 3.08 4.4997 0.9995 1177114 Maybridge4_002055 Brc1ccc(cc1)N2C(=O)C3=C(C2=O)C(=NCCN3)c4ccccc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 N10 compound treatment 0.07 0.00175 0.45 0.069 6.25E-5 0.02 0.3309 0.7339 1659522 Maybridge4_002056 Clc1cccc(Cl)c1C(=O)N2CCC(CC2)NC(=O)C3CCCCC3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 N11 compound treatment 0.068 -2.5E-4 -0.06 0.068 -9.37E-4 -0.26 -0.2301 -0.8558 1381385 Maybridge4_002057 CN1C(=O)N(c2ccc(Cl)cc2)C(C)(O)CC1(C)C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 N12 compound treatment 0.07 0.00175 0.45 0.072 0.00306 0.85 0.9217 0.9555 1409714 Maybridge4_002058 COc1cccc(NC(=O)c2ccc(OC)c(OC)c2)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 N13 compound treatment 0.068 -2.5E-4 -0.06 0.072 0.00306 0.85 0.5576 0.6519 1704266 Maybridge4_002059 CC(C)(C)C(=O)Nc1ccccc1Cc2ccccc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 N14 compound treatment 0.103 0.0348 8.95 0.102 0.0331 9.21 12.8374 0.9999 3178133 Maybridge4_002060 NNC(=O)c1cc(S)ncn1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 N15 compound treatment 0.067 -0.00125 -0.32 0.069 6.25E-5 0.02 -0.2153 -0.6679 3063524 Maybridge4_002061 CC(=O)NC(Nc1ccccc1)(C(F)(F)F)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 N16 compound treatment 0.067 -0.00125 -0.32 0.071 0.00206 0.57 0.1786 0.2712 3178134 Maybridge4_002062 C/C(=N\c1ccccc1C(F)(F)F)/c2cccs2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 N17 compound treatment 0.072 0.00375 0.97 0.074 0.00506 1.41 1.6797 0.9829 1020871 Maybridge4_002063 O=C1NC(C(=O)N1)c2ccccc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 N18 compound treatment 0.083 0.0147 3.8 0.084 0.0151 4.19 5.6515 0.9988 1667495 Maybridge4_002064 Clc1ccc2[nH]c(=O)c3nc(oc3c2c1)c4ccccc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 N19 compound treatment 0.072 0.00375 0.97 0.073 0.00406 1.13 1.4827 0.9969 1670169 Maybridge4_002065 CC(C)c1ccc(cc1)S(=O)(=O)CC#N 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 N20 compound treatment 0.074 0.00575 1.48 0.075 0.00606 1.69 2.2407 0.9979 1596128 Maybridge4_002066 CCOC(=O)C1CCN(C1=O)S(=O)(=O)Cc2ccccc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 N21 compound treatment 0.108 0.0398 10.23 0.101 0.0321 8.93 13.5507 0.9977 1008385 Maybridge4_002067 O=C(c1ccccc1)c2ccccc2C(=O)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 N22 compound treatment 0.067 -0.00125 -0.32 0.067 -0.00194 -0.54 -0.6091 -0.9695 1546853 Maybridge4_002068 Cn1c(=O)n(C)c2ncn(CC(O)CN(CC=C)CC=C)c2c1=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 N23 mock treatment 0.069 7.5E-4 0.19 0.068 -9.37E-4 -0.26 -0.0481 -0.148 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 N24 positive control 0.075 0.00675 1.74 0.075 0.00606 1.69 2.4228 0.9999 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 O01 compound treatment 0.192 0.124 31.86 0.209 0.14 39.01 50.1115 0.995 3063527 Maybridge4_002069 O=C(Nc1sccc1c2nc3ccccc3s2)Nc4ccccc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 O02 compound treatment 0.069 7.5E-4 0.19 0.07 0.00106 0.3 0.3458 0.9786 3178135 Maybridge4_002070 CCOC(=O)CSc1nnc(Cn2nnc3ccccc23)n1c4ccc(F)cc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 O03 compound treatment 0.069 7.5E-4 0.19 0.068 -9.37E-4 -0.26 -0.0481 -0.148 3063528 Maybridge4_002071 Cc1ccc(cc1)S(=O)(=O)NC(=O)OCC2CN(Cc3ccccc3)CCO2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 O04 compound treatment 0.197 0.129 33.15 0.165 0.0961 26.75 42.3571 0.9943 3178136 Maybridge4_002072 Cn1nc2c3ccccc3n(CC=C)c2nc1=S 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 O05 compound treatment 0.268 0.2 51.43 0.269 0.2 55.72 75.7635 0.9992 3178137 Maybridge4_002073 Clc1ccc(cc1)n2ncc(n2)C(=O)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 O06 compound treatment 0.113 0.0447 11.52 0.117 0.0481 13.39 17.6118 0.9972 3178138 Maybridge4_002074 Brc1ccc(cc1)C2=Nn3c(Cn4nnc5ccccc45)nnc3SC2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 O07 compound treatment 0.078 0.00975 2.51 0.092 0.0231 6.42 6.3167 0.916 1760428 Maybridge4_002075 O=C(Nc1ccc2OCCOc2c1)c3ccc4nccnc4c3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 O08 compound treatment 0.071 0.00275 0.71 0.069 6.25E-5 0.02 0.513 0.7243 3178139 Maybridge4_002076 CNC(=O)NC(=O)CSc1nnc(o1)c2ccco2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 O09 compound treatment 0.219 0.151 38.81 0.213 0.144 40.12 55.8148 0.9999 3178140 Maybridge4_002077 CCOC(=O)COc1c(C#N)sc2n(c3ccccc3)c(=S)n(c4ccccc4)c(=O)c12 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 O10 compound treatment 0.086 0.0177 4.57 0.087 0.0181 5.03 6.7885 0.9989 3063548 Maybridge4_002078 S=c1[nH]c(=S)c2cnc(nc2[nH]1)N3CCOCC3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 O11 compound treatment 0.108 0.0398 10.23 0.117 0.0481 13.39 16.7015 0.9912 1200067 Maybridge4_002079 Cc1cc(C)c2c(N)c(sc2n1)C(=O)c3cccs3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 O12 compound treatment 0.101 0.0328 8.43 0.103 0.0341 9.49 12.6702 0.9983 2102976 Maybridge4_002080 COc1ccc(cc1)C2=Nn3c(SC2)nc4sc5CCCCc5c4c3=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 O13 compound treatment 0.08 0.0118 3.03 0.09 0.0211 5.87 6.2869 0.9526 3063550 Maybridge4_002081 Cc1cc(C)c(C#N)c(Sc2ncnc3n(Cc4ccccc4)nnc23)n1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 O14 compound treatment 0.183 0.115 29.54 0.17 0.101 28.15 40.7929 0.9997 3178141 Maybridge4_002082 O=c1n(/N=C/c2cccs2)cnc3sc(cc13)c4ccccc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 O15 compound treatment 0.13 0.0617 15.9 0.118 0.0491 13.66 20.9037 0.9972 3178142 Maybridge4_002083 CCOC(=O)c1nnn2c1n(Cc3ccc(Cl)cc3)c(=O)c4ccccc42 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 O16 compound treatment 0.153 0.0848 21.82 0.148 0.0791 22.02 30.9988 1.0 3063551 Maybridge4_002084 COc1cc(/C=N/n2c(C)nc3n(cnc3c2=O)c4ccccc4)cc(OC)c1OC 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 O17 compound treatment 0.077 0.00875 2.25 0.077 0.00806 2.25 3.1807 1.0 3178143 Maybridge4_002085 O=c1nc2n(nc(c3ccccc3)n2c(c1C#N)c4ccccc4)c5ccccc5 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 O18 compound treatment 0.148 0.0798 20.53 0.137 0.0681 18.95 27.9224 0.9992 3063552 Maybridge4_002086 C1Cc2ccccc2N1c3ncnc4sc(cc34)c5ccccc5 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 O19 compound treatment 0.074 0.00575 1.48 0.078 0.00906 2.52 2.8315 0.9677 3178144 Maybridge4_002087 COc1ccc(cc1)n2ncc(NC(=O)Nc3ccc4OCCCOc4c3)c2C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 O20 compound treatment 0.069 7.5E-4 0.19 0.071 0.00206 0.57 0.5427 0.8956 3063553 Maybridge4_002088 Nc1ncnc2nc(ncc12)N3CCOCC3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 O21 compound treatment 0.068 -2.5E-4 -0.06 0.068 -9.37E-4 -0.26 -0.2301 -0.8558 3178145 Maybridge4_002089 CC(=O)N1N=C2C(CCc3ccccc23)C1c4cccs4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 O22 compound treatment 0.067 -0.00125 -0.32 0.068 -9.37E-4 -0.26 -0.4122 -0.9946 3063554 Maybridge4_002090 Cc1cc(=O)n2ncnc2n1CC(=O)NN 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 O23 mock treatment 0.072 0.00375 0.97 0.068 -9.37E-4 -0.26 0.4981 0.498 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 O24 positive control 0.075 0.00675 1.74 0.077 0.00806 2.25 2.8166 0.992 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 P01 compound treatment 0.079 0.0107 2.77 0.082 0.0131 3.64 4.5295 0.9909 1504248 Maybridge4_002091 C1Cc2ccccc2N1c3ncnc4n(ncc34)c5ccccc5 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 P02 compound treatment 0.083 0.0147 3.8 0.084 0.0151 4.19 5.6515 0.9988 1485949 Maybridge4_002092 CC(CN1CCN(Cc2ccccc2)CC1)N(C(=O)c3ccc(cc3)C(C)(C)C)c4ccccn4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 P03 compound treatment 0.092 0.0238 6.11 0.099 0.0301 8.37 10.2439 0.9881 3063615 Maybridge4_002093 O=C/1NNC(=N\C1=C/c2ccccc2)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 P04 compound treatment 0.073 0.00475 1.22 0.074 0.00506 1.41 1.8617 0.9975 3178146 Maybridge4_002094 Cn1cnnc1Sc2cc(C#N)c(C#N)cc2Sc3nncn3C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 P05 compound treatment 0.202 0.134 34.44 0.184 0.115 32.04 47.009 0.9994 3063618 Maybridge4_002095 CCNc1nc(SCc2ccc(Cl)cc2)nc3sc4CN(C)CCc4c13 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 P06 compound treatment 0.076 0.00775 2.0 0.076 0.00706 1.97 2.8017 1.0 3178147 Maybridge4_002096 Cn1cnc(c1C#N)n2oo2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 P07 compound treatment 0.073 0.00475 1.22 0.08 0.0111 3.08 3.0433 0.9181 1405262 Maybridge4_002097 O=C(NCc1ccccc1)NC2CCCCC2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 P08 compound treatment 0.119 0.0508 13.07 0.121 0.0521 14.5 19.4919 0.9987 1585718 Maybridge4_002098 CCOC(=O)C(C)Oc1cc(O)c2c(=O)cc(oc2c1)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 P09 compound treatment 0.078 0.00975 2.51 0.074 0.00506 1.41 2.772 0.9628 3178148 Maybridge4_002099 COC(=O)/C(=C/C(=O)c1c(F)c(F)c(OC)c(F)c1F)/O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 P10 compound treatment 0.072 0.00375 0.97 0.07 0.00106 0.3 0.892 0.8833 1497616 Maybridge4_002100 O=C(Cc1ccccc1)NC2CCN(CC2)C(=O)C3CCC3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 P11 compound treatment 0.07 0.00175 0.45 0.069 6.25E-5 0.02 0.3309 0.7339 3178149 Maybridge4_002101 O=c1ccc2CCCCc2n1CCC#N 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 P12 compound treatment 0.075 0.00675 1.74 0.075 0.00606 1.69 2.4228 0.9999 1054556 Maybridge4_002102 Cc1ccc(NS(=O)(=O)c2ccccc2)c(NS(=O)(=O)c3ccccc3)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 P13 compound treatment 0.07 0.00175 0.45 0.071 0.00206 0.57 0.7248 0.9928 1043550 Maybridge4_002103 OC1CCN(Cc2ccccc2)CC1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 P14 compound treatment 0.07 0.00175 0.45 0.07 0.00106 0.3 0.5278 0.9792 1240290 Maybridge4_002104 CC(C)(C)OC(=O)N1CCN(Cc2ccccc2)CC1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 P15 compound treatment 0.07 0.00175 0.45 0.068 -9.37E-4 -0.26 0.134 0.2573 3063648 Maybridge4_002105 CC(=O)NC(NCc1ccccc1)(C(F)(F)F)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 P16 compound treatment 0.07 0.00175 0.45 0.072 0.00306 0.85 0.9217 0.9555 3178234 Maybridge4_002106 CC(C)[C@H]1COC(=N1)c2cccc(n2)C3=N[C@H](CO3)C(C)C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 P17 compound treatment 0.072 0.00375 0.97 0.07 0.00106 0.3 0.892 0.8833 3063650 Maybridge4_002107 CC(O)/C=C/c1cccc[n+]1C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 P18 compound treatment 0.097 0.0288 7.4 0.098 0.0291 8.09 10.9573 0.999 3178235 Maybridge4_002108 CCOC(=O)C1=C(C)N(C(=O)Oc2ccccc2)C(=NC1c3ccccc3)SC 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 P19 compound treatment 0.089 0.0208 5.34 0.089 0.0201 5.59 7.7285 0.9997 3063651 Maybridge4_002109 CN1C(=O)/C(=C\Nc2ccc(Cl)cc2)/C(=O)c3c1n(C)c(=O)n(C)c3=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 P20 compound treatment 0.106 0.0377 9.72 0.109 0.0401 11.16 14.762 0.9976 1466385 Maybridge4_002110 COC(=O)C1=C(C)NC(=C(C1C)C(=O)OC)C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 P21 compound treatment 0.071 0.00275 0.71 0.073 0.00406 1.13 1.3007 0.9745 1646281 Maybridge4_002111 COc1cccc(c1)c2ncc(o2)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 P22 compound treatment 0.123 0.0548 14.1 0.13 0.0611 17.01 21.9924 0.9957 1592521 Maybridge4_002112 O=C(Nc1ccccc1)N(Cc2ccccc2)c3cccc4ccccc34 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 P23 mock treatment 0.072 0.00375 0.97 0.071 0.00206 0.57 1.0889 0.9692 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2054 P24 positive control 0.078 0.00975 2.51 0.078 0.00906 2.52 3.5597 1.0 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 A01 compound treatment 0.103 0.0332 8.54 0.104 0.032 8.91 12.3437 0.9998 3178236 Maybridge4_002113 CCOC(=O)c1c(C)n[nH]c1/N=C/c2ccc(OC)c(OC)c2Cl 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 A02 compound treatment 0.133 0.0632 16.27 0.128 0.056 15.6 22.5316 0.9998 3178237 Maybridge4_002114 CS/C(=C(/C#N)\S(=O)(=O)c1ccc(Cl)cc1)/NC2CCCCC2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 A03 compound treatment 0.078 0.00819 2.11 0.077 0.005 1.39 2.4752 0.9797 1739670 Maybridge4_002115 O=C(C(C(=O)N1CCCCC1)C2(CC3CC4CC(C3)C2)C4)N5CCCCC5 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 A04 compound treatment 0.092 0.0222 5.71 0.09 0.018 5.01 7.5841 0.9979 3178238 Maybridge4_002116 CSc1c(C#N)c(nn1C)c2ccc(Cl)cc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 A05 compound treatment 0.086 0.0162 4.17 0.091 0.019 5.29 6.6886 0.993 3063681 Maybridge4_002117 CN(C)c1nc(O)nc(n1)c2ccc(Cl)cc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 A06 compound treatment 0.118 0.0482 12.41 0.11 0.038 10.58 16.2561 0.9969 3178239 Maybridge4_002118 CN1c2ccccc2C(=O)/C(=C\Nc3cc(cc(c3)C(F)(F)F)C(F)(F)F)/S1(=O)=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 A07 compound treatment 0.099 0.0292 7.51 0.099 0.027 7.52 10.6308 1.0 1532269 Maybridge4_002119 COc1cc2CCN=C(c3ccccc3NC(=O)c4cccc(Cl)c4)c2cc1OC 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 A08 compound treatment 0.141 0.0712 18.33 0.15 0.078 21.72 28.3204 0.9964 1424615 Maybridge4_002120 CCCS(=O)(=O)C1=C(N)OC(=C(C#N)C1c2ccc(Cl)cc2)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 A09 compound treatment 0.082 0.0122 3.14 0.087 0.015 4.18 5.1727 0.9901 1227957 Maybridge4_002121 Cc1cc(N(S(=O)(=O)c2ccc(C)cc2)S(=O)(=O)c3ccc(C)cc3)n(C)n1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 A10 compound treatment 0.075 0.00519 1.34 0.079 0.007 1.95 2.3229 0.983 3063685 Maybridge4_002122 CS/C(=C(/C#N)\C(=O)c1ccc(Cl)cc1)/NCC2CC2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 A11 compound treatment 0.074 0.00419 1.08 0.077 0.005 1.39 1.747 0.992 1505422 Maybridge4_002123 O=C(Nc1cc(nn1c2ccccc2)C3CC3)Nc4ccccc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 A12 compound treatment 0.077 0.00719 1.85 0.079 0.007 1.95 2.687 0.9997 3063686 Maybridge4_002124 CC(C)S(=O)(=O)/C(=C/Nc1ncccn1)/C#N 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 A13 compound treatment 0.117 0.0472 12.15 0.117 0.045 12.53 17.4525 0.9999 1730851 Maybridge4_002125 Cc1ccc(cc1)C2C(=C(N)OC(=C2C#N)C3CC3)C#N 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 A14 compound treatment 0.081 0.0112 2.88 0.083 0.011 3.06 4.203 0.9995 3063688 Maybridge4_002126 Cn1ccnc1S(=O)(=O)/C(=C/c2ccc3OCOc3c2)/C#N 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 A15 compound treatment 0.072 0.00219 0.56 0.076 0.004 1.11 1.186 0.9501 1337308 Maybridge4_002127 CCOC(=O)c1cnc2n(C)nc(C3CC3)c2c1N4CCOCC4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 A16 compound treatment 0.094 0.0242 6.23 0.092 0.02 5.57 8.342 0.9984 3063690 Maybridge4_002128 Cc1cc(nc2c(Br)c(nn12)C(C)(C)C)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 A17 compound treatment 0.073 0.00319 0.82 0.075 0.003 0.84 1.1711 1.0 1574781 Maybridge4_002129 COc1c(Cl)scc1NC(=O)N(C)C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 A18 compound treatment 0.166 0.0962 24.77 0.175 0.103 28.68 37.795 0.9973 3063692 Maybridge4_002130 CSC(=C(C#N)C(=O)c1cccc(c1)C(F)(F)F)SC 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 A19 compound treatment 0.144 0.0742 19.1 0.151 0.079 22.0 29.0635 0.9975 3178240 Maybridge4_002131 Clc1ccccc1C(=O)C(=C2SCCCS2)C#N 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 A20 compound treatment 0.073 0.00319 0.82 0.075 0.003 0.84 1.1711 1.0 1150123 Maybridge4_002132 CC(C)CC(NC(=O)Cc1ccsc1)C(=O)NN 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 A21 compound treatment 0.162 0.0922 23.74 0.169 0.097 27.01 35.8852 0.9979 3063728 Maybridge4_002133 COc1cccc(c1)c2nc(N)nc(SC)c2C#N 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 A22 compound treatment 0.126 0.0562 14.47 0.126 0.054 15.04 20.8634 0.9998 3178241 Maybridge4_002134 Fc1ccc(N/C=C(\C#N)/S(=O)(=O)Cc2ccco2)cc1Cl 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 A23 mock treatment 0.073 0.00319 0.82 0.076 0.004 1.11 1.368 0.9887 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 A24 positive control 0.076 0.00619 1.59 0.078 0.006 1.67 2.308 0.9997 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 B01 compound treatment 0.082 0.0122 3.14 0.091 0.019 5.29 5.9604 0.9689 3178242 Maybridge4_002135 FC(F)(F)c1cc(CN/C=C(\C#N)/S(=O)(=O)Cc2ccco2)cc(c1)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 B02 compound treatment 0.101 0.0312 8.03 0.104 0.032 8.91 11.9796 0.9986 3063731 Maybridge4_002136 COC(=O)c1ccc2C(=O)/C(=C/Nc3ccc(Cl)cc3)/S(=O)(=O)N(C)c2c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 B03 compound treatment 0.08 0.0102 2.62 0.082 0.01 2.78 3.824 0.9996 3178243 Maybridge4_002137 CSc1sc(/C(=N\O)/C)c2CC(C)(C)C/C(=N/O)/c12 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 B04 compound treatment 0.171 0.101 26.05 0.176 0.104 28.96 38.9022 0.9986 3063732 Maybridge4_002138 COC(=O)c1sc(SC)c(c1C)c2ccon2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 B05 compound treatment 0.523 0.453 116.68 0.548 0.476 132.56 176.2429 0.998 3178244 Maybridge4_002139 Clc1ccc(Sc2ccccc2CN/C(=C(\N=C\c3cccs3)/C#N)/C#N)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 B06 compound treatment 0.078 0.00819 2.11 0.081 0.009 2.51 3.2629 0.9963 3063733 Maybridge4_002140 CN(C)/C=C/C(=O)c1ccc2OC(C)(C)CCc2c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 B07 compound treatment 0.1 0.0302 7.77 0.103 0.031 8.63 11.6006 0.9986 1330787 Maybridge4_002141 Clc1ccc(cc1)C(=O)N(CCS(=O)(=O)c2ccc(Cl)cc2)Cc3cccs3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 B08 compound treatment 0.11 0.0402 10.35 0.115 0.043 11.98 15.7843 0.9974 3063734 Maybridge4_002142 Clc1ccc(cc1)S(=O)(=O)C(=C2SCCCCS2)C#N 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 B09 compound treatment 0.225 0.155 39.96 0.216 0.144 40.1 56.6104 1.0 1191188 Maybridge4_002143 CSc1scc2CCc3cn(nc3-c12)C(=O)c4ccc(Cl)cc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 B10 compound treatment 0.185 0.115 29.66 0.198 0.126 35.09 45.7834 0.9965 1483249 Maybridge4_002144 CC1(C)CCc2cc(ccc2O1)c3ccn(n3)S(=O)(=O)c4ccc(Cl)cc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 B11 compound treatment 0.229 0.159 40.99 0.224 0.152 42.33 58.914 0.9999 3178245 Maybridge4_002145 Cc1csc2sc(C(=O)c3ccc(Cl)cc3)c(C)c12 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 B12 compound treatment 0.143 0.0732 18.84 0.143 0.071 19.77 27.3061 0.9997 3063735 Maybridge4_002146 FC(F)(F)c1cc(n2ncc(C(=O)NC(=S)Nc3ccccc3Cl)c2n1)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 B13 compound treatment 0.081 0.0112 2.88 0.081 0.009 2.51 3.8091 0.9976 1629969 Maybridge4_002147 CCOC(=O)c1sc(SC)c-2c1CCc3cnc(SC)nc23 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 B14 compound treatment 0.082 0.0122 3.14 0.087 0.015 4.18 5.1727 0.9901 3178246 Maybridge4_002148 CC(C)CSc1nnc(CSCc2nc(cs2)c3ccc(Cl)cc3)n1C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 B15 compound treatment 0.396 0.326 83.98 0.393 0.321 89.4 122.5981 0.9995 1122221 Maybridge4_002149 Clc1ccc(cc1)C2CC(=CC(=S)S2)N3CCCCC3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 B16 compound treatment 0.075 0.00519 1.34 0.077 0.005 1.39 1.9291 0.9998 3063769 Maybridge4_002150 NNC(=O)c1ccc(CSc2ccc(cn2)C(F)(F)F)o1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 B17 compound treatment 0.155 0.0852 21.93 0.161 0.089 24.79 33.0354 0.9981 3178247 Maybridge4_002151 COC(=O)C1=C(CSC1)Nc2ccc(OC(=O)Nc3ccc(OC(F)(F)F)cc3)cc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 B18 compound treatment 0.186 0.116 29.91 0.191 0.119 33.14 44.587 0.9987 3063773 Maybridge4_002152 CC(C)(C)SC(=O)c1cccnc1SCCS(=O)(=O)c2cccc(c2)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 B19 compound treatment 0.174 0.104 26.83 0.18 0.108 30.08 40.2361 0.9984 3178248 Maybridge4_002153 Cc1csc2sc(/C=N/Cc3cccs3)c(C)c12 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 B20 compound treatment 0.067 -0.00281 -0.72 0.069 -0.003 -0.84 -1.1028 -0.9975 1206852 Maybridge4_002154 CCOC(=O)c1cnc2n(C)nc(C)c2c1Sc3nnc(SC)s3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 B21 compound treatment 0.232 0.162 41.76 0.24 0.168 46.79 62.611 0.9984 3178249 Maybridge4_002155 CS(=O)(=O)c1sc(C(=O)NC(=S)Nc2ccc(OC(F)(F)F)cc2)c3CCC=Cc13 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 B22 compound treatment 0.193 0.123 31.72 0.196 0.124 34.53 46.846 0.9991 3178341 Maybridge4_002156 CCOC(=O)CC1Sc2ccccc2N=C1SCC(=O)Nc3cccc(c3)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 B23 mock treatment 0.071 0.00119 0.31 0.073 0.001 0.28 0.4131 0.9989 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 B24 positive control 0.075 0.00519 1.34 0.076 0.004 1.11 1.7321 0.9959 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 C01 compound treatment 0.075 0.00519 1.34 0.079 0.007 1.95 2.3229 0.983 3063777 Maybridge4_002157 CCN(CC)C(=S)NC(=S)c1ccc(C)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 C02 compound treatment 0.078 0.00819 2.11 0.087 0.015 4.18 4.4445 0.9498 3178342 Maybridge4_002158 COC(=O)c1ccccc1S(=O)(=O)/C(=C/Nc2nc(C)cc(C)n2)/C#N 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 C03 compound treatment 0.072 0.00219 0.56 0.075 0.003 0.84 0.989 0.9816 1199477 Maybridge4_002159 CN(C1CCS(=O)(=O)C1)C(=O)COc2ccc(Oc3ccccc3)cc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 C04 compound treatment 0.125 0.0552 14.21 0.125 0.053 14.76 20.4844 0.9998 3178343 Maybridge4_002160 CSc1c(C#N)c(nn1C(=O)C(C)(C)C)c2cccs2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 C05 compound treatment 0.071 0.00119 0.31 0.074 0.002 0.56 0.61 0.9601 3063778 Maybridge4_002161 CS/C(=N/C(=N)Nc1ccc(Cl)cc1)/N 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 C06 compound treatment 0.127 0.0572 14.72 0.137 0.065 18.1 23.2116 0.9947 3178344 Maybridge4_002162 Cc1c(csc1C(=O)Nc2ccc(F)cc2F)S(=O)(=O)c3ccc(Cl)cc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 C07 compound treatment 0.089 0.0192 4.94 0.091 0.019 5.29 7.2348 0.9994 1368486 Maybridge4_002163 OC(=O)c1ccccc1SCC(=O)c2ccc(Cl)cc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 C08 compound treatment 0.078 0.00819 2.11 0.077 0.005 1.39 2.4752 0.9797 3178345 Maybridge4_002164 CNC(=S)Nc1cscc1S(=O)(=O)c2ccc(Cl)cc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 C09 compound treatment 0.153 0.0832 21.42 0.143 0.071 19.77 29.1267 0.9992 3063810 Maybridge4_002165 Clc1cccc(NC(=S)NC(C#N)c2ccccc2)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 C10 compound treatment 1.207 1.14 292.79 1.207 1.14 316.09 430.5446 0.9993 3178346 Maybridge4_002166 CN(C)/C=C/C(=O)c1cnc2cc(C)nn2c1C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 C11 compound treatment 0.089 0.0192 4.94 0.091 0.019 5.29 7.2348 0.9994 1175106 Maybridge4_002167 Cc1c(nnc2cc(nn12)c3ccccc3)C(=O)N 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 C12 compound treatment 0.079 0.00919 2.37 0.078 0.006 1.67 2.8542 0.9855 3178347 Maybridge4_002168 COC(=O)c1scc(c1n2cccc2)S(=O)(=O)C(C)(C)C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 C13 compound treatment 0.089 0.0192 4.94 0.093 0.021 5.85 7.6287 0.9965 1474680 Maybridge4_002169 NC1=C(C#N)C(C(=C(O1)C2CC2)C#N)c3ccccc3Cl 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 C14 compound treatment 0.072 0.00219 0.56 0.077 0.005 1.39 1.3829 0.9207 1123050 Maybridge4_002170 CC(C)S(=O)(=O)c1cscc1NC(=O)Nc2ccccc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 C15 compound treatment 0.072 0.00219 0.56 0.076 0.004 1.11 1.186 0.9501 1443948 Maybridge4_002171 O=c1c2CSCc2[nH]c3cc(nn13)c4ccco4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 C16 compound treatment 0.104 0.0342 8.8 0.105 0.033 9.19 12.7227 0.9998 3063812 Maybridge4_002172 CC(C)S(=O)(=O)c1csc(NC(=O)Nc2cc(cc(c2)C(F)(F)F)C(F)(F)F)c1Cl 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 C17 compound treatment 0.073 0.00319 0.82 0.077 0.005 1.39 1.5649 0.9682 1153510 Maybridge4_002173 COc1c(Cl)scc1NC(=O)N2CC(C)OC(C)C2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 C18 compound treatment 0.091 0.0212 5.46 0.095 0.023 6.41 8.3866 0.9968 3063813 Maybridge4_002174 CS(=O)(=O)c1scc(c1C#N)c2cccs2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 C19 compound treatment 0.07 1.88E-4 0.05 0.073 0.001 0.28 0.2311 0.8175 3178348 Maybridge4_002175 CC(C)(C)c1ccc(cc1)c2n[nH]c(c2C#N)S(=O)(=O)C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 C20 compound treatment 0.117 0.0472 12.15 0.125 0.053 14.76 19.0279 0.9953 3178349 Maybridge4_002176 Cn1nc(cc1C(F)(F)F)c2ccc(s2)C(=O)Nc3ccc(Cl)cc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 C21 compound treatment 0.152 0.0822 21.16 0.162 0.09 25.06 32.6862 0.9965 3063814 Maybridge4_002177 COC(=O)c1sc(SC)c(C#N)c1c2ccco2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 C22 compound treatment 0.098 0.0282 7.26 0.1 0.028 7.8 10.6457 0.9994 3178350 Maybridge4_002178 CCN(CCS(=O)(=O)c1ccc(C)cc1)C(=O)c2ccc(s2)c3cc(nn3C)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 C23 mock treatment 0.069 -8.12E-4 -0.21 0.072 0.0 0.0 -0.1479 -0.7071 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 C24 positive control 0.077 0.00719 1.85 0.079 0.007 1.95 2.687 0.9997 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 D01 compound treatment 0.077 0.00719 1.85 0.08 0.008 2.23 2.8839 0.9957 3063815 Maybridge4_002179 Nc1nc(ncc1S(=O)(=O)Cc2ccco2)c3ccncc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 D02 compound treatment 0.073 0.00319 0.82 0.075 0.003 0.84 1.1711 1.0 3063818 Maybridge4_002180 CC(C)(C)S(=O)(=O)c1cnc(nc1N)c2cnccn2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 D03 compound treatment 0.118 0.0482 12.41 0.121 0.049 13.65 18.4223 0.9989 3178351 Maybridge4_002181 Cc1csc2sc(COC(=O)Nc3ccccc3)c(C)c12 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 D04 compound treatment 0.075 0.00519 1.34 0.081 0.009 2.51 2.7168 0.9566 3178352 Maybridge4_002182 CSc1sc(C(=O)NN)c2CCCC3(SCCS3)c12 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 D05 compound treatment 0.073 0.00319 0.82 0.078 0.006 1.67 1.7619 0.9464 3063851 Maybridge4_002183 CCOC(=O)c1sc(c2/C(=N\O)/CC(C)(C)Cc12)S(=O)(=O)C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 D06 compound treatment 0.097 0.0272 7.0 0.101 0.029 8.08 10.6605 0.9975 3178353 Maybridge4_002184 Cc1ccc(cc1)S(=O)(=O)CCSc2sc(C#N)c3CC(C)(C)CC(=O)c23 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 D07 compound treatment 0.078 0.00819 2.11 0.078 0.006 1.67 2.6722 0.9934 1145089 Maybridge4_002185 CSc1sc(C(=O)O)c-2c1S(=O)(=O)N(C)c3ccccc23 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 D08 compound treatment 0.115 0.0452 11.63 0.116 0.044 12.25 16.8915 0.9997 3178354 Maybridge4_002186 FC(F)(F)c1cccc(c1)C(=O)C(=C2SCCCCS2)C#N 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 D09 compound treatment 0.09 0.0202 5.2 0.093 0.021 5.85 7.8107 0.9983 3063853 Maybridge4_002187 Cn1nc(cc1C(F)(F)F)c2ccc(s2)S(=O)(=O)NCc3cccs3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 D10 compound treatment 0.122 0.0522 13.44 0.134 0.062 17.27 21.7105 0.9923 3178355 Maybridge4_002188 CC1(C)CCc2cc(ccc2O1)c3ccn(n3)S(=O)(=O)c4cccc(c4)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 D11 compound treatment 0.105 0.0352 9.06 0.109 0.037 10.3 13.6924 0.9979 3063854 Maybridge4_002189 CSc1sc(cc1S(=O)(=O)C(C)C)C(=O)Sc2ccccc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 D12 compound treatment 0.507 0.437 112.56 0.499 0.427 118.92 163.6807 0.9996 3178356 Maybridge4_002190 CC1(C)CCc2cc(ccc2O1)c3ccnc(S)n3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 D13 compound treatment 0.14 0.0702 18.07 0.141 0.069 19.22 26.3661 0.9995 3063856 Maybridge4_002191 Cc1c(Br)sc2sc(c(C)c12)c3nn(C)cc3Br 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 D14 compound treatment 0.12 0.0502 12.92 0.13 0.058 16.15 20.5587 0.9939 3178357 Maybridge4_002192 CSc1sc(Cl)c2CC(C)(C)C/C(=N/O)/c12 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 D15 compound treatment 0.084 0.0142 3.65 0.087 0.015 4.18 5.5368 0.9978 3178358 Maybridge4_002193 CC(C)NC(=O)CSc1nccc(n1)c2sc3sc(Br)c(C)c3c2C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 D16 compound treatment 0.672 0.602 155.05 0.658 0.586 163.2 225.0314 0.9997 3063857 Maybridge4_002194 Sc1nccc(n1)c2ccc3OCCc3c2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 D17 compound treatment 0.073 0.00319 0.82 0.075 0.003 0.84 1.1711 1.0 3063858 Maybridge4_002195 COc1ccc(CSc2nnc(CSc3cccs3)n2C)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 D18 compound treatment 0.072 0.00219 0.56 0.072 0.0 0.0 0.3983 0.7071 3178359 Maybridge4_002196 CS(=O)(=NS(=O)(=O)c1cccc2nsnc12)c3ccc(Cl)cc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 D19 compound treatment 0.1 0.0302 7.77 0.103 0.031 8.63 11.6006 0.9986 3178360 Maybridge4_002197 Cc1cc2ncc(c(C)n2n1)c3ccnc(SCCS(=O)(=O)c4ccccc4)n3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 D20 compound treatment 0.085 0.0152 3.91 0.091 0.019 5.29 6.5066 0.9889 3063859 Maybridge4_002198 CC(C)C1Oc2c(cccc2N(CC(=O)O)C1=S)C(C)C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 D21 compound treatment 0.075 0.00519 1.34 0.079 0.007 1.95 2.3229 0.983 3178361 Maybridge4_002199 CSc1nc(nc(c1C#N)c2ccc(OC(F)(F)F)cc2)c3cccnc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 D22 compound treatment 0.211 0.141 36.35 0.22 0.148 41.22 54.8493 0.998 1139728 Maybridge4_002200 CCOC(=O)CC1Sc2ccccc2N=C1SCCS(=O)(=O)c3ccc(Cl)cc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 D23 mock treatment 0.069 -8.12E-4 -0.21 0.073 0.001 0.28 0.049 0.1407 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 D24 positive control 0.077 0.00719 1.85 0.079 0.007 1.95 2.687 0.9997 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 E01 compound treatment 0.077 0.00719 1.85 0.083 0.011 3.06 3.4747 0.9709 1149948 Maybridge4_002201 Clc1ccc(cc1)N2CCN(CC2)C3=Cc4ccccc4C3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 E02 compound treatment 0.078 0.00819 2.11 0.084 0.012 3.34 3.8537 0.9753 3178362 Maybridge4_002202 COC(=O)c1ccccc1S(=O)(=O)/C(=C/Nc2nc(SC)nc(n2)C3CC3)/C#N 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 E03 compound treatment 0.082 0.0122 3.14 0.084 0.012 3.34 4.5819 0.9995 3063320 Maybridge4_002203 CSc1nc(N)n(n1)c2cc(Cl)cc(Cl)c2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 E04 compound treatment 0.173 0.103 26.57 0.178 0.106 29.52 39.6602 0.9986 3178363 Maybridge4_002204 CSc1n[nH]c(NC(=O)c2ccccc2Cl)c1S(=O)(=O)c3ccc(Cl)cc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 E05 compound treatment 0.079 0.00919 2.37 0.083 0.011 3.06 3.8388 0.9918 1032087 Maybridge4_002205 Oc1ccnc(SCc2ccc(Cl)cc2)n1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 E06 compound treatment 0.096 0.0262 6.74 0.106 0.034 9.47 11.4631 0.9862 3178364 Maybridge4_002206 CN1c2ccccc2C(=O)/C(=C\Nc3ncccn3)/S1(=O)=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 E07 compound treatment 0.072 0.00219 0.56 0.073 0.001 0.28 0.5952 0.9473 3063324 Maybridge4_002207 CCN(CCC#N)C(=S)Nc1cc(cc(c1)C(F)(F)F)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 E08 compound treatment 0.073 0.00319 0.82 0.076 0.004 1.11 1.368 0.9887 1520456 Maybridge4_002208 CCOC(=O)NS(=O)(=O)c1ccccc1Cl 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 E09 compound treatment 0.166 0.0962 24.77 0.171 0.099 27.57 37.0073 0.9986 1248613 Maybridge4_002209 O=c1cc([nH]c2cc(nn12)c3ccccc3)c4ccccc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 E10 compound treatment 0.068 -0.00181 -0.47 0.071 -0.001 -0.28 -0.5269 -0.9696 3178365 Maybridge4_002210 Cc1cccc(c1)c2n[nH]c(c2C#N)S(=O)(=O)C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 E11 compound treatment 0.124 0.0542 13.95 0.133 0.061 16.99 21.8777 0.9952 1374930 Maybridge4_002211 COc1cccc(c1)c2c(nnc3cc(nn23)c4ccccc4)C(=O)N 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 E12 compound treatment 0.137 0.0672 17.3 0.129 0.057 15.87 23.4568 0.9991 1289071 Maybridge4_002212 Clc1ccc(cc1)S(=O)(=O)CCSc2ccccc2NC(=O)c3ccccc3Cl 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 E13 compound treatment 0.142 0.0722 18.59 0.142 0.07 19.49 26.9271 0.9997 1391332 Maybridge4_002213 COc1ccc(cc1)C2C(=C(N)OC(=C2C#N)C3CC3)C#N 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 E14 compound treatment 0.068 -0.00181 -0.47 0.075 0.003 0.84 0.2608 0.2725 3063326 Maybridge4_002214 Cc1nccc(n1)c2cccc(NS(=O)(=O)c3ccccc3C(F)(F)F)c2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 E15 compound treatment 0.069 -8.12E-4 -0.21 0.071 -0.001 -0.28 -0.3448 -0.9901 3178456 Maybridge4_002215 Cn1nc(cc1N)C(C)(C)C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 E16 compound treatment 0.072 0.00219 0.56 0.075 0.003 0.84 0.989 0.9816 1540260 Maybridge4_002216 CC(C)S(=O)(=O)c1csc(NC(=O)N2CCCCC2)c1Cl 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 E17 compound treatment 0.1 0.0302 7.77 0.099 0.027 7.52 10.8129 0.9999 1698879 Maybridge4_002217 Nc1nc(ncc1S(=O)(=O)c2ccc(Cl)cc2)N3CCOCC3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 E18 compound treatment 0.112 0.0422 10.86 0.11 0.038 10.58 15.1637 0.9999 1598720 Maybridge4_002218 Clc1ccc(cc1)c2csc(S(=O)C3CCCCC3)c2C#N 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 E19 compound treatment 0.087 0.0172 4.43 0.086 0.014 3.9 5.8861 0.998 1438402 Maybridge4_002219 O=C(c1ccccc1)c2cnc3ccccn3c2=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 E20 compound treatment 0.112 0.0422 10.86 0.124 0.052 14.48 17.9207 0.99 3178457 Maybridge4_002220 CN(C)c1scc(c1C#N)c2ccc(Cl)cc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 E21 compound treatment 0.101 0.0312 8.03 0.103 0.031 8.63 11.7826 0.9993 3178458 Maybridge4_002221 Cc1ccc(cc1)S(=O)(=O)/C(=C/Nc2cc(cc(c2)C(F)(F)F)C(F)(F)F)/C#N 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 E22 compound treatment 0.134 0.0642 16.53 0.132 0.06 16.71 23.5014 1.0 1367919 Maybridge4_002222 O=S(=O)(Cc1ccco1)Cc2nc(cs2)c3ccc(cc3)c4ccccc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 E23 mock treatment 0.069 -8.12E-4 -0.21 0.071 -0.001 -0.28 -0.3448 -0.9901 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 E24 positive control 0.081 0.0112 2.88 0.078 0.006 1.67 3.2183 0.9665 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 F01 compound treatment 0.106 0.0362 9.32 0.106 0.034 9.47 13.2837 1.0 3063357 Maybridge4_002223 CNC(=O)c1cc(C#N)c(SC)s1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 F02 compound treatment 0.083 0.0132 3.4 0.083 0.011 3.06 4.5671 0.9987 3178459 Maybridge4_002224 CSc1scc2CCc3cnc(SCC(=O)c4ccc(Cl)cc4)nc3-c12 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 F03 compound treatment 0.183 0.113 29.14 0.189 0.117 32.58 43.647 0.9984 3063358 Maybridge4_002225 Cc1csc2sc(C(=O)Oc3ccc(Cl)cc3)c(C)c12 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 F04 compound treatment 0.083 0.0132 3.4 0.087 0.015 4.18 5.3548 0.9947 3178460 Maybridge4_002226 Nc1nc(ncc1S(=O)(=O)c2ccc(cn2)C(F)(F)F)N3CCCC3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 F05 compound treatment 0.079 0.00919 2.37 0.082 0.01 2.78 3.6419 0.9967 3063359 Maybridge4_002227 CSc1sc(cc1c2nc(C)cs2)C(=O)NN 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 F06 compound treatment 0.148 0.0782 20.13 0.147 0.075 20.89 29.0041 0.9998 3178461 Maybridge4_002228 CC(C)S(=O)(=O)c1cscc1NC(=O)c2ccc(s2)c3cc(nn3C)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 F07 compound treatment 0.113 0.0432 11.12 0.118 0.046 12.81 16.9212 0.9975 1693988 Maybridge4_002229 CS(=O)(=O)c1sc(C(=O)Nc2ccccc2Cl)c3CCC=Cc13 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 F08 compound treatment 0.167 0.0972 25.02 0.165 0.093 25.9 36.0078 0.9999 3178462 Maybridge4_002230 CSc1sc(c2ccon2)c(c1C#N)c3ccco3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 F09 compound treatment 0.111 0.0412 10.6 0.121 0.049 13.65 17.1479 0.9922 3178463 Maybridge4_002231 CC1(C)CC(=O)C=C(SCC(=O)Nc2cc(cc(c2)C(F)(F)F)C(F)(F)F)S1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 F10 compound treatment 0.071 0.00119 0.31 0.075 0.003 0.84 0.807 0.907 3063360 Maybridge4_002232 FC(F)(F)c1ccc(nc1)S(=O)(=O)Cc2ccccc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 F11 compound treatment 0.071 0.00119 0.31 0.076 0.004 1.11 1.0039 0.869 3178464 Maybridge4_002233 CS(=O)(=NS(=O)(=O)c1ccc(s1)c2ccccn2)c3ccc(Cl)cc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 F12 compound treatment 0.082 0.0122 3.14 0.083 0.011 3.06 4.385 0.9999 3063362 Maybridge4_002234 C/S(=N\C(=O)Nc1ccc(Cl)cc1)/c2sc(Cl)c3CCCC(=O)c23 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 F13 compound treatment 0.084 0.0142 3.65 0.08 0.008 2.23 4.1584 0.9719 3178465 Maybridge4_002235 CS(=O)(=NC(=S)NC(=O)Oc1ccccc1)c2ccccc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 F14 compound treatment 0.069 -8.12E-4 -0.21 0.077 0.005 1.39 0.8367 0.5942 3063392 Maybridge4_002236 FC(F)(F)c1cnc(N2CCS(=NC(=O)c3ccccc3)CC2)c(Cl)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 F15 compound treatment 0.153 0.0832 21.42 0.162 0.09 25.06 32.8682 0.9969 3178466 Maybridge4_002237 Cc1c(Br)sc2sc(c(C)c12)c3ccnc(SCC(=O)NCC=C)n3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 F16 compound treatment 0.15 0.0802 20.65 0.16 0.088 24.51 31.9282 0.9964 1201268 Maybridge4_002238 C(Sc1nccc(n1)c2ccc3OCCc3c2)c4ccccc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 F17 compound treatment 0.113 0.0432 11.12 0.112 0.04 11.14 15.7397 1.0 1378146 Maybridge4_002239 CS(=O)(=O)c1sc(NC(=O)Nc2ccc(Cl)cc2)c3CCC=Cc13 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 F18 compound treatment 0.09 0.0202 5.2 0.094 0.022 6.13 8.0077 0.9967 1406686 Maybridge4_002240 Cc1nn(Cc2cccc(c2)C(=O)NC(=O)Nc3ccc(Cl)cc3)c(C)c1Br 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 F19 compound treatment 0.108 0.0382 9.83 0.109 0.037 10.3 14.2386 0.9997 1721379 Maybridge4_002241 O=S(=O)(N1CCCCC1)c2ccc(s2)S(=O)(=O)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 F20 compound treatment 0.169 0.0992 25.54 0.171 0.099 27.57 37.5535 0.9993 3063394 Maybridge4_002242 CN(C)/C=C\1/C(=O)c2sccc2N(C)S1(=O)=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 F21 compound treatment 0.183 0.113 29.14 0.179 0.107 29.8 41.6777 0.9999 3178467 Maybridge4_002243 CSc1sc(c(C)c1c2ccnc(S)n2)c3nc(C)cs3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 F22 compound treatment 0.088 0.0182 4.68 0.093 0.021 5.85 7.4466 0.9939 1422989 Maybridge4_002244 Clc1ccc(OC(=O)c2csc(n2)C3COc4ccccc4O3)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 F23 mock treatment 0.069 -8.12E-4 -0.21 0.071 -0.001 -0.28 -0.3448 -0.9901 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 F24 positive control 0.079 0.00919 2.37 0.078 0.006 1.67 2.8542 0.9855 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 G01 compound treatment 0.114 0.0442 11.38 0.117 0.045 12.53 16.9063 0.9988 1651892 Maybridge4_002245 CCCCC1(Cc2ccccc2)C(=O)Nc3ccccc3C1=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 G02 compound treatment 0.09 0.0202 5.2 0.096 0.024 6.68 8.4015 0.9923 3178468 Maybridge4_002246 CSc1nc(N/C=C(\C#N)/S(=O)(=O)c2ccccc2Cl)nc(n1)C3CC3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 G03 compound treatment 0.532 0.462 119.0 0.513 0.441 122.82 170.9891 0.9999 3063398 Maybridge4_002247 CC(=N)NC(=S)Nc1ccc(Cl)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 G04 compound treatment 0.079 0.00919 2.37 0.081 0.009 2.51 3.445 0.9996 3178469 Maybridge4_002248 CSc1n[nH]c(NC(=O)Nc2ccccc2)c1S(=O)(=O)c3ccc(Cl)cc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 G05 compound treatment 0.078 0.00819 2.11 0.079 0.007 1.95 2.8691 0.9992 3063400 Maybridge4_002249 CN(C)C(=O)Oc1ccnc(SCc2c(F)cccc2Cl)n1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 G06 compound treatment 0.212 0.142 36.61 0.218 0.146 40.66 54.6375 0.9986 3178470 Maybridge4_002250 COc1ccc(cc1)c2n[nH]c(SC)c2C#N 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 G07 compound treatment 0.089 0.0192 4.94 0.092 0.02 5.57 7.4317 0.9982 3063401 Maybridge4_002251 Cc1ccc(COc2ccc(I)cc2)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 G08 compound treatment 0.166 0.0962 24.77 0.162 0.09 25.06 35.235 1.0 3178471 Maybridge4_002252 CSc1sc(C(=O)Nc2cccc(Cl)c2)c(c1C#N)c3cccs3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 G09 compound treatment 0.071 0.00119 0.31 0.074 0.002 0.56 0.61 0.9601 1687124 Maybridge4_002253 CCN(CCS(=O)(=O)c1ccccc1)S(=O)(=O)c2ccc(C)cc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 G10 compound treatment 0.072 0.00219 0.56 0.075 0.003 0.84 0.989 0.9816 3178472 Maybridge4_002254 COC(=O)c1scc(c1N)S(=O)(=O)C(C)(C)C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 G11 compound treatment 0.174 0.104 26.83 0.169 0.097 27.01 38.0699 1.0 1226475 Maybridge4_002255 NC(=O)c1nnc2cc(nn2c1N)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 G12 compound treatment 0.087 0.0172 4.43 0.088 0.016 4.46 6.2799 1.0 1452741 Maybridge4_002256 Clc1ccc(cc1)S(=O)(=O)CCSc2ccccc2NC(=O)Nc3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 G13 compound treatment 0.348 0.278 71.62 0.367 0.295 82.16 108.7393 0.9977 3063431 Maybridge4_002257 Fc1cccc(Cl)c1CN/C(=C(\N=C\c2cccs2)/C#N)/C#N 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 G14 compound treatment 0.071 0.00119 0.31 0.076 0.004 1.11 1.0039 0.869 3178473 Maybridge4_002258 Clc1cccc(Cl)c1CSc2cccs2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 G15 compound treatment 0.191 0.121 31.2 0.196 0.124 34.53 46.4819 0.9987 3178474 Maybridge4_002259 COc1ccc(/C=C(\C#N)/S(=O)(=O)c2ccc(Cl)cc2)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 G16 compound treatment 0.162 0.0922 23.74 0.158 0.086 23.95 33.7191 1.0 1133071 Maybridge4_002260 CNC(=O)Nc1ccccc1NC2=C(CSC2)C(=O)OC 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 G17 compound treatment 0.072 0.00219 0.56 0.074 0.002 0.56 0.7921 1.0 3178475 Maybridge4_002261 CC1CN(CC(C)O1)/C=C(\C#N)/S(=O)(=O)c2ccc(Br)cc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 G18 compound treatment 0.072 0.00219 0.56 0.073 0.001 0.28 0.5952 0.9473 3063432 Maybridge4_002262 CS(=O)(=NS(=O)(=O)c1ccccc1C(F)(F)F)c2ccc(Cl)cc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 G19 compound treatment 0.102 0.0322 8.29 0.105 0.033 9.19 12.3585 0.9987 1259331 Maybridge4_002263 COCc1cc(O)nc2n(C)nc(c3cccs3)c12 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 G20 compound treatment 0.067 -0.00281 -0.72 0.071 -0.001 -0.28 -0.709 -0.9138 3063433 Maybridge4_002264 CS/C(=C(/C#N)\S(=O)(=O)C(C)C)/N1CCCC1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 G21 compound treatment 0.069 -8.12E-4 -0.21 0.072 0.0 0.0 -0.1479 -0.7071 3178476 Maybridge4_002265 CSc1c(C#N)c(nn1CC(=O)NN)c2ccccc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 G22 compound treatment 0.068 -0.00181 -0.47 0.07 -0.002 -0.56 -0.7238 -0.9961 3063434 Maybridge4_002266 Cc1onc(c1C(=O)N=S(=O)(C)C)c2c(Cl)cccc2Cl 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 G23 mock treatment 0.07 1.88E-4 0.05 0.072 0.0 0.0 0.0341 0.7071 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 G24 positive control 0.081 0.0112 2.88 0.079 0.007 1.95 3.4153 0.9819 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 H01 compound treatment 0.111 0.0412 10.6 0.13 0.058 16.15 18.9202 0.9792 3178477 Maybridge4_002267 CCOC(=O)c1sc(SCc2ccccc2)c(c1n3cccc3)S(=O)(=O)C(C)C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 H02 compound treatment 0.216 0.146 37.64 0.21 0.138 38.43 53.7903 0.9999 1259984 Maybridge4_002268 CSc1scc2CCc3cnc(SCC(=O)C(C)(C)C)nc3-c12 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 H03 compound treatment 0.071 0.00119 0.31 0.076 0.004 1.11 1.0039 0.869 3063436 Maybridge4_002269 CSc1sc(cc1S(=O)(=O)C(C)C)C(=O)NN 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 H04 compound treatment 0.115 0.0452 11.63 0.119 0.047 13.09 17.4822 0.9983 3178558 Maybridge4_002270 COC(=O)c1sc(SCCOC(=O)c2ccccc2Cl)c3C(=O)CC(C)(C)Cc13 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 H05 compound treatment 0.124 0.0542 13.95 0.127 0.055 15.32 20.6962 0.9989 3063438 Maybridge4_002271 CSc1sc(C#N)c(C)c1c2ccn(n2)C(=O)c3ccc(Cl)cc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 H06 compound treatment 0.332 0.262 67.51 0.344 0.272 75.75 101.2971 0.9983 3178559 Maybridge4_002272 CSc1sc(C(=O)/C=C/N(C)C)c(c1C#N)c2ccccc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 H07 compound treatment 0.085 0.0152 3.91 0.087 0.015 4.18 5.7189 0.9995 1222048 Maybridge4_002273 CS(=O)c1sc(C(=O)OCc2ccccc2)c3CC(C)(C)CC(=O)c13 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 H08 compound treatment 0.126 0.0562 14.47 0.129 0.057 15.87 21.4541 0.9989 3178560 Maybridge4_002274 CSc1sc(c2cc[nH]n2)c(c1C#N)c3ccco3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 H09 compound treatment 0.1 0.0302 7.77 0.101 0.029 8.08 11.2067 0.9998 3178561 Maybridge4_002275 CC1(C)CC(=O)C=C(SCc2c(Cl)cccc2Cl)S1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 H10 compound treatment 0.111 0.0412 10.6 0.115 0.043 11.98 15.9663 0.9982 1307156 Maybridge4_002276 CC1(C)CCc2cc(ccc2O1)c3ccn(n3)C(=O)c4ccc(Cl)cc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 H11 compound treatment 0.089 0.0192 4.94 0.1 0.028 7.8 9.0071 0.9757 3063440 Maybridge4_002277 CSc1nnc(c2ccc(s2)S(=O)(=O)n3nc(C)cc3C)n1C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 H12 compound treatment 0.099 0.0292 7.51 0.108 0.036 10.03 12.4031 0.9899 3178562 Maybridge4_002278 CCSc1nccc(n1)c2ccc3OC(C)(C)CCc3c2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 H13 compound treatment 0.116 0.0462 11.89 0.114 0.042 11.7 16.6797 1.0 3063442 Maybridge4_002279 Cc1csc2sc(c(C)c12)c3ccnc(SCc4ccccc4)n3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 H14 compound treatment 0.094 0.0242 6.23 0.099 0.027 7.52 9.7205 0.9956 3178563 Maybridge4_002280 CCOC(=O)c1sc(/S(=N/C(=O)Nc2ccccc2Cl)/C)c3C=CCCc13 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 H15 compound treatment 0.069 -8.12E-4 -0.21 0.073 0.001 0.28 0.049 0.1407 1505800 Maybridge4_002281 COC(=O)C(CC(C)C)NS(=O)(=O)c1ccc(s1)c2nnc(SC)n2C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 H16 compound treatment 0.074 0.00419 1.08 0.075 0.003 0.84 1.3531 0.9921 3178564 Maybridge4_002282 FC(F)(F)c1ccc(nc1)S(=O)(=O)CCSc2ncccc2C(=O)NCc3ccccn3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 H17 compound treatment 0.187 0.117 30.17 0.193 0.121 33.7 45.1629 0.9985 3178565 Maybridge4_002283 Clc1ccc(cc1)C2CC(=O)C=C(SCC(=O)c3ccccc3)S2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 H18 compound treatment 0.072 0.00219 0.56 0.075 0.003 0.84 0.989 0.9816 3063443 Maybridge4_002284 C/C(=N\O)/c1ccc2OCCc2c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 H19 compound treatment 0.078 0.00819 2.11 0.079 0.007 1.95 2.8691 0.9992 3063445 Maybridge4_002285 CC1(C)CC(=O)c2c(SCC(=O)NN)sc(C#N)c2C1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 H20 compound treatment 0.069 -8.12E-4 -0.21 0.071 -0.001 -0.28 -0.3448 -0.9901 1254429 Maybridge4_002286 Cc1nn(C)c2ncc(C(=O)N)c(Oc3cccnc3)c12 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 H21 compound treatment 0.204 0.134 34.55 0.206 0.134 37.32 50.8179 0.9993 3063446 Maybridge4_002287 CCOC(=O)c1sc(SC)c2c1CCCC32SCCS3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 H22 compound treatment 0.068 -0.00181 -0.47 0.07 -0.002 -0.56 -0.7238 -0.9961 1921420 Maybridge4_002288 OC(=O)/C=C/1\OC(=O)c2ccccc12 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 H23 mock treatment 0.069 -8.12E-4 -0.21 0.073 0.001 0.28 0.049 0.1407 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 H24 positive control 0.08 0.0102 2.62 0.079 0.007 1.95 3.2332 0.9893 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 I01 compound treatment 0.089 0.0192 4.94 0.095 0.023 6.41 8.0225 0.9918 3178566 Maybridge4_002289 Cc1ccc(cc1)C(=O)OC[C@H]2O[C@@H](C[C@@H]2OC(=O)c3ccc(C)cc3)c4nnc5ncccn45 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 I02 compound treatment 0.097 0.0272 7.0 0.099 0.027 7.52 10.2667 0.9994 3178567 Maybridge4_002290 FC(F)(F)c1cc(N/C=C(\C#N)/S(=O)(=O)Cc2ccc(Cl)cc2)cc(c1)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 I03 compound treatment 0.069 -8.12E-4 -0.21 0.074 0.002 0.56 0.2459 0.4133 3063447 Maybridge4_002291 CCOC(=O)c1c(C)noc1c2ccco2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 I04 compound treatment 0.126 0.0562 14.47 0.14 0.068 18.94 23.6203 0.9912 3064096 Maybridge4_002292 CSc1sc(NC(=O)N2CCOCC2)c(c1C#N)c3ccc(Cl)cc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 I05 compound treatment 0.08 0.0102 2.62 0.084 0.012 3.34 4.2178 0.9928 3064097 Maybridge4_002293 CCOC(=O)/C=C/1\NC(=O)CS1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 I06 compound treatment 0.093 0.0232 5.97 0.103 0.031 8.63 10.3262 0.9838 3064098 Maybridge4_002294 CSc1[nH]nc(c1C#N)c2cccc(Cl)c2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 I07 compound treatment 0.07 1.88E-4 0.05 0.073 0.001 0.28 0.2311 0.8175 3064099 Maybridge4_002295 Fc1ccc(NC(=S)N(CCC#N)CC2CCCO2)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 I08 compound treatment 0.071 0.00119 0.31 0.073 0.001 0.28 0.4131 0.9989 3064100 Maybridge4_002296 CSc1sc(C(=O)O)c(C)c1S(=O)(=O)c2ccc(Cl)cc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 I09 compound treatment 0.071 0.00119 0.31 0.071 -0.001 -0.28 0.0193 0.0466 1242964 Maybridge4_002297 Cc1nn(c(NC(=O)c2ccccc2)c1C#N)C(C)(C)C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 I10 compound treatment 0.073 0.00319 0.82 0.076 0.004 1.11 1.368 0.9887 3064101 Maybridge4_002298 CC(C)(C)S(=O)(=O)/C(=C/Nc1ccccn1)/C#N 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 I11 compound treatment 0.066 -0.00381 -0.98 0.07 -0.002 -0.56 -1.0879 -0.964 1003716 Maybridge4_002299 Cc1ccc(cc1)S(=O)(=O)C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 I12 compound treatment 0.075 0.00519 1.34 0.078 0.006 1.67 2.126 0.9938 3064102 Maybridge4_002300 COC(=O)c1scc(c1/N=C/N(C)C)S(=O)(=O)C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 I13 compound treatment 0.385 0.315 81.15 0.367 0.295 82.16 115.4754 1.0 3178568 Maybridge4_002301 COc1cccc(c1)C(=O)/C=c/2\[nH]c(=O)\c(=C/c3cccs3)\s2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 I14 compound treatment 0.122 0.0522 13.44 0.13 0.058 16.15 20.9228 0.9958 1621333 Maybridge4_002302 Cc1nccc(n1)c2cccc(NC(=O)Nc3ccccc3)c2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 I15 compound treatment 0.136 0.0662 17.04 0.138 0.066 18.38 25.047 0.9993 1156135 Maybridge4_002303 CC(C)(C)c1ccc(cc1)c2n[nH]c(NS(=O)(=O)c3ccccc3)c2Br 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 I16 compound treatment 0.181 0.111 28.63 0.181 0.109 30.36 41.7075 0.9996 3064103 Maybridge4_002304 COC(=O)c1sc(SC)c(C#N)c1c2cccc(Cl)c2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 I17 compound treatment 0.118 0.0482 12.41 0.121 0.049 13.65 18.4223 0.9989 1665125 Maybridge4_002305 O=C(Nc1ccccc1)Nc2ccc(cc2)C3SCCS3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 I18 compound treatment 0.072 0.00219 0.56 0.074 0.002 0.56 0.7921 1.0 3064104 Maybridge4_002306 O=S(=O)(C(=C1SCCCS1)C#N)c2cccs2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 I19 compound treatment 0.116 0.0462 11.89 0.118 0.046 12.81 17.4674 0.9993 3178569 Maybridge4_002307 CSc1nc2cc(C)nn2c(c1C#N)c3ccc(cc3)C(C)(C)C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 I20 compound treatment 0.068 -0.00181 -0.47 0.072 0.0 0.0 -0.33 -0.7071 3178570 Maybridge4_002308 Cc1ccc(cc1)S(=O)(=NC(=O)NC(=O)c2c(Cl)cccc2Cl)C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 I21 compound treatment 0.091 0.0212 5.46 0.093 0.021 5.85 7.9928 0.9994 3064105 Maybridge4_002309 CSc1nc(C)nc(N/C=C(\C#N)/S(=O)(=O)c2ccc(C)cc2)n1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 I22 compound treatment 0.068 -0.00181 -0.47 0.072 0.0 0.0 -0.33 -0.7071 1118314 Maybridge4_002310 NNC(=O)c1csc(CS(=O)(=O)Cc2ccco2)n1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 I23 mock treatment 0.069 -8.12E-4 -0.21 0.07 -0.002 -0.56 -0.5418 -0.9106 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 I24 positive control 0.078 0.00819 2.11 0.079 0.007 1.95 2.8691 0.9992 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 J01 compound treatment 0.129 0.0592 15.24 0.124 0.052 14.48 21.0157 0.9997 3064106 Maybridge4_002311 CSc1sc(c2n[nH]cc2Br)c3CC(C)(C)CC(=O)c13 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 J02 compound treatment 0.088 0.0182 4.68 0.102 0.03 8.35 9.2189 0.9625 3178571 Maybridge4_002312 CSc1scc2CCc3cnc(SCC(=O)NCC=C)nc3-c12 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 J03 compound treatment 0.11 0.0402 10.35 0.114 0.042 11.7 15.5873 0.9981 3064107 Maybridge4_002313 CSc1sc(C#N)c2CC(CC(=O)c12)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 J04 compound treatment 0.167 0.0972 25.02 0.168 0.096 26.74 36.5986 0.9995 3178572 Maybridge4_002314 NC(=S)c1cnn2c(cc(nc12)C(F)(F)F)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 J05 compound treatment 0.095 0.0252 6.49 0.101 0.029 8.08 10.2964 0.9941 3064108 Maybridge4_002315 COC(=O)c1sccc1N/C=C(\C#N)/S(=O)(=O)C(C)(C)C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 J06 compound treatment 0.087 0.0172 4.43 0.094 0.022 6.13 7.4615 0.9872 3178573 Maybridge4_002316 CCOC(=O)c1sc(SC)c-2c1CCc3conc32 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 J07 compound treatment 0.085 0.0152 3.91 0.089 0.017 4.73 6.1127 0.9955 3178574 Maybridge4_002317 Cc1nn(Cc2nnc(o2)c3cc(cc(c3)C(F)(F)F)C(F)(F)F)c(C)c1Br 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 J08 compound treatment 0.198 0.128 33.0 0.204 0.132 36.76 49.3317 0.9986 3064109 Maybridge4_002318 CCCS(=O)(=O)/C(=C/c1sccc1Oc2ccccc2)/C#N 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 J09 compound treatment 0.073 0.00319 0.82 0.073 0.001 0.28 0.7772 0.8968 3178575 Maybridge4_002319 Cc1ccc(cc1)S(=O)(=O)CCSC2=CC(=O)CC(C)(C)S2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 J10 compound treatment 0.09 0.0202 5.2 0.095 0.023 6.41 8.2046 0.9946 3064110 Maybridge4_002320 Clc1ccc(cc1)c2ccnc(SCCS(=O)(=O)c3ccc(Cl)cc3)n2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 J11 compound treatment 0.25 0.18 46.39 0.248 0.176 49.01 67.4635 0.9996 3178576 Maybridge4_002321 CSc1sc(C(=O)Sc2ccccc2)c-3c1S(=O)(=O)N(C)c4ccccc34 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 J12 compound treatment 0.079 0.00919 2.37 0.083 0.011 3.06 3.8388 0.9918 1454764 Maybridge4_002322 CCOC(=O)C1=C(Nc2ccc(OC(=O)C)cc2)C(=O)N(C1)C(C)(C)C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 J13 compound treatment 0.204 0.134 34.55 0.215 0.143 39.82 52.5903 0.9975 3178577 Maybridge4_002323 Cc1csc2sc(c(C)c12)c3ccnc(SCC(=O)c4ccccc4)n3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 J14 compound treatment 0.069 -8.12E-4 -0.21 0.073 0.001 0.28 0.049 0.1407 3178578 Maybridge4_002324 CCOC(=O)c1sc(/S(=N/S(=O)(=O)c2cccc(Cl)c2)/C)c3C=CCCc13 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 J15 compound treatment 0.07 1.88E-4 0.05 0.072 0.0 0.0 0.0341 0.7071 3064111 Maybridge4_002325 COc1cccc(NC(=S)N=S(=O)(C)c2ccccc2)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 J16 compound treatment 0.07 1.88E-4 0.05 0.075 0.003 0.84 0.6249 0.7467 3178579 Maybridge4_002326 CCCCc1ccc(NC(=O)N=S2CCN(CC2)c3ncc(cc3Cl)C(F)(F)F)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 J17 compound treatment 0.117 0.0472 12.15 0.118 0.046 12.81 17.6494 0.9996 3064112 Maybridge4_002327 Cc1nn(Cc2nnc(SCc3c(Cl)cccc3Cl)o2)c(C)c1Br 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 J18 compound treatment 0.14 0.0702 18.07 0.138 0.066 18.38 25.7753 1.0 3178580 Maybridge4_002328 C/S(=N/C(=O)Nc1ccc(Cl)cc1)/c2ccc(OC(=O)c3ccc(Cl)cc3)cc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 J19 compound treatment 0.111 0.0412 10.6 0.111 0.039 10.86 15.1786 0.9999 3064113 Maybridge4_002329 CS(=O)(=NS(=O)(=O)c1cc(cs1)S(=O)(=O)c2ccccc2)c3ccc(Cl)cc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 J20 compound treatment 0.193 0.123 31.72 0.192 0.12 33.42 46.0583 0.9997 1183286 Maybridge4_002330 CN1c2ccsc2-c3nc(SCc4ccc(Cl)cc4)ncc3S1(=O)=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 J21 compound treatment 0.092 0.0222 5.71 0.096 0.024 6.68 8.7656 0.9969 3064114 Maybridge4_002331 FC(F)(F)Oc1ccc(cc1)S(=O)(=O)CCSc2ccc(cn2)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 J22 compound treatment 0.08 0.0102 2.62 0.086 0.014 3.9 4.6117 0.9814 3178581 Maybridge4_002332 O=C(CCN1CCC(=N1)c2cccs2)c3cccs3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 J23 mock treatment 0.07 1.88E-4 0.05 0.071 -0.001 -0.28 -0.1628 -0.5759 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 J24 positive control 0.077 0.00719 1.85 0.08 0.008 2.23 2.8839 0.9957 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 K01 compound treatment 0.074 0.00419 1.08 0.085 0.013 3.62 3.3224 0.8795 3064115 Maybridge4_002333 C/C(=C\C#N)/Nc1c(C)n(C)n(c2ccccc2)c1=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 K02 compound treatment 0.069 -8.12E-4 -0.21 0.075 0.003 0.84 0.4429 0.5142 3178657 Maybridge4_002334 CSc1sc(C(=O)O)c(c1C#N)c2cccs2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 K03 compound treatment 0.231 0.161 41.5 0.231 0.159 44.28 60.6566 0.9995 1629094 Maybridge4_002335 NC(=S)NN1C2CSC1CS2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 K04 compound treatment 0.073 0.00319 0.82 0.075 0.003 0.84 1.1711 1.0 3178658 Maybridge4_002336 CSc1c(C#N)c(nn1C(=O)c2cccs2)c3ccc(Cl)cc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 K05 compound treatment 0.071 0.00119 0.31 0.075 0.003 0.84 0.807 0.907 3178659 Maybridge4_002337 FC(F)(F)c1cccc(c1)S(=O)(=O)N2CCCN3C2c4ccccc4C3=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 K06 compound treatment 0.071 0.00119 0.31 0.072 0.0 0.0 0.2162 0.7071 3064116 Maybridge4_002338 CSc1nc(/N=C/N(C)C)n2nc(cc2n1)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 K07 compound treatment 0.068 -0.00181 -0.47 0.074 0.002 0.56 0.0639 0.0879 3178660 Maybridge4_002339 CN(CCC#N)C(=S)Nc1ccc(F)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 K08 compound treatment 0.071 0.00119 0.31 0.074 0.002 0.56 0.61 0.9601 3064117 Maybridge4_002340 COC(=O)c1scc(C#N)c1/N=C/N(C)C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 K09 compound treatment 0.071 0.00119 0.31 0.07 -0.002 -0.56 -0.1777 -0.2796 1197958 Maybridge4_002341 CCN(CCS(=O)(=O)c1ccc(Cl)cc1)C(=O)Nc2ccc(Cl)cc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 K10 compound treatment 0.095 0.0252 6.49 0.095 0.023 6.41 9.1149 1.0 1372972 Maybridge4_002342 COc1ncccc1C(=O)Nc2ccc(F)cc2F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 K11 compound treatment 0.067 -0.00281 -0.72 0.071 -0.001 -0.28 -0.709 -0.9138 3178661 Maybridge4_002343 CC(=O)Nc1c(Br)c(nn1c2ccccc2)C3CC3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 K12 compound treatment 0.072 0.00219 0.56 0.076 0.004 1.11 1.186 0.9501 3064118 Maybridge4_002344 O=S(=O)(/C(=C/c1ccc(\C=C(/C#N)\S(=O)(=O)c2ccccc2)cc1)/C#N)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 K13 compound treatment 0.07 1.88E-4 0.05 0.074 0.002 0.56 0.428 0.7655 3178662 Maybridge4_002345 Oc1c2CN(C3CCCCC3)C(=O)c2nc4cc(nn14)c5ccccc5 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 K14 compound treatment 0.075 0.00519 1.34 0.078 0.006 1.67 2.126 0.9938 1503351 Maybridge4_002346 CNC(=O)Nc1cccc(c1)c2ccnc(C)n2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 K15 compound treatment 0.14 0.0702 18.07 0.138 0.066 18.38 25.7753 1.0 3178663 Maybridge4_002347 Clc1ccc(cc1)S(=O)(=O)/C(=C/c2ccccc2Cl)/C#N 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 K16 compound treatment 0.068 -0.00181 -0.47 0.074 0.002 0.56 0.0639 0.0879 1326810 Maybridge4_002348 CC(C)S(=O)(=O)c1cnc(nc1N)N2CCOCC2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 K17 compound treatment 0.077 0.00719 1.85 0.084 0.012 3.34 3.6716 0.9611 3064119 Maybridge4_002349 CNC(=O)Nc1ccc(cc1)C2SCCS2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 K18 compound treatment 0.142 0.0722 18.59 0.141 0.069 19.22 26.7302 0.9999 1218060 Maybridge4_002350 CCOC(=O)c1cnc2c(csc2c1Sc3ccc(Cl)cc3)S(=O)(=O)C(C)C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 K19 compound treatment 0.1 0.0302 7.77 0.101 0.029 8.08 11.2067 0.9998 3064120 Maybridge4_002351 CSc1nc2cc(C)nn2c(c3ccco3)c1C#N 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 K20 compound treatment 0.155 0.0852 21.93 0.158 0.086 23.95 32.4447 0.999 1209169 Maybridge4_002352 CS(=O)N(C(=O)c1scc(c1C)S(=O)(=O)c2ccc(Cl)cc2)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 K21 compound treatment 0.069 -8.12E-4 -0.21 0.072 0.0 0.0 -0.1479 -0.7071 1134325 Maybridge4_002353 COCc1cc(OC(=O)N(C)C)nc2n(C)nc(c3cccs3)c12 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 K22 compound treatment 0.122 0.0522 13.44 0.12 0.048 13.37 18.9536 1.0 1310626 Maybridge4_002354 CCOC(=O)CSc1sc(C(=O)OCC)c-2c1S(=O)(=O)N(C)c3ccccc23 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 K23 mock treatment 0.071 0.00119 0.31 0.072 0.0 0.0 0.2162 0.7071 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 K24 positive control 0.078 0.00819 2.11 0.081 0.009 2.51 3.2629 0.9963 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 L01 compound treatment 0.152 0.0822 21.16 0.162 0.09 25.06 32.6862 0.9965 3064121 Maybridge4_002355 CSc1sc(c2ccn(n2)C(=O)Nc3ccccc3)c4CC(C)(C)CC(=O)c14 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 L02 compound treatment 0.101 0.0312 8.03 0.105 0.033 9.19 12.1765 0.9977 3178664 Maybridge4_002356 CS(=O)(=N/C=C(\C#N)/S(=O)(=O)c1ccc(cn1)C(F)(F)F)c2ccc(Cl)cc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 L03 compound treatment 0.073 0.00319 0.82 0.078 0.006 1.67 1.7619 0.9464 3064122 Maybridge4_002357 CSc1sc(C#N)c(C)c1C(=O)/C=C/N(C)C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 L04 compound treatment 0.094 0.0242 6.23 0.093 0.021 5.85 8.539 0.9995 3178665 Maybridge4_002358 CCOC(=O)c1sc(SCCS(=O)(=O)c2ccc(Cl)cc2)c3C(=O)CCCc13 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 L05 compound treatment 0.09 0.0202 5.2 0.097 0.025 6.96 8.5984 0.9896 1438715 Maybridge4_002359 Cc1c(C=C)c(sc1C(=O)Oc2ccccc2)S(=O)(=O)C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 L06 compound treatment 0.135 0.0652 16.78 0.134 0.062 17.27 24.0773 0.9999 3178666 Maybridge4_002360 CC1(C)CC(=O)c2c(SCCOC(=O)c3ccccc3Cl)sc(C#N)c2C1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 L07 compound treatment 0.07 1.88E-4 0.05 0.075 0.003 0.84 0.6249 0.7467 3064123 Maybridge4_002361 Cc1nn(Cc2nc(cs2)C(C)(C)C)c(C)c1Br 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 L08 compound treatment 0.072 0.00219 0.56 0.074 0.002 0.56 0.7921 1.0 1009905 Maybridge4_002362 CC(=O)Nc1ccc(Br)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 L09 compound treatment 0.09 0.0202 5.2 0.09 0.018 5.01 7.22 0.9998 3178667 Maybridge4_002363 CSc1sc(c2CCCC(=O)c12)c3ccnc(SCC(=O)c4ccc(Cl)cc4)n3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 L10 compound treatment 0.068 -0.00181 -0.47 0.072 0.0 0.0 -0.33 -0.7071 3064124 Maybridge4_002364 O=S1(=O)CC=C(C1)Sc2ccccc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 L11 compound treatment 0.068 -0.00181 -0.47 0.071 -0.001 -0.28 -0.5269 -0.9696 3178668 Maybridge4_002365 Cc1cc(C)n(CCS(=O)(=O)c2ccc(Cl)cc2)n1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 L12 compound treatment 0.175 0.105 27.08 0.176 0.104 28.96 39.6305 0.9994 3064125 Maybridge4_002366 Clc1ccc(cc1)C(=O)Nc2cc(cs2)S(=O)(=O)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 L13 compound treatment 0.21 0.14 36.09 0.208 0.136 37.88 52.3041 0.9997 3178669 Maybridge4_002367 Cc1csc2sc(c(C)c12)c3ccnc(SCC(=O)NCc4ccccc4)n3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 L14 compound treatment 0.082 0.0122 3.14 0.087 0.015 4.18 5.1727 0.9901 1344584 Maybridge4_002368 COC(=O)c1c(C)n2CSCc2c1C(=O)OC 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 L15 compound treatment 0.073 0.00319 0.82 0.077 0.005 1.39 1.5649 0.9682 3178670 Maybridge4_002369 CN(C)/C=C/C(=O)c1ccsc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 L16 compound treatment 0.082 0.0122 3.14 0.089 0.017 4.73 5.5666 0.98 1542795 Maybridge4_002370 CCCCc1ccc(NC(=O)N=S2CCN(CC2)C(=O)c3ccc(Cl)cc3)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 L17 compound treatment 0.09 0.0202 5.2 0.094 0.022 6.13 8.0077 0.9967 1463535 Maybridge4_002371 CN1c2sc(C)c(C)c2C(=C(C(=O)Nc3ccc(Cl)cc3)S1(=O)=O)O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 L18 compound treatment 0.071 0.00119 0.31 0.075 0.003 0.84 0.807 0.907 1537505 Maybridge4_002372 Cc1occc1C(=O)C(=C(NCc2cccnc2)NCc3cccnc3)C#N 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 L19 compound treatment 0.078 0.00819 2.11 0.077 0.005 1.39 2.4752 0.9797 3064207 Maybridge4_002373 CS(=O)(=O)c1cc2cc(Cl)ccc2oc1=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 L20 compound treatment 0.156 0.0862 22.19 0.158 0.086 23.95 32.6267 0.9993 3064208 Maybridge4_002374 FC(F)(F)c1ccc(SC(=O)c2csc(n2)C3COc4ccccc4O3)nc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 L21 compound treatment 0.09 0.0202 5.2 0.095 0.023 6.41 8.2046 0.9946 3064209 Maybridge4_002375 CN(C)/C=N/C(=O)c1sc(c2C=CCCc12)S(=O)(=O)C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 L22 compound treatment 0.068 -0.00181 -0.47 0.07 -0.002 -0.56 -0.7238 -0.9961 1320320 Maybridge4_002376 O=C(C1Cc2ccccc2C1)N3CCOCC3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 L23 mock treatment 0.07 1.88E-4 0.05 0.075 0.003 0.84 0.6249 0.7467 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 L24 positive control 0.077 0.00719 1.85 0.08 0.008 2.23 2.8839 0.9957 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 M01 compound treatment 0.077 0.00719 1.85 0.083 0.011 3.06 3.4747 0.9709 3064210 Maybridge4_002377 OC(=O)c1ccc2ccccc2c1Br 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 M02 compound treatment 0.157 0.0872 22.45 0.155 0.083 23.11 32.218 0.9999 3064211 Maybridge4_002378 Clc1ccc(cc1)S(=O)(=O)/C(=C/Nc2cccc(Cl)c2)/C#N 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 M03 compound treatment 0.069 -8.12E-4 -0.21 0.073 0.001 0.28 0.049 0.1407 3178671 Maybridge4_002379 COC(=O)c1ccc(Oc2ccc(Cl)cc2Cl)o1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 M04 compound treatment 0.138 0.0682 17.56 0.143 0.071 19.77 26.3958 0.9982 3178672 Maybridge4_002380 CCOC(=O)/C(=C\Nc1ccc(F)c(Cl)c1)/S(=O)(=O)c2ccc(Cl)cc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 M05 compound treatment 0.182 0.112 28.88 0.19 0.118 32.86 43.6618 0.9979 3064212 Maybridge4_002381 Clc1ccc(/C=C/C(=O)Nc2cccc(Cl)c2)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 M06 compound treatment 0.078 0.00819 2.11 0.08 0.008 2.23 3.066 0.9996 3064213 Maybridge4_002382 NNC(=O)CS(=O)(=O)c1ccc(Cl)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 M07 compound treatment 0.159 0.0892 22.96 0.165 0.093 25.9 34.5514 0.9982 3178673 Maybridge4_002383 Cc1cc(C)cc(NC(=S)Nc2cc(C)cc(C)c2)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 M08 compound treatment 0.136 0.0662 17.04 0.141 0.069 19.22 25.6378 0.9982 3178674 Maybridge4_002384 Clc1ccc(SCC(=O)Nc2cscc2S(=O)(=O)c3ccc(Cl)cc3)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 M09 compound treatment 0.099 0.0292 7.51 0.101 0.029 8.08 11.0247 0.9994 1165743 Maybridge4_002385 CCN(CCS(=O)(=O)c1ccc(Cl)cc1)S(=O)(=O)c2ccc(Cl)cc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 M10 compound treatment 0.103 0.0332 8.54 0.103 0.031 8.63 12.1467 1.0 3178675 Maybridge4_002386 Clc1ccccc1NC(=S)Nc2cscc2S(=O)(=O)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 M11 compound treatment 0.107 0.0372 9.57 0.095 0.023 6.41 11.2996 0.9809 1302916 Maybridge4_002387 CC(C)(C)n1nc(cc1NC(=O)Nc2ccccc2)C3CC3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 M12 compound treatment 0.154 0.0842 21.68 0.153 0.081 22.56 31.278 0.9998 3178676 Maybridge4_002388 COC(=O)c1sc(SC)c(c1C)c2ccn(n2)S(=O)(=O)c3ccc(Cl)cc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 M13 compound treatment 0.069 -8.12E-4 -0.21 0.076 0.004 1.11 0.6398 0.5645 3064215 Maybridge4_002389 COc1c(Cl)scc1C(=O)O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 M14 compound treatment 0.068 -0.00181 -0.47 0.074 0.002 0.56 0.0639 0.0879 3178677 Maybridge4_002390 CC(C)S(=O)(=O)c1csc(C(=O)NN)c1Cl 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 M15 compound treatment 0.152 0.0822 21.16 0.155 0.083 23.11 31.3077 0.999 1619049 Maybridge4_002391 CC(C)(C)c1ccc(cc1)c2[nH]nc(NC(=O)c3ccccc3Cl)c2Br 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 M16 compound treatment 0.068 -0.00181 -0.47 0.073 0.001 0.28 -0.1331 -0.2448 3178678 Maybridge4_002392 CSc1sc(C(=O)O)c(I)c1S(=O)(=O)C(C)C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 M17 compound treatment 0.118 0.0482 12.41 0.116 0.044 12.25 17.4376 1.0 3178679 Maybridge4_002393 CC(C)(C)c1ccc(cc1)C(=O)C(=C2SCCCS2)C#N 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 M18 compound treatment 0.071 0.00119 0.31 0.074 0.002 0.56 0.61 0.9601 3064216 Maybridge4_002394 CS(=O)(=NC(=O)Nc1ccccc1)c2ccccc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 M19 compound treatment 0.119 0.0492 12.66 0.119 0.047 13.09 18.2105 0.9999 3178680 Maybridge4_002395 CSc1nc2cc(C)nn2c(c1C#N)c3ccccc3Cl 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 M20 compound treatment 0.08 0.0102 2.62 0.082 0.01 2.78 3.824 0.9996 1447748 Maybridge4_002396 Clc1ccccc1c2csc(CS(=O)(=O)c3cccs3)n2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 M21 compound treatment 0.095 0.0252 6.49 0.096 0.024 6.68 9.3118 0.9999 3178681 Maybridge4_002397 CSc1nc(N)n2nc(cc2n1)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 M22 compound treatment 0.178 0.108 27.86 0.168 0.096 26.74 38.6013 0.9998 3178753 Maybridge4_002398 CN(C)/C=C/C(=O)c1sc(SCc2ccc(Cl)cc2)c3C(=O)CC(C)(C)Cc13 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 M23 mock treatment 0.071 0.00119 0.31 0.072 0.0 0.0 0.2162 0.7071 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 M24 positive control 0.077 0.00719 1.85 0.081 0.009 2.51 3.0809 0.9889 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 N01 compound treatment 0.154 0.0842 21.68 0.157 0.085 23.67 32.0657 0.999 3064217 Maybridge4_002399 CCOC(=O)c1sc2sc(C(=O)OCC)c(c3ccc(Cl)cc3)c2c1N 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 N02 compound treatment 0.076 0.00619 1.59 0.078 0.006 1.67 2.308 0.9997 3064244 Maybridge4_002400 CCOC(=O)NS(=O)(=O)c1ccc(s1)c2cc(n(C)n2)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 N03 compound treatment 0.076 0.00619 1.59 0.08 0.008 2.23 2.7019 0.9865 3064245 Maybridge4_002401 CSc1scc2CC(C)(C)CC(=O)c12 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 N04 compound treatment 0.098 0.0282 7.26 0.108 0.036 10.03 12.2211 0.9874 3064246 Maybridge4_002402 CC1(C)CCc2cc(ccc2O1)C3SCCS3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 N05 compound treatment 0.081 0.0112 2.88 0.085 0.013 3.62 4.5968 0.9936 3064248 Maybridge4_002403 Cc1nn(CC(=S)N)c(C)c1Br 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 N06 compound treatment 0.074 0.00419 1.08 0.079 0.007 1.95 2.1408 0.961 1138975 Maybridge4_002404 CC(C)S(=O)(=O)c1cscc1N2C(=O)c3ccccc3C2=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 N07 compound treatment 0.128 0.0582 14.98 0.145 0.073 20.33 24.9691 0.9887 3064249 Maybridge4_002405 Fc1cccc(NC(=S)N(CCS(=O)(=O)c2ccc(Cl)cc2)Cc3cccs3)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 N08 compound treatment 0.072 0.00219 0.56 0.077 0.005 1.39 1.3829 0.9207 3064250 Maybridge4_002406 Clc1ccc(C(=O)C2C(=O)CCC(C2=O)c3ccccc3)c(Cl)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 N09 compound treatment 0.133 0.0632 16.27 0.129 0.057 15.87 22.7285 0.9999 3064251 Maybridge4_002407 CSc1sc(c2CC(C)(C)CC(=O)c12)c3ccnc(SCC(=O)C(C)(C)C)n3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 N10 compound treatment 0.067 -0.00281 -0.72 0.069 -0.003 -0.84 -1.1028 -0.9975 1318871 Maybridge4_002408 Cn1ccnc1SCCS(=O)(=O)c2ccccc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 N11 compound treatment 0.264 0.194 50.0 0.267 0.195 54.31 73.7539 0.9991 1250473 Maybridge4_002409 CCOC(=O)c1sc(SCc2ccccc2)c3c1-c4sccc4N(C)S3(=O)=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 N12 compound treatment 0.072 0.00219 0.56 0.076 0.004 1.11 1.186 0.9501 3064253 Maybridge4_002410 FC(F)(F)c1cc(cc(c1)S(=O)(=O)/N=S\2/CCC3(C2)OCCO3)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 N13 compound treatment 0.079 0.00919 2.37 0.085 0.013 3.62 4.2327 0.9787 1662782 Maybridge4_002411 CSc1sc(c2nc(cs2)C(C)(C)C)c3CCCC(=O)c13 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 N14 compound treatment 0.07 1.88E-4 0.05 0.075 0.003 0.84 0.6249 0.7467 1607185 Maybridge4_002412 Clc1ccc(cc1)C(=O)N=S2CCN(CC2)C(=O)c3ccc(Cl)cc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 N15 compound treatment 0.124 0.0542 13.95 0.133 0.061 16.99 21.8777 0.9952 3178754 Maybridge4_002413 COC(=O)C1=C(CSC1)Nc2ccc(OC(=O)c3cccc(c3)C(F)(F)F)cc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 N16 compound treatment 0.151 0.0812 20.9 0.159 0.087 24.23 31.9134 0.9973 1495489 Maybridge4_002414 Clc1ccc(OC(=O)c2cccnc2SCCS(=O)(=O)c3ccccc3)c(Cl)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 N17 compound treatment 0.074 0.00419 1.08 0.078 0.006 1.67 1.9439 0.9775 3178755 Maybridge4_002415 CSc1sc(C(=O)NN)c2CCC=Cc12 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 N18 compound treatment 0.125 0.0552 14.21 0.123 0.051 14.2 20.0905 1.0 3178756 Maybridge4_002416 CS(=O)(=NS(=O)(=O)c1cccs1)c2ccc(OC(=O)c3ccc(Cl)cc3)cc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 N19 compound treatment 0.081 0.0112 2.88 0.083 0.011 3.06 4.203 0.9995 3064254 Maybridge4_002417 CS(=O)(=O)/C(=C/Nc1cnccn1)/C#N 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 N20 compound treatment 0.215 0.145 37.38 0.209 0.137 38.15 53.4113 0.9999 1627111 Maybridge4_002418 O=C(SCc1cccs1)c2csc(n2)C3COc4ccccc4O3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 N21 compound treatment 0.073 0.00319 0.82 0.075 0.003 0.84 1.1711 1.0 3064255 Maybridge4_002419 FC(F)(F)Oc1ccc(cc1)S(=O)(=O)CCN2CCOCC2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 N22 compound treatment 0.09 0.0202 5.2 0.093 0.021 5.85 7.8107 0.9983 3178757 Maybridge4_002420 Clc1ccc(cc1)c2cc(NC(=O)C3Cc4ccccc4C3)[nH]n2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 N23 mock treatment 0.07 1.88E-4 0.05 0.071 -0.001 -0.28 -0.1628 -0.5759 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 N24 positive control 0.076 0.00619 1.59 0.081 0.009 2.51 2.8988 0.9761 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 O01 compound treatment 0.18 0.11 28.37 0.17 0.098 27.29 39.3592 0.9998 1259648 Maybridge4_002421 COc1ccc(NC(=O)C(C(=O)Nc2ccc(OC)cc2)C3(CC4CC5CC(C4)C3)C5)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 O02 compound treatment 0.09 0.0202 5.2 0.102 0.03 8.35 9.5831 0.9739 3064256 Maybridge4_002422 FC(F)(F)c1cc(N/C=C(\C#N)/S(=O)(=O)c2ccccn2)cc(c1)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 O03 compound treatment 0.076 0.00619 1.59 0.079 0.007 1.95 2.505 0.995 1743228 Maybridge4_002423 Cc1ccc(Nc2cc(O)nn2C)cc1Cl 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 O04 compound treatment 0.105 0.0352 9.06 0.105 0.033 9.19 12.9047 1.0 3064257 Maybridge4_002424 CCn1c(S)nc2ccccc2c1=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 O05 compound treatment 0.155 0.0852 21.93 0.159 0.087 24.23 32.6416 0.9988 3178758 Maybridge4_002425 Cc1c(C)c(C)c(CSc2ccccc2N)c(C)c1C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 O06 compound treatment 0.141 0.0712 18.33 0.14 0.068 18.94 26.3512 0.9999 3064258 Maybridge4_002426 CS/C(=C(\C#N)/C(=O)C1CC1)/N2CCOCC2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 O07 compound treatment 0.07 1.88E-4 0.05 0.072 0.0 0.0 0.0341 0.7071 1286597 Maybridge4_002427 O=S(=O)(CCN1CCSCC1)c2ccccc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 O08 compound treatment 0.11 0.0402 10.35 0.106 0.034 9.47 14.0119 0.999 3064259 Maybridge4_002428 Clc1ccccc1C(=O)Nc2cscc2S(=O)(=O)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 O09 compound treatment 0.071 0.00119 0.31 0.071 -0.001 -0.28 0.0193 0.0466 3178759 Maybridge4_002429 O=S(=O)(CCSc1ccccc1)c2ccccc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 O10 compound treatment 0.095 0.0252 6.49 0.091 0.019 5.29 8.3272 0.9949 1558086 Maybridge4_002430 COC(=O)C1=C(CSC1)Nc2ccc(F)cc2F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 O11 compound treatment 0.103 0.0332 8.54 0.107 0.035 9.75 12.9344 0.9978 3064260 Maybridge4_002431 Cc1cc(C)n2nc(cc2n1)c3ccc(cc3)C(C)(C)C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 O12 compound treatment 0.136 0.0662 17.04 0.14 0.068 18.94 25.4409 0.9986 3178760 Maybridge4_002432 CC(C)S(=O)(=O)c1csc(C(=O)OCC(=O)c2ccc(Cl)cc2)c1N 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 O13 compound treatment 0.068 -0.00181 -0.47 0.075 0.003 0.84 0.2608 0.2725 3064262 Maybridge4_002433 Clc1ccc(cc1)S(=O)(=O)/C(=C/N2CCCCC2)/C#N 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 O14 compound treatment 0.095 0.0252 6.49 0.098 0.026 7.24 9.7056 0.9985 3178761 Maybridge4_002434 Fc1ccc(NC(=O)c2cccnc2Sc3cccs3)c(F)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 O15 compound treatment 0.083 0.0132 3.4 0.086 0.014 3.9 5.1578 0.9976 3064263 Maybridge4_002435 Nc1nc(Sc2ccc(Cl)cc2)c(C#N)c(c1C#N)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 O16 compound treatment 0.156 0.0862 22.19 0.154 0.082 22.84 31.839 0.9999 3178762 Maybridge4_002436 CSc1scc(c1C#N)c2cc(Cl)cc(Cl)c2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 O17 compound treatment 0.148 0.0782 20.13 0.143 0.071 19.77 28.2164 1.0 3064280 Maybridge4_002437 O=C(C(=C1SCCCS1)C#N)c2cccs2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 O18 compound treatment 0.215 0.145 37.38 0.232 0.16 44.56 57.9406 0.9962 3064281 Maybridge4_002438 CN(/N=C(\C#N)/C(=O)C1CC1)c2ccc(Cl)cc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 O19 compound treatment 0.068 -0.00181 -0.47 0.071 -0.001 -0.28 -0.5269 -0.9696 1358615 Maybridge4_002439 COCc1cc(OC(=O)N(C)C)nc2n(C)nc(C)c12 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 O20 compound treatment 0.071 0.00119 0.31 0.075 0.003 0.84 0.807 0.907 1379175 Maybridge4_002440 Cn1ccc(n1)c2cccc(NC(=O)Nc3ccccc3)c2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 O21 compound treatment 0.095 0.0252 6.49 0.1 0.028 7.8 10.0995 0.9958 3064282 Maybridge4_002441 CSc1c(C#N)c(nn1CNC(=O)Nc2ccccc2C(F)(F)F)c3cccs3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 O22 compound treatment 0.213 0.143 36.87 0.224 0.152 42.33 56.0011 0.9976 3064283 Maybridge4_002442 CCOC(=O)c1sc(SCc2c(Cl)cccc2Cl)c(c1N)S(=O)(=O)C(C)C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 O23 mock treatment 0.068 -0.00181 -0.47 0.069 -0.003 -0.84 -0.9208 -0.9622 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 O24 positive control 0.076 0.00619 1.59 0.081 0.009 2.51 2.8988 0.9761 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 P01 compound treatment 0.19 0.12 30.94 0.177 0.105 29.24 42.5583 0.9996 3064285 Maybridge4_002443 Nc1c(C#N)sc2sc(C#N)c(c3ccco3)c12 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 P02 compound treatment 0.1 0.0302 7.77 0.107 0.035 9.75 12.3883 0.9937 3064286 Maybridge4_002444 CC(C)(C)c1ncc(c(N)n1)S(=O)(=O)c2ccc(cn2)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 P03 compound treatment 0.092 0.0222 5.71 0.099 0.027 7.52 9.3564 0.9908 3178763 Maybridge4_002445 CCOC(=O)c1sc(SC)c2C(=O)CC(Cc12)c3ccc(OC)cc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 P04 compound treatment 0.076 0.00619 1.59 0.078 0.006 1.67 2.308 0.9997 3178764 Maybridge4_002446 CCOC(=O)c1sc(Sc2ccc(cn2)C(F)(F)F)c3C(=O)CC(C)(C)Cc13 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 P05 compound treatment 0.08 0.0102 2.62 0.08 0.008 2.23 3.4301 0.9967 1299033 Maybridge4_002447 CS(=O)(=O)c1sc(C(=O)O)c2CCC=Cc12 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 P06 compound treatment 0.078 0.00819 2.11 0.081 0.009 2.51 3.2629 0.9963 1436320 Maybridge4_002448 Cc1cc(C)n(n1)c2ncc(c(N)n2)S(=O)(=O)c3ccc(Cl)cc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 P07 compound treatment 0.134 0.0642 16.53 0.141 0.069 19.22 25.2737 0.9972 3178765 Maybridge4_002449 CSc1scc2CCc3cn(nc3-c12)C(=O)c4cccc(c4)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 P08 compound treatment 0.074 0.00419 1.08 0.077 0.005 1.39 1.747 0.992 3178766 Maybridge4_002450 CS(=O)(=NC(=O)NC(=O)c1ccc(Cl)cc1)c2ccc(cn2)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 P09 compound treatment 0.082 0.0122 3.14 0.084 0.012 3.34 4.5819 0.9995 3064288 Maybridge4_002451 O=S(=O)(N1CCCCC1)c2ccc(s2)c3ccccn3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 P10 compound treatment 0.069 -8.12E-4 -0.21 0.069 -0.003 -0.84 -0.7387 -0.8577 3064289 Maybridge4_002452 COC(=O)c1cnc(S)n1C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 P11 compound treatment 0.108 0.0382 9.83 0.11 0.038 10.58 14.4355 0.9993 3178767 Maybridge4_002453 FC(F)(F)c1cc(NC(=S)NC(=O)Oc2ccccc2)cc(c1)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 P12 compound treatment 0.078 0.00819 2.11 0.083 0.011 3.06 3.6568 0.9834 3064290 Maybridge4_002454 Cc1ccc(SCC(=O)c2ccc(CC(=O)O)s2)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 P13 compound treatment 0.073 0.00319 0.82 0.079 0.007 1.95 1.9588 0.9261 3178768 Maybridge4_002455 CS(=O)(=NS(=O)(=O)c1ccc(OC(F)(F)F)cc1)c2ccc(Cl)cc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 P14 compound treatment 0.078 0.00819 2.11 0.081 0.009 2.51 3.2629 0.9963 3064291 Maybridge4_002456 CN(C)/C=C/C(=O)c1ccc2OCCc2c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 P15 compound treatment 0.075 0.00519 1.34 0.079 0.007 1.95 2.3229 0.983 3178769 Maybridge4_002457 Cc1cc2ncc(c(C)n2n1)c3ccnc(SCc4c(Cl)cccc4Cl)n3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 P16 compound treatment 0.071 0.00119 0.31 0.077 0.005 1.39 1.2008 0.8423 3064292 Maybridge4_002458 CS(=O)(=O)CCSc1ncccc1C(=O)NCc2cccs2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 P17 compound treatment 0.096 0.0262 6.74 0.101 0.029 8.08 10.4785 0.996 1476633 Maybridge4_002459 CCOC(=O)c1sc(N2CCCCC2)c3C(=O)CC(C)(C)Cc13 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 P18 compound treatment 0.071 0.00119 0.31 0.077 0.005 1.39 1.2008 0.8423 3064293 Maybridge4_002460 OC(=O)C1Cc2ccccc2C1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 P19 compound treatment 0.108 0.0382 9.83 0.108 0.036 10.03 14.0417 1.0 3178770 Maybridge4_002461 FC(F)(F)c1ccc(nc1)S(=O)(=O)/C(=C/Nc2cnccn2)/C#N 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 P20 compound treatment 0.207 0.137 35.32 0.201 0.129 35.93 50.3795 1.0 1356891 Maybridge4_002462 CCOC(=O)CC1Sc2ccccc2N=C1SCC(=O)Nc3ccc(Cl)cc3Cl 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 P21 compound treatment 0.086 0.0162 4.17 0.086 0.014 3.9 5.704 0.9994 3064294 Maybridge4_002463 Clc1ccc(Sc2ccc(s2)c3ccccn3)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 P22 compound treatment 0.133 0.0632 16.27 0.134 0.062 17.27 23.7132 0.9996 1623679 Maybridge4_002464 Cc1ccc(NC(=O)c2ccc3OCCc3c2)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 P23 mock treatment 0.069 -8.12E-4 -0.21 0.071 -0.001 -0.28 -0.3448 -0.9901 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2055 P24 positive control 0.078 0.00819 2.11 0.076 0.004 1.11 2.2783 0.9556 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 A01 compound treatment 0.122 0.0512 13.2 0.122 0.0471 13.11 18.5991 1.0 3178771 Maybridge4_002465 FC(F)(F)c1ccc(NC(=O)c2ccc3OCCc3c2)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 A02 compound treatment 0.088 0.0173 4.44 0.091 0.0161 4.47 6.3044 1.0 3178772 Maybridge4_002466 COc1cc(nc2ccc(C)c(NC(=O)Nc3ccc(OC(F)(F)F)cc3)c12)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 A03 compound treatment 0.08 0.00925 2.38 0.08 0.00507 1.41 2.6818 0.9688 1345781 Maybridge4_002467 O=C1N(CC2COc3ccccc3O2)C(=O)c4ccccc14 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 A04 compound treatment 0.078 0.00725 1.87 0.084 0.00907 2.53 3.1054 0.9889 1377469 Maybridge4_002468 CN(C)CC#Cc1cncc(c1)C(=O)NN 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 A05 compound treatment 0.076 0.00525 1.35 0.082 0.00707 1.97 2.3474 0.9832 1734397 Maybridge4_002469 Brc1cc2CCOc2c(c1)C(=O)N3CCCCC3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 A06 compound treatment 0.089 0.0182 4.7 0.092 0.0171 4.75 6.6834 1.0 3178773 Maybridge4_002470 FC(F)(F)c1ccc2cc(CSc3ccc(Cl)cc3)ccc2n1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 A07 compound treatment 0.13 0.0592 15.26 0.133 0.0581 16.17 22.2217 0.9996 3064295 Maybridge4_002471 COc1ccc(OC(=O)c2csc(COc3ccc4nonc4c3)n2)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 A08 compound treatment 0.074 0.00325 0.84 0.079 0.00407 1.13 1.3925 0.9889 1124957 Maybridge4_002472 Fc1ccc(cc1)S(=O)(=O)CCN2CCC(CC2)n3cccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 A09 compound treatment 0.159 0.0882 22.72 0.172 0.0971 27.03 35.1815 0.9963 3064326 Maybridge4_002473 Cc1nn(Cc2ccc(o2)C(=O)Sc3ccc(cn3)C(F)(F)F)c(C)c1Br 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 A10 compound treatment 0.074 0.00325 0.84 0.078 0.00307 0.85 1.1956 0.9999 1618157 Maybridge4_002474 CCOC(=O)c1c(SC)nc2ccc(Cl)cc2c1N3CCOCC3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 A11 compound treatment 0.103 0.0323 8.3 0.108 0.0331 9.21 12.383 0.9987 1711585 Maybridge4_002475 CCOC(=O)NC(=O)c1cn(Cc2cccs2)c(=O)n(C)c1=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 A12 compound treatment 0.105 0.0343 8.82 0.109 0.0341 9.49 12.9441 0.9993 3064327 Maybridge4_002476 FC(F)(F)c1cc(N2CCN(CC2)C(=O)c3cccs3)c4ccccc4n1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 A13 compound treatment 0.103 0.0323 8.3 0.104 0.0291 8.09 11.5953 0.9999 3064329 Maybridge4_002477 Cc1ccc(cc1)S(=O)(=O)NCCSc2cc(nc3ccccc23)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 A14 compound treatment 0.155 0.0843 21.69 0.173 0.0981 27.31 34.6502 0.9935 3064330 Maybridge4_002478 Clc1ccc(NC(=O)OCC#Cc2ccc(C#N)cc2)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 A15 compound treatment 0.221 0.15 38.68 0.243 0.168 46.81 60.4508 0.9955 3064331 Maybridge4_002479 COC(=O)c1scc2c(SCc3ccccc3)cc(nc12)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 A16 compound treatment 0.09 0.0193 4.96 0.096 0.0211 5.87 7.6532 0.9965 3178850 Maybridge4_002480 CCCNC(=O)Nc1ccc(OC(F)(F)F)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 A17 compound treatment 0.073 0.00225 0.58 0.079 0.00407 1.13 1.2105 0.9515 1220133 Maybridge4_002481 COC(=O)c1sccc1n2cc(C#N)c(=O)n(C)c2=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 A18 compound treatment 0.088 0.0173 4.44 0.097 0.0221 6.15 7.486 0.9873 1288518 Maybridge4_002482 O=c1[nH]nc(CSc2ccccn2)c3ccccc13 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 A19 compound treatment 0.091 0.0203 5.21 0.099 0.0241 6.7 8.426 0.9923 1196923 Maybridge4_002483 Cn1c(=O)c(cn(c2ccccc2)c1=O)C(=S)N 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 A20 compound treatment 0.074 0.00325 0.84 0.084 0.00907 2.53 2.3771 0.8936 3178851 Maybridge4_002484 COc1ccc(NC(=O)N(Cc2ccccc2)C(=O)CC#N)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 A21 compound treatment 0.361 0.29 74.73 0.377 0.302 84.12 112.327 0.9983 1562266 Maybridge4_002485 Clc1ccccc1C(=O)CSC2=NCCc3ccccc23 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 A22 compound treatment 0.091 0.0203 5.21 0.1 0.0251 6.98 8.6229 0.9897 3064332 Maybridge4_002486 FC(F)(F)c1cc(Oc2ccc(Cl)cc2)c3cc(Cl)ccc3n1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 A23 mock treatment 0.074 0.00325 0.84 0.083 0.00807 2.25 2.1802 0.9094 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 A24 positive control 0.077 0.00625 1.61 0.082 0.00707 1.97 2.5295 0.995 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 B01 compound treatment 0.132 0.0612 15.77 0.131 0.0561 15.61 22.192 1.0 1234192 Maybridge4_002487 Cc1nc(ncc1S(=O)(=O)c2ccc(Cl)cc2)C3COc4ccccc4O3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 B02 compound treatment 0.135 0.0643 16.54 0.147 0.0721 20.07 25.889 0.9954 3064333 Maybridge4_002488 COC(=O)c1cc2cc(Br)ccc2s1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 B03 compound treatment 0.103 0.0323 8.3 0.115 0.0401 11.16 13.7615 0.9894 1523364 Maybridge4_002489 Cc1ccccc1NC(=O)NCCc2ccccc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 B04 compound treatment 0.131 0.0602 15.51 0.136 0.0611 17.01 22.9946 0.9989 3064334 Maybridge4_002490 Cc1c(sc2ccc(Cl)cc12)C(=O)COC(=O)c3ccccc3C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 B05 compound treatment 0.072 0.00125 0.32 0.074 -9.33E-4 -0.26 0.0438 0.1058 3178852 Maybridge4_002491 Cc1cccc(C)c1NC(=O)N(Cc2ccccc2)C(=O)CC#N 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 B06 compound treatment 0.113 0.0423 10.88 0.121 0.0461 12.83 16.7637 0.9966 3064335 Maybridge4_002492 Cc1c(sc2ccccc12)c3ccnn3C(=O)Nc4ccccc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 B07 compound treatment 0.083 0.0123 3.15 0.087 0.0121 3.36 4.6064 0.9995 1235231 Maybridge4_002493 COC(=O)c1ccc(CN(C(=O)C)C(=O)Nc2ccc(cc2C)C(=O)OC)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 B08 compound treatment 0.083 0.0123 3.15 0.083 0.00807 2.25 3.8187 0.9862 3178853 Maybridge4_002494 Clc1ccccc1NC(=S)N2CCOC2c3c[nH]c4ccccc34 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 B09 compound treatment 0.077 0.00625 1.61 0.079 0.00407 1.13 1.9387 0.9852 3064336 Maybridge4_002495 C=CCn1c(SCc2ccccc2)nnc1c3ccc4ncccc4c3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 B10 compound treatment 0.09 0.0193 4.96 0.089 0.0141 3.92 6.2747 0.9932 3064337 Maybridge4_002496 O=C(CCSc1ccccc1)c2cccs2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 B11 compound treatment 0.155 0.0843 21.69 0.165 0.0901 25.08 33.0748 0.9974 3178854 Maybridge4_002497 CC(C)n1c(nc2cc(ccc12)C(=O)Nc3ccc(Cl)cc3)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 B12 compound treatment 0.096 0.0253 6.5 0.094 0.0191 5.31 8.3517 0.995 1241391 Maybridge4_002498 Clc1cccc(NC(=O)OC2CCCCc3cccnc23)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 B13 compound treatment 0.144 0.0732 18.86 0.15 0.0751 20.91 28.1183 0.9987 1376937 Maybridge4_002499 CCc1ccc2[nH]c(cc2c1)C(=O)NCCc3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 B14 compound treatment 0.076 0.00525 1.35 0.078 0.00307 0.85 1.5597 0.9755 3178855 Maybridge4_002500 FC(F)(F)COc1ccc(Sc2ncccn2)c(OCC(F)(F)F)c1C#N 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 B15 compound treatment 0.105 0.0343 8.82 0.11 0.0351 9.77 13.141 0.9987 1581778 Maybridge4_002501 Clc1ccc(cc1)c2ccc(s2)C(=O)NC(=O)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 B16 compound treatment 0.082 0.0113 2.9 0.089 0.0141 3.92 4.8182 0.989 1626834 Maybridge4_002502 C(N1CCC(=N1)c2ccco2)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 B17 compound treatment 0.168 0.0973 25.04 0.162 0.0871 24.25 34.8508 0.9999 3064338 Maybridge4_002503 O=C(NC(=S)NCc1ccccc1)/C=C/c2cccs2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 B18 compound treatment 0.077 0.00625 1.61 0.084 0.00907 2.53 2.9233 0.9763 3178856 Maybridge4_002504 OCCn1nc(c2cc(cc(c2)C(F)(F)F)C(F)(F)F)c3ccccc3c1=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 B19 compound treatment 0.13 0.0592 15.26 0.128 0.0531 14.78 21.2371 0.9999 1406037 Maybridge4_002505 COc1ccc(cc1)c2csc(n2)c3ccc(OC)cc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 B20 compound treatment 0.072 0.00125 0.32 0.077 0.00207 0.58 0.6346 0.9623 1528457 Maybridge4_002506 COc1ccc(cc1)c2nn(CCC#N)c(=O)[nH]2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 B21 compound treatment 0.073 0.00225 0.58 0.083 0.00807 2.25 1.9982 0.8613 3064339 Maybridge4_002507 Cc1ccc(CC(=O)c2cccnc2)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 B22 compound treatment 0.112 0.0413 10.62 0.118 0.0431 11.99 15.9908 0.9982 3178857 Maybridge4_002508 CCOC(=O)NC(=S)N1C(C)CCCC1C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 B23 mock treatment 0.074 0.00325 0.84 0.075 6.67E-5 0.02 0.6048 0.7226 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 B24 positive control 0.077 0.00625 1.61 0.082 0.00707 1.97 2.5295 0.995 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 C01 compound treatment 0.074 0.00325 0.84 0.075 6.67E-5 0.02 0.6048 0.7226 3178858 Maybridge4_002509 Cn1c(S)nnc1C2COc3ccccc3O2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 C02 compound treatment 0.092 0.0213 5.47 0.093 0.0181 5.03 7.4265 0.9991 3064341 Maybridge4_002510 CCOC(=O)c1cncc(C#CCOC(=O)Nc2cc(Cl)cc(Cl)c2)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 C03 compound treatment 0.078 0.00725 1.87 0.077 0.00207 0.58 1.7269 0.8841 1514783 Maybridge4_002511 Clc1ccc(cc1)C(=O)NCC2COc3ccccc3O2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 C04 compound treatment 0.17 0.0993 25.55 0.177 0.102 28.42 38.1688 0.9986 3064342 Maybridge4_002512 CSc1nn(cc1c2nc(cs2)c3ccccc3)c4ccccc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 C05 compound treatment 0.071 2.5E-4 0.06 0.073 -0.00193 -0.54 -0.3352 -0.6182 3064366 Maybridge4_002513 COc1cccn(CC(=O)NN)c1=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 C06 compound treatment 0.172 0.101 26.07 0.17 0.0951 26.48 37.1544 1.0 3064367 Maybridge4_002514 Clc1ccc(Cl)c(c1)S(=O)(=O)n2ccc(n2)c3ccc(Br)s3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 C07 compound treatment 0.121 0.0503 12.94 0.124 0.0491 13.66 18.8109 0.9996 1600605 Maybridge4_002515 Clc1ccc(NC(=O)c2csc(COc3ccc4nonc4c3)n2)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 C08 compound treatment 0.074 0.00325 0.84 0.076 0.00107 0.3 0.8017 0.9029 1505462 Maybridge4_002516 Cc1ccc(cc1)S(=O)(=O)CCN2CCC(CC2)n3cccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 C09 compound treatment 0.122 0.0512 13.2 0.118 0.0431 11.99 17.8114 0.9989 3064368 Maybridge4_002517 CSc1nc2ccc(NS(=O)(=O)c3ccccc3C(F)(F)F)cc2s1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 C10 compound treatment 0.153 0.0823 21.18 0.149 0.0741 20.63 29.5599 0.9999 3064369 Maybridge4_002518 CCOC(=O)c1c(SC)nc2c(cccc2c1N3CCCC3)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 C11 compound treatment 0.101 0.0302 7.79 0.108 0.0331 9.21 12.0189 0.9965 3064371 Maybridge4_002519 Cn1c(S)nnc1CSc2cc(nc3ccccc23)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 C12 compound treatment 0.173 0.102 26.33 0.17 0.0951 26.48 37.3365 1.0 3064373 Maybridge4_002520 FC(F)(F)c1cccc(c1)N2C(=O)C3SCCN3C2=S 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 C13 compound treatment 0.191 0.12 30.96 0.176 0.101 28.15 41.7951 0.9989 3178859 Maybridge4_002521 O=C(Nc1ccccc1)OCC#Cc2ccc(s2)c3ccccn3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 C14 compound treatment 0.132 0.0612 15.77 0.126 0.0511 14.22 21.2074 0.9987 3064374 Maybridge4_002522 FC(F)(F)Oc1ccc(NC(=O)OCC#Cc2ccc(C#N)cc2)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 C15 compound treatment 0.133 0.0623 16.03 0.124 0.0491 13.66 20.9956 0.9968 1566879 Maybridge4_002523 CCOC(=O)Cn1c(=O)c(cn(C(C)C)c1=O)c2nc(cs2)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 C16 compound treatment 0.112 0.0413 10.62 0.108 0.0331 9.21 14.0216 0.9975 1528772 Maybridge4_002524 Cc1ccc(OC(=O)c2c(nnc3ccccc23)c4ccccc4)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 C17 compound treatment 0.094 0.0233 5.99 0.092 0.0171 4.75 7.5937 0.9935 1617239 Maybridge4_002525 Clc1ccc(Cn2ccnc2COC(=O)Nc3ccc(Cl)cc3)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 C18 compound treatment 0.074 0.00325 0.84 0.077 0.00207 0.58 0.9987 0.9833 1164357 Maybridge4_002526 COC(=O)CSCc1n[nH]c(=O)c2ccccc12 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 C19 compound treatment 0.071 2.5E-4 0.06 0.071 -0.00393 -1.1 -0.7291 -0.6644 3178860 Maybridge4_002527 Cn1c(=O)c(cn(c2ccccc2)c1=O)/C(=N/O)/N 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 C20 compound treatment 0.071 2.5E-4 0.06 0.076 0.00107 0.3 0.2556 0.8408 3178861 Maybridge4_002528 Fc1cccc(NC(=O)N(Cc2ccccc2)C(=O)CC#N)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 C21 compound treatment 0.07 -7.5E-4 -0.19 0.076 0.00107 0.3 0.0735 0.2075 1734152 Maybridge4_002529 CC(C)(C)OC(=O)N1CCN(CCNC(=O)c2ccc(Cl)cc2)CC1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 C22 compound treatment 0.117 0.0462 11.91 0.12 0.0451 12.55 17.295 0.9997 1710452 Maybridge4_002530 COc1ccc(NC(=O)Nc2ccc(OC)c(OC3CCCC3)c2)cc1OC4CCCC4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 C23 mock treatment 0.072 0.00125 0.32 0.072 -0.00293 -0.82 -0.3501 -0.3987 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 C24 positive control 0.08 0.00925 2.38 0.078 0.00307 0.85 2.2879 0.9043 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 D01 compound treatment 0.081 0.0103 2.64 0.08 0.00507 1.41 2.8639 0.957 3064376 Maybridge4_002531 Cc1ccccc1NC(=O)N(Cc2cccs2)C(=O)CC#N 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 D02 compound treatment 0.075 0.00425 1.09 0.075 6.67E-5 0.02 0.7869 0.719 3178862 Maybridge4_002532 Cc1nc2ccc(NS(=O)(=O)c3ccccc3C(F)(F)F)cc2o1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 D03 compound treatment 0.114 0.0432 11.14 0.115 0.0401 11.16 15.7642 1.0 3064377 Maybridge4_002533 FC(F)(F)c1cccc(NC(=S)Nc2cc(n[nH]2)c3cccs3)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 D04 compound treatment 0.17 0.0993 25.55 0.157 0.0821 22.86 34.2303 0.9984 3178863 Maybridge4_002534 Cc1nc(cs1)c2sc3ccc(Cl)cc3c2C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 D05 compound treatment 0.074 0.00325 0.84 0.076 0.00107 0.3 0.8017 0.9029 1387292 Maybridge4_002535 CCCOc1cc(ccc1OC)C(=O)N 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 D06 compound treatment 0.169 0.0983 25.3 0.184 0.109 30.37 39.3652 0.9959 3064378 Maybridge4_002536 Cc1c(sc2ccccc12)c3ccnn3C(=O)c4ccc(cc4)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 D07 compound treatment 0.181 0.11 28.39 0.179 0.104 28.98 40.5653 0.9999 1130276 Maybridge4_002537 CSc1ccccc1CNC(=O)NC2(CC3CC4CC(C3)C2)C4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 D08 compound treatment 0.086 0.0153 3.93 0.086 0.0111 3.08 4.9557 0.9928 3064379 Maybridge4_002538 FC(F)(F)c1ccc(CSc2nccc(n2)c3cccnc3)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 D09 compound treatment 0.074 0.00325 0.84 0.074 -9.33E-4 -0.26 0.4079 0.4655 3178864 Maybridge4_002539 CCOC(=O)CSc1nnc(c2ccc3ncccc3c2)n1C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 D10 compound treatment 0.188 0.117 30.19 0.175 0.1 27.87 41.052 0.9992 3178865 Maybridge4_002540 Cc1c(sc2ccccc12)C(=S)Nc3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 D11 compound treatment 0.069 -0.00175 -0.45 0.075 6.67E-5 0.02 -0.3055 -0.6774 3064380 Maybridge4_002541 CC(C)n1c(nc2cc(ccc12)C(=O)N3CCOCC3)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 D12 compound treatment 0.135 0.0643 16.54 0.135 0.0601 16.73 23.5259 1.0 1150832 Maybridge4_002542 Nc1nccc(n1)c2ccc(NC(=O)Nc3ccccc3)cc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 D13 compound treatment 0.138 0.0673 17.31 0.155 0.0801 22.3 28.0106 0.9922 3064381 Maybridge4_002543 CCc1ccc2[nH]c(cc2c1)C(=O)Nc3ccc(c(C#N)c3)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 D14 compound treatment 0.098 0.0273 7.02 0.096 0.0211 5.87 9.1096 0.996 3178947 Maybridge4_002544 FC(F)(F)COc1ccc(SCc2ccccc2)c(OCC(F)(F)F)c1C#N 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 D15 compound treatment 0.096 0.0253 6.5 0.088 0.0131 3.64 7.1701 0.9624 1264919 Maybridge4_002545 CC(C)(C)c1ccc(s1)C(=O)OCc2ccc3OCOc3c2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 D16 compound treatment 0.087 0.0163 4.18 0.089 0.0141 3.92 5.7285 0.9995 3064382 Maybridge4_002546 CN1CCC(=N1)/C=C/c2cccs2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 D17 compound treatment 0.077 0.00625 1.61 0.076 0.00107 0.3 1.3479 0.8237 3178948 Maybridge4_002547 O=C(NC(=S)N1CCCCC1)/C=C/c2cccs2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 D18 compound treatment 0.082 0.0113 2.9 0.082 0.00707 1.97 3.4398 0.9823 3064383 Maybridge4_002548 Cn1nc(c2cc(cc(c2)C(F)(F)F)C(F)(F)F)c3ccccc3c1=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 D19 compound treatment 0.243 0.172 44.35 0.235 0.16 44.58 62.8807 1.0 1464348 Maybridge4_002549 COc1ccc(cc1)C(=O)CSC2=NCCCCCC2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 D20 compound treatment 0.117 0.0462 11.91 0.125 0.0501 13.94 18.2796 0.9969 3064384 Maybridge4_002550 CC(C)(C)C(=O)NC(=S)Nc1cc(cc(c1)C(F)(F)F)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 D21 compound treatment 0.16 0.0892 22.98 0.161 0.0861 23.97 33.1974 0.9998 3178949 Maybridge4_002551 O=C(Cc1cccc(Oc2ccccc2)c1)c3cccc(C#N)c3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 D22 compound treatment 0.068 -0.00275 -0.71 0.072 -0.00293 -0.82 -1.0783 -0.9975 3064385 Maybridge4_002552 CC1CCCC(C)N1c2nn(C)c(=O)[nH]2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 D23 mock treatment 0.07 -7.5E-4 -0.19 0.077 0.00207 0.58 0.2704 0.4455 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 D24 positive control 0.079 0.00825 2.12 0.082 0.00707 1.97 2.8936 0.9993 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 E01 compound treatment 0.073 0.00225 0.58 0.075 6.67E-5 0.02 0.4228 0.7294 3064421 Maybridge4_002553 Cn1c(SCc2ccc(F)cc2)nnc1C3COc4ccccc4O3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 E02 compound treatment 0.118 0.0473 12.17 0.12 0.0451 12.55 17.477 0.9999 3064422 Maybridge4_002554 CCOC(=O)c1cncc(C#CCOC(=O)Nc2ccc(OC(F)(F)F)cc2)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 E03 compound treatment 0.1 0.0293 7.53 0.105 0.0301 8.37 11.2461 0.9986 1569623 Maybridge4_002555 Clc1ccc(NC(=O)NCC2COc3ccccc3O2)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 E04 compound treatment 0.07 -7.5E-4 -0.19 0.07 -0.00493 -1.37 -1.108 -0.7986 3064423 Maybridge4_002556 C/S(=N\S(=O)(=O)c1cccc2nsnc12)/c3ncc(Cl)cc3C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 E05 compound treatment 0.073 0.00225 0.58 0.073 -0.00193 -0.54 0.0289 0.0366 1912560 Maybridge4_002557 CNC(=O)N(c1ccccc1)c2ccccc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 E06 compound treatment 0.129 0.0583 15.0 0.13 0.0551 15.34 21.4489 0.9999 1719037 Maybridge4_002558 Clc1ccc(cc1)C(=O)OCc2sccc2Oc3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 E07 compound treatment 0.109 0.0382 9.85 0.112 0.0371 10.32 14.2631 0.9997 3064424 Maybridge4_002559 Clc1ccc(SC(=O)c2csc(n2)c3ccc4nonc4c3)c(Cl)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 E08 compound treatment 0.263 0.192 49.5 0.267 0.192 53.49 72.8235 0.9993 1379034 Maybridge4_002560 Cc1ccc(SC(=O)c2ccc(C#Cc3ccccc3)o2)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 E09 compound treatment 0.079 0.00825 2.12 0.081 0.00607 1.69 2.6967 0.9936 3178950 Maybridge4_002561 O=C1CC2Sc3ccccc3N=C2N1Cc4ccccn4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 E10 compound treatment 0.172 0.101 26.07 0.176 0.101 28.15 38.336 0.9993 3064426 Maybridge4_002562 CCOC(=O)c1c(Oc2ccc(OC)cc2)c3cccc(c3nc1SC)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 E11 compound treatment 0.068 -0.00275 -0.71 0.069 -0.00593 -1.65 -1.6691 -0.9285 3178951 Maybridge4_002563 Cn1cc(/C(=N/O)/N)c(=O)n(Cc2ccccc2)c1=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 E12 compound treatment 0.149 0.0783 20.15 0.155 0.0801 22.3 30.0132 0.9987 3178952 Maybridge4_002564 COC(=O)C(Cc1csc2ccc(Cl)cc12)NC(=O)c3ccc(cc3)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 E13 compound treatment 0.091 0.0203 5.21 0.087 0.0121 3.36 6.0629 0.9774 1645379 Maybridge4_002565 CC(C)n1cc(c2nc(C)cs2)c(=O)n(Cc3ccccc3)c1=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 E14 compound treatment 0.088 0.0173 4.44 0.084 0.00907 2.53 4.926 0.9642 3064427 Maybridge4_002566 O=C(OCC#Cc1ccc(C#N)cc1)c2ccccc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 E15 compound treatment 0.142 0.0712 18.34 0.144 0.0691 19.23 26.5726 0.9997 3178953 Maybridge4_002567 COC(=O)c1scc2c(Oc3ccccc3C(F)(F)F)cc(nc12)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 E16 compound treatment 0.127 0.0563 14.48 0.129 0.0541 15.06 20.8879 0.9998 3178954 Maybridge4_002568 CC(C)(C)c1cc2nc(cc(N3CCN(CC3)c4ccc(cn4)C(F)(F)F)n2n1)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 E17 compound treatment 0.078 0.00725 1.87 0.076 0.00107 0.3 1.53 0.8095 3064428 Maybridge4_002569 Cc1ccc(SCc2nccn2Cc3ccc(Cl)cc3)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 E18 compound treatment 0.073 0.00225 0.58 0.075 6.67E-5 0.02 0.4228 0.7294 3178955 Maybridge4_002570 Cn1c(Cc2nc(no2)c3cnccn3)nnc1SCc4ccc(Cl)cc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 E19 compound treatment 0.097 0.0262 6.76 0.095 0.0201 5.59 8.7307 0.9955 1530658 Maybridge4_002571 Cc1c(sc2ccc(Cl)cc12)S(=O)(=O)N=S(=O)(C)c3ccc(C)cc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 E20 compound treatment 0.074 0.00325 0.84 0.077 0.00207 0.58 0.9987 0.9833 1174825 Maybridge4_002572 Cn1c(S)nnc1CCN(Cc2ccco2)S(=O)(=O)c3ccc(Cl)cc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 E21 compound treatment 0.546 0.475 122.36 0.506 0.431 120.05 171.4111 1.0 1683285 Maybridge4_002573 COc1ccc(cc1)C(=O)CSC2=NCCc3ccccc23 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 E22 compound treatment 0.176 0.105 27.1 0.175 0.1 27.87 38.8673 0.9999 1586313 Maybridge4_002574 COc1ccc(NC(=O)Nc2cc(F)cc(F)c2)cc1OC3CCCC3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 E23 mock treatment 0.07 -7.5E-4 -0.19 0.074 -9.33E-4 -0.26 -0.3203 -0.9893 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 E24 positive control 0.081 0.0103 2.64 0.083 0.00807 2.25 3.4546 0.9968 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 F01 compound treatment 0.121 0.0503 12.94 0.119 0.0441 12.27 17.8263 0.9997 1006297 Maybridge4_002575 Clc1ccc(CCc2ccc(Cl)cc2)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 F02 compound treatment 0.133 0.0623 16.03 0.139 0.0641 17.84 23.9495 0.9986 3178956 Maybridge4_002576 Clc1ccccc1C(=O)NC(=O)Nc2ccc3C=CS(=O)(=O)c3c2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 F03 compound treatment 0.084 0.0133 3.41 0.087 0.0121 3.36 4.7885 1.0 1320469 Maybridge4_002577 O=C(Cc1ccc(CC(=O)c2ccccc2)cc1)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 F04 compound treatment 0.147 0.0762 19.63 0.151 0.0761 21.18 28.8614 0.9993 1267104 Maybridge4_002578 Cc1c(CC(=O)Nc2ccc(Cl)cc2)sc3ccc(Cl)cc13 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 F05 compound treatment 0.077 0.00625 1.61 0.074 -9.33E-4 -0.26 0.9541 0.5853 3064429 Maybridge4_002579 CCCn1c(=O)ccn(c2ccccc2C)c1=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 F06 compound treatment 0.31 0.239 61.6 0.287 0.212 59.06 85.3187 0.9998 1449737 Maybridge4_002580 O=C(CSC1=NCCc2ccccc12)c3ccc(cc3)c4ccccc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 F07 compound treatment 0.075 0.00425 1.09 0.079 0.00407 1.13 1.5746 0.9999 3064430 Maybridge4_002581 O=C(CNC(=O)OCc1ccccc1)ON2C(=O)CCC2=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 F08 compound treatment 0.195 0.124 31.99 0.208 0.133 37.06 48.8249 0.9973 1291828 Maybridge4_002582 Cc1c(sc2ccc(Cl)cc12)c3cc(NC(=O)c4ccccc4)[nH]n3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 F09 compound treatment 0.08 0.00925 2.38 0.082 0.00707 1.97 3.0756 0.9955 3064431 Maybridge4_002583 CC(=O)OC1CCN(CC1)c2cc(nc3cc(Cl)cc(Cl)c23)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 F10 compound treatment 0.078 0.00725 1.87 0.08 0.00507 1.41 2.3177 0.9905 3178957 Maybridge4_002584 CNC(=S)c1sc2ccccc2c1C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 F11 compound treatment 0.09 0.0193 4.96 0.085 0.0101 2.8 5.487 0.9636 1269577 Maybridge4_002585 O=C(NCc1ccc(s1)S(=O)(=O)NCc2ccccc2)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 F12 compound treatment 0.078 0.00725 1.87 0.081 0.00607 1.69 2.5146 0.9988 3064432 Maybridge4_002586 FC(F)(F)COc1ccc(c(OCC(F)(F)F)c1C#N)S(=O)(=O)N2CCCC2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 F13 compound treatment 0.163 0.0922 23.75 0.154 0.0791 22.02 32.3651 0.9993 1508849 Maybridge4_002587 CCC(C)c1ccccc1NC(=O)c2cc3cc(CC)ccc3[nH]2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 F14 compound treatment 0.079 0.00825 2.12 0.075 6.67E-5 0.02 1.5151 0.7133 3064434 Maybridge4_002588 FC(F)(F)COc1ccc(SCC=C)c(OCC(F)(F)F)c1C#N 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 F15 compound treatment 0.139 0.0683 17.57 0.135 0.0601 16.73 24.2541 0.9997 1212532 Maybridge4_002589 Cc1cccc(NC(=O)NC(=O)c2ccc(s2)C(C)(C)C)n1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 F16 compound treatment 0.117 0.0462 11.91 0.121 0.0461 12.83 17.4919 0.9993 3064435 Maybridge4_002590 C(N1CCC(=N1)/C=C/c2ccco2)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 F17 compound treatment 0.072 0.00125 0.32 0.076 0.00107 0.3 0.4376 0.9992 1289651 Maybridge4_002591 CC(C)N(C(C)C)C(=O)NC(=O)c1ccc(F)cc1F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 F18 compound treatment 0.072 0.00125 0.32 0.08 0.00507 1.41 1.2253 0.8466 3064458 Maybridge4_002592 NN/C(=N\S(=O)(=O)c1ccccc1)/Nc2cccc(Cl)c2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 F19 compound treatment 0.088 0.0173 4.44 0.082 0.00707 1.97 4.5321 0.9329 3064459 Maybridge4_002593 FC(F)(F)c1cccc(c1)n2c(n[nH]c2=S)c3ccncc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 F20 compound treatment 0.393 0.322 82.97 0.378 0.303 84.4 118.3498 1.0 3064460 Maybridge4_002594 NNC(=S)c1cc(Cl)cc(Cl)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 F21 compound treatment 0.119 0.0483 12.42 0.121 0.0461 12.83 17.856 0.9999 3064461 Maybridge4_002595 NC(=O)c1ccc(CC(=O)c2ccc(Cl)cc2)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 F22 compound treatment 0.073 0.00225 0.58 0.076 0.00107 0.3 0.6197 0.9519 3064462 Maybridge4_002596 C1CN=C(S1)N2CCCCC2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 F23 mock treatment 0.071 2.5E-4 0.06 0.074 -9.33E-4 -0.26 -0.1383 -0.5164 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 F24 positive control 0.081 0.0103 2.64 0.081 0.00607 1.69 3.0608 0.9768 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 G01 compound treatment 0.124 0.0532 13.71 0.133 0.0581 16.17 21.1294 0.9966 3064463 Maybridge4_002597 Cn1c(SCC(=O)c2ccccc2)nnc1C3COc4ccccc4O3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 G02 compound treatment 0.083 0.0123 3.15 0.085 0.0101 2.8 4.2126 0.9983 3064464 Maybridge4_002598 COc1cc(nc2ccc(C)c(NC(=O)c3ccc(Cl)cc3)c12)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 G03 compound treatment 0.123 0.0522 13.45 0.127 0.0521 14.5 19.7658 0.9993 1291018 Maybridge4_002599 Cc1ccc(NC(=S)NCC2COc3ccccc3O2)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 G04 compound treatment 0.089 0.0182 4.7 0.092 0.0171 4.75 6.6834 1.0 3064465 Maybridge4_002600 Cc1c(noc1C(=O)CN=S(=O)(C)c2ccc(cn2)C(F)(F)F)c3c(Cl)cccc3Cl 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 G05 compound treatment 0.075 0.00425 1.09 0.072 -0.00293 -0.82 0.1961 0.1436 3178958 Maybridge4_002601 COc1cccn(Cc2nnc(S)n2C)c1=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 G06 compound treatment 0.076 0.00525 1.35 0.074 -9.33E-4 -0.26 0.772 0.5609 1395477 Maybridge4_002602 Clc1ccccc1C(=O)N2CCC(CC2)n3cccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 G07 compound treatment 0.09 0.0193 4.96 0.078 0.00307 0.85 4.1085 0.8169 3064466 Maybridge4_002603 Clc1ccc(cc1)C(=O)CSc2nc3CSCc3c(=O)[nH]2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 G08 compound treatment 0.068 -0.00275 -0.71 0.075 6.67E-5 0.02 -0.4875 -0.6883 1133834 Maybridge4_002604 O=c1[nH]c(=O)n(nc1C#N)c2ccccc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 G09 compound treatment 0.138 0.0673 17.31 0.138 0.0631 17.56 24.6628 1.0 3064468 Maybridge4_002605 CCOC(=O)c1nnc2c(Br)c(C)nn2c1C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 G10 compound treatment 0.159 0.0882 22.72 0.155 0.0801 22.3 31.8338 1.0 3178959 Maybridge4_002606 CSc1nn(cc1C(=O)Nc2cccc(c2)C(F)(F)F)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 G11 compound treatment 0.111 0.0403 10.36 0.104 0.0291 8.09 13.0518 0.9925 1533729 Maybridge4_002607 CC(C)n1cc(c2noc(n2)c3ccccc3Cl)c(=O)n(Cc4ccccc4)c1=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 G12 compound treatment 0.093 0.0222 5.73 0.098 0.0231 6.42 8.5932 0.9984 1333749 Maybridge4_002608 CSc1nc2c(Cl)cccc2c3n(C)n(Cc4ccc(Cl)cc4)c(=O)c13 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 G13 compound treatment 0.14 0.0693 17.83 0.137 0.0621 17.29 24.83 0.9999 1217547 Maybridge4_002609 CC(C)n1cc(c2nc(cs2)C(C)(C)C)c(=O)n(Cc3ccccc3)c1=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 G14 compound treatment 0.07 -7.5E-4 -0.19 0.072 -0.00293 -0.82 -0.7142 -0.8508 1707847 Maybridge4_002610 CCCn1c(=O)cc(N)n(c2ccc(Cl)cc2)c1=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 G15 compound treatment 0.072 0.00125 0.32 0.072 -0.00293 -0.82 -0.3501 -0.3987 1123385 Maybridge4_002611 CCOC(=O)c1cn(Cc2cccc(Cl)c2)c3cc(C)nn3c1=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 G16 compound treatment 0.071 2.5E-4 0.06 0.077 0.00207 0.58 0.4525 0.7813 3064470 Maybridge4_002612 CCCn1c(=O)cc(N)n(c2ccc(OC(F)(F)F)cc2)c1=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 G17 compound treatment 0.146 0.0752 19.37 0.152 0.0771 21.46 28.8763 0.9987 3178960 Maybridge4_002613 CC(C)(C)c1cc2nc(cc(Sc3ccccc3)n2n1)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 G18 compound treatment 0.074 0.00325 0.84 0.081 0.00607 1.69 1.7864 0.9475 3064471 Maybridge4_002614 Cn1c(Cc2nc(no2)c3cnccn3)nnc1SCC(=O)Nc4ccc(Cl)cc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 G19 compound treatment 0.083 0.0123 3.15 0.089 0.0141 3.92 5.0003 0.9942 1167659 Maybridge4_002615 Cn1c(=O)c(cn(c2ccccc2)c1=O)c3noc(n3)c4ccccc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 G20 compound treatment 0.14 0.0693 17.83 0.124 0.0491 13.66 22.27 0.9914 1420377 Maybridge4_002616 Clc1ccc(NC(=O)CCN(Cc2ccco2)S(=O)(=O)c3ccc(Cl)cc3)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 G21 compound treatment 0.131 0.0602 15.51 0.126 0.0511 14.22 21.0253 0.9991 3064472 Maybridge4_002617 FC(F)(F)Oc1ccc(NC(=O)N2CCN(CC2)C(c3ccccc3)c4ccccc4)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 G22 compound treatment 0.119 0.0483 12.42 0.118 0.0431 11.99 17.2652 0.9998 1413855 Maybridge4_002618 O=C(N1CCN(CC1)C(c2ccccc2)c3ccccc3)c4ccc5nonc5c4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 G23 mock treatment 0.071 2.5E-4 0.06 0.072 -0.00293 -0.82 -0.5321 -0.6494 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 G24 positive control 0.081 0.0103 2.64 0.081 0.00607 1.69 3.0608 0.9768 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 H01 compound treatment 0.09 0.0193 4.96 0.092 0.0171 4.75 6.8655 0.9998 3064474 Maybridge4_002619 Cc1ccccc1NC(=O)NC(=O)CC#N 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 H02 compound treatment 0.073 0.00225 0.58 0.072 -0.00293 -0.82 -0.168 -0.1678 1680806 Maybridge4_002620 OC(=O)Cc1csc2ccc(Cl)cc12 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 H03 compound treatment 0.077 0.00625 1.61 0.075 6.67E-5 0.02 1.151 0.7152 3064475 Maybridge4_002621 COc1ccccc1CCn2cc(C#N)c(=O)[nH]c2=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 H04 compound treatment 0.081 0.0103 2.64 0.079 0.00407 1.13 2.6669 0.9287 3179054 Maybridge4_002622 Cc1cccc(NC(=S)N2CCOC2c3ccsc3)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 H05 compound treatment 0.075 0.00425 1.09 0.073 -0.00193 -0.54 0.393 0.3223 1623471 Maybridge4_002623 CCCn1c(=O)c(C#N)cn(C2CC2)c1=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 H06 compound treatment 0.131 0.0602 15.51 0.126 0.0511 14.22 21.0253 0.9991 3179055 Maybridge4_002624 Cc1c(sc2ccc(Cl)cc12)c3ccnn3S(=O)(=O)C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 H07 compound treatment 0.074 0.00325 0.84 0.077 0.00207 0.58 0.9987 0.9833 3179056 Maybridge4_002625 COc1ccc(Cn2c(=O)n(c3cc(ccc3C)S(=O)C)c4nc[nH]c4c2=O)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 H08 compound treatment 0.179 0.108 27.87 0.191 0.116 32.32 42.5643 0.9973 3064477 Maybridge4_002626 CC(C)c1ccc(/N=C/c2sc3ccccc3c2C)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 H09 compound treatment 0.133 0.0623 16.03 0.129 0.0541 15.06 21.9802 0.9995 3179057 Maybridge4_002627 CCOC(=O)c1ccc2nc(cc(N3CCN(CC3)c4ccccc4)c2c1)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 H10 compound treatment 0.087 0.0163 4.18 0.086 0.0111 3.08 5.1378 0.9887 3064478 Maybridge4_002628 Cc1c(/C=N/O)sc2ccccc12 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 H11 compound treatment 0.155 0.0843 21.69 0.156 0.0811 22.58 31.3025 0.9998 3064510 Maybridge4_002629 COc1ccc(cc1)c2ccnc(SCc3ccc(Cl)cc3Cl)n2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 H12 compound treatment 0.067 -0.00375 -0.97 0.074 -9.33E-4 -0.26 -0.8665 -0.8666 1135828 Maybridge4_002630 OC(=O)CC(NC(=O)Nc1ccccc1)c2ccsc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 H13 compound treatment 0.069 -0.00175 -0.45 0.08 0.00507 1.41 0.6792 0.4585 1625372 Maybridge4_002631 Clc1ccc2c(ccnc2c1)N3CCN(CC3)C(=O)C4CCC4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 H14 compound treatment 0.091 0.0203 5.21 0.096 0.0211 5.87 7.8352 0.9983 3064512 Maybridge4_002632 COc1ccc(NS(=O)(=O)c2ccc(OCC(F)(F)F)c(C#N)c2OCC(F)(F)F)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 H15 compound treatment 0.196 0.125 32.25 0.205 0.13 36.22 48.4162 0.9983 3064513 Maybridge4_002633 CCOC(=O)c1sc(Nc2ccccc2C(F)(F)F)c(C(=O)OCC)c1N 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 H16 compound treatment 0.071 2.5E-4 0.06 0.077 0.00207 0.58 0.4525 0.7813 3064514 Maybridge4_002634 Clc1cccc(N/C(=N\S(=O)(=O)c2ccccc2)/NCCc3ccccn3)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 H17 compound treatment 0.33 0.259 66.75 0.317 0.242 67.41 94.8677 1.0 3064515 Maybridge4_002635 CCOC(=O)NC(=S)Nc1cccc(C)n1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 H18 compound treatment 0.074 0.00325 0.84 0.078 0.00307 0.85 1.1956 0.9999 3179058 Maybridge4_002636 CCOC(=O)NC(=S)N1CCCC1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 H19 compound treatment 0.075 0.00425 1.09 0.097 0.0221 6.15 5.1192 0.8201 3179059 Maybridge4_002637 COc1ccc(CSC2=NCN(CN2)C3CC(C)CC(C)(C)C3)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 H20 compound treatment 0.073 0.00225 0.58 0.08 0.00507 1.41 1.4074 0.9227 1226235 Maybridge4_002638 S=C(NCc1ccccc1)NCc2ccccn2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 H21 compound treatment 0.079 0.00825 2.12 0.08 0.00507 1.41 2.4997 0.9803 3179060 Maybridge4_002639 O=C(Cc1ccc(Oc2ccccc2)cc1)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 H22 compound treatment 0.07 -7.5E-4 -0.19 0.079 0.00407 1.13 0.6643 0.5782 3064516 Maybridge4_002640 CCOC(=S)Nc1cccc2ccccc12 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 H23 mock treatment 0.069 -0.00175 -0.45 0.073 -0.00193 -0.54 -0.6993 -0.9961 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 H24 positive control 0.083 0.0123 3.15 0.082 0.00707 1.97 3.6218 0.9742 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 I01 compound treatment 0.087 0.0163 4.18 0.085 0.0101 2.8 4.9408 0.981 1349293 Maybridge4_002641 COC(=O)c1ccc-2c(c1)N(C)S(=O)(=O)c3cnc(SC)nc23 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 I02 compound treatment 0.074 0.00325 0.84 0.073 -0.00193 -0.54 0.211 0.212 3064517 Maybridge4_002642 NNC(=O)c1cncc(C#Cc2ccccc2)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 I03 compound treatment 0.134 0.0633 16.28 0.142 0.0671 18.68 24.7223 0.9977 1297264 Maybridge4_002643 Clc1ccc(cc1)C(=O)NC(=S)NCC2COc3ccccc3O2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 I04 compound treatment 0.07 -7.5E-4 -0.19 0.074 -9.33E-4 -0.26 -0.3203 -0.9893 1443440 Maybridge4_002644 COC(=O)c1csc(c1OC)S(=O)(=O)N=S(=O)(C)c2cccs2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 I05 compound treatment 0.074 0.00325 0.84 0.073 -0.00193 -0.54 0.211 0.212 3179061 Maybridge4_002645 COc1ccc2nc([nH]c2c1)S(=O)Cc3ncc(C)c(OC)c3C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 I06 compound treatment 0.085 0.0143 3.67 0.086 0.0111 3.08 4.7736 0.9962 1207614 Maybridge4_002646 Clc1ccc(cc1)S(=O)(=O)N2CCC(CC2)n3cccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 I07 compound treatment 0.069 -0.00175 -0.45 0.072 -0.00293 -0.82 -0.8962 -0.9607 1176328 Maybridge4_002647 Cn1c(Cc2nn(C)c(=O)c3ccccc23)nnc1SCC(=O)c4ccc(Cl)cc4Cl 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 I08 compound treatment 0.143 0.0722 18.6 0.133 0.0581 16.17 24.5885 0.9976 1698489 Maybridge4_002648 Clc1ccc(Cn2c(=O)c(C#N)nn(c3ccccc3)c2=O)c(Cl)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 I09 compound treatment 0.072 0.00125 0.32 0.071 -0.00393 -1.1 -0.547 -0.4791 1223405 Maybridge4_002649 CCOC(=O)NC(=O)c1cn(CCc2ccncc2)c(=O)[nH]c1=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 I10 compound treatment 0.087 0.0163 4.18 0.086 0.0111 3.08 5.1378 0.9887 1257420 Maybridge4_002650 CSc1nn(cc1C(=O)N2CCCCC2)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 I11 compound treatment 0.07 -7.5E-4 -0.19 0.069 -0.00593 -1.65 -1.305 -0.7844 3064519 Maybridge4_002651 CC(C)n1cc(/C(=N/O)/N)c(=O)n(Cc2ccccc2)c1=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 I12 compound treatment 0.065 -0.00575 -1.48 0.072 -0.00293 -0.82 -1.6245 -0.9607 1544891 Maybridge4_002652 OC(=O)C1CNC(=O)N1C(=O)OCc2ccccc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 I13 compound treatment 0.076 0.00525 1.35 0.08 0.00507 1.41 1.9536 0.9998 1689579 Maybridge4_002653 CCOC(=O)c1csc(n1)c2cn(C(C)C)c(=O)n(Cc3ccccc3)c2=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 I14 compound treatment 0.068 -0.00275 -0.71 0.069 -0.00593 -1.65 -1.6691 -0.9285 3064520 Maybridge4_002654 Cn1c(CSCC(=O)Nc2ccccc2)nnc1SCc3ccc(Cl)cc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 I15 compound treatment 0.127 0.0563 14.48 0.112 0.0371 10.32 17.5401 0.9862 3179062 Maybridge4_002655 Cc1[nH]c2ccccc2c1SCc3nnc(SCc4ccc(Cl)cc4)n3C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 I16 compound treatment 0.07 -7.5E-4 -0.19 0.076 0.00107 0.3 0.0735 0.2075 3064521 Maybridge4_002656 Cn1c(CSCC(=O)Nc2ccccc2)nnc1SCC(=O)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 I17 compound treatment 0.129 0.0583 15.0 0.122 0.0471 13.11 19.8735 0.9977 3179063 Maybridge4_002657 COc1ccc(Oc2cc(nc3cc(nn23)C(C)(C)C)C(F)(F)F)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 I18 compound treatment 0.081 0.0103 2.64 0.087 0.0121 3.36 4.2423 0.9928 3179064 Maybridge4_002658 CSc1cccc(NC(=O)N(Cc2ccccc2)C(=O)CC#N)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 I19 compound treatment 0.072 0.00125 0.32 0.071 -0.00393 -1.1 -0.547 -0.4791 1399847 Maybridge4_002659 O=S1(=O)CC(N2CCCC2)c3ccccc31 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 I20 compound treatment 0.096 0.0253 6.5 0.09 0.0151 4.2 7.564 0.9776 3179065 Maybridge4_002660 FC(F)(F)c1cc(N2CCC(CC2)n3cccc3)c4ccccc4n1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 I21 compound treatment 0.17 0.0993 25.55 0.161 0.0861 23.97 35.018 0.9995 3064522 Maybridge4_002661 O=C(OCc1ccc(C#Cc2ccccc2)s1)c3cccs3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 I22 compound treatment 0.087 0.0163 4.18 0.071 -0.00393 -1.1 2.1839 0.505 1065782 Maybridge4_002662 O=C(NCc1ccccc1)Nc2ccccc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 I23 mock treatment 0.07 -7.5E-4 -0.19 0.07 -0.00493 -1.37 -1.108 -0.7986 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 I24 positive control 0.081 0.0103 2.64 0.079 0.00407 1.13 2.6669 0.9287 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 J01 compound treatment 0.116 0.0452 11.65 0.128 0.0531 14.78 18.6883 0.9931 3064524 Maybridge4_002663 Cn1c(SCc2cc(F)cc(F)c2)nnc1c3ccc4nonc4c3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 J02 compound treatment 0.074 0.00325 0.84 0.075 6.67E-5 0.02 0.6048 0.7226 3179066 Maybridge4_002664 Clc1ccc2scc(CC(=O)OCc3ccccc3)c2c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 J03 compound treatment 0.136 0.0653 16.8 0.133 0.0581 16.17 23.3141 0.9998 3064525 Maybridge4_002665 FC(F)(F)c1cc(N2CCCCC2)c3cccc(Cl)c3n1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 J04 compound treatment 0.169 0.0983 25.3 0.171 0.0961 26.75 36.8052 0.9996 3179067 Maybridge4_002666 NC(=S)Cc1c(Cl)sc2ccc(Cl)cc12 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 J05 compound treatment 0.075 0.00425 1.09 0.08 0.00507 1.41 1.7715 0.9921 1230774 Maybridge4_002667 O=c1c(C#N)cn(C2CC2)c(=O)n1Cc3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 J06 compound treatment 0.17 0.0993 25.55 0.177 0.102 28.42 38.1688 0.9986 3064526 Maybridge4_002668 Cc1c(sc2ccc(Cl)cc12)c3ccnc(SCC=C)n3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 J07 compound treatment 0.095 0.0243 6.24 0.094 0.0191 5.31 8.1696 0.9968 1249532 Maybridge4_002669 Cc1cc(NC(=O)c2ccc3nonc3c2)on1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 J08 compound treatment 0.073 0.00225 0.58 0.074 -9.33E-4 -0.26 0.2258 0.3557 1640712 Maybridge4_002670 CN1C(=O)CC(Sc2ccccc12)c3ccsc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 J09 compound treatment 0.103 0.0323 8.3 0.104 0.0291 8.09 11.5953 0.9999 3064554 Maybridge4_002671 Cc1ccc2c(cc(nc2c1)C(F)(F)F)N3CC4CCC(CC4)C3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 J10 compound treatment 0.115 0.0442 11.39 0.113 0.0381 10.6 15.5524 0.9994 3064555 Maybridge4_002672 Fc1ccc(NC2=NNC(=O)C2)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 J11 compound treatment 0.07 -7.5E-4 -0.19 0.07 -0.00493 -1.37 -1.108 -0.7986 3064556 Maybridge4_002673 COc1ccc(cc1)c2ccnc(SCC(=O)N3CCOCC3)n2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 J12 compound treatment 0.091 0.0203 5.21 0.093 0.0181 5.03 7.2445 0.9998 1655959 Maybridge4_002674 CCCS(=O)(=O)c1ccc(NC(=O)Nc2ccc(Cl)cc2Cl)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 J13 compound treatment 0.07 -7.5E-4 -0.19 0.075 6.67E-5 0.02 -0.1234 -0.6362 1535225 Maybridge4_002675 CC(C)N(C(C)C)C(=O)N1CCN(CC1)c2ccnc3cc(Cl)ccc23 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 J14 compound treatment 0.068 -0.00275 -0.71 0.076 0.00107 0.3 -0.2906 -0.3785 3064558 Maybridge4_002676 FC(F)(F)COc1ccc(Br)c(OCC(F)(F)F)c1C#N 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 J15 compound treatment 0.138 0.0673 17.31 0.132 0.0571 15.89 23.4813 0.9991 3064559 Maybridge4_002677 COC(=O)c1ccccc1SC(=O)c2ccc(Cl)c(Cl)c2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 J16 compound treatment 0.124 0.0532 13.71 0.126 0.0511 14.22 19.7509 0.9998 1497304 Maybridge4_002678 Clc1ccc(NC(=S)NS(=O)(=O)c2ccccc2)cc1Cl 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 J17 compound treatment 0.139 0.0683 17.57 0.151 0.0761 21.18 27.4049 0.9957 1102994 Maybridge4_002679 CCOC(=O)NC(=S)c1cccn1C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 J18 compound treatment 0.072 0.00125 0.32 0.082 0.00707 1.97 1.6192 0.812 1203607 Maybridge4_002680 COc1ccc(OC)c(c1)S(=O)(=O)N2CCCC2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 J19 compound treatment 0.069 -0.00175 -0.45 0.088 0.0131 3.64 2.2545 0.6149 3064560 Maybridge4_002681 S=C1NCN(Cc2ccncc2)CN1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 J20 compound treatment 0.116 0.0452 11.65 0.116 0.0411 11.44 16.3252 1.0 3179068 Maybridge4_002682 Cc1cc(Br)c(NC(=S)NC(=O)C(C)(C)C)c(Br)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 J21 compound treatment 0.074 0.00325 0.84 0.085 0.0101 2.8 2.5741 0.8798 3064561 Maybridge4_002683 COC(=O)c1ccc2[nH]cnc2c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 J22 compound treatment 0.069 -0.00175 -0.45 0.079 0.00407 1.13 0.4822 0.3956 3179069 Maybridge4_002684 O=c1[nH]nc([nH]1)N2CCSCC2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 J23 mock treatment 0.071 2.5E-4 0.06 0.076 0.00107 0.3 0.2556 0.8408 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 J24 positive control 0.078 0.00725 1.87 0.078 0.00307 0.85 1.9238 0.9372 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 K01 compound treatment 0.076 0.00525 1.35 0.076 0.00107 0.3 1.1659 0.8424 3064562 Maybridge4_002685 COC(=O)c1ccc2OCCc2c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 K02 compound treatment 0.15 0.0793 20.4 0.147 0.0721 20.07 28.6199 1.0 3179151 Maybridge4_002686 CCOC(=O)c1cncc(C#CCOC(=O)c2c(C)onc2c3ccccc3)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 K03 compound treatment 0.101 0.0302 7.79 0.126 0.0511 14.22 15.5636 0.9598 1273322 Maybridge4_002687 CCOC(=O)Cc1nn(Cc2nc(cs2)c3ccccc3)c(=O)c4ccccc14 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 K04 compound treatment 0.095 0.0243 6.24 0.096 0.0211 5.87 8.5635 0.9995 3179152 Maybridge4_002688 CN(CCOC(=O)c1ccccc1)c2cc(nc3ccccc23)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 K05 compound treatment 0.075 0.00425 1.09 0.075 6.67E-5 0.02 0.7869 0.719 3179153 Maybridge4_002689 COc1cccn(Cc2nnc(SCC(=O)c3ccccc3)o2)c1=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 K06 compound treatment 0.111 0.0403 10.36 0.11 0.0351 9.77 14.2334 0.9996 1551980 Maybridge4_002690 Clc1cc(Cl)cc(NC(=O)N2CCC(CC2)n3cccc3)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 K07 compound treatment 0.072 0.00125 0.32 0.073 -0.00193 -0.54 -0.1531 -0.2441 3179154 Maybridge4_002691 CN(C)c1cc(nc2cc(nn12)C(C)(C)C)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 K08 compound treatment 0.092 0.0213 5.47 0.093 0.0181 5.03 7.4265 0.9991 3064563 Maybridge4_002692 CCCn1c(=O)c(nn(c2ccccc2)c1=O)/C(=N/O)/N 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 K09 compound treatment 0.076 0.00525 1.35 0.075 6.67E-5 0.02 0.9689 0.7168 1707363 Maybridge4_002693 Cc1ncn2cc([nH]c(=O)c12)c3ccc(Cl)cc3Cl 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 K10 compound treatment 0.129 0.0583 15.0 0.126 0.0511 14.22 20.6612 0.9996 3179155 Maybridge4_002694 COC(=O)c1c(C)[nH]c(C)c1/C=C(\C#N)/S(=O)(=O)c2ccc(Cl)cc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 K11 compound treatment 0.069 -0.00175 -0.45 0.08 0.00507 1.41 0.6792 0.4585 1478501 Maybridge4_002695 CC(C)n1cc(c2noc(n2)c3cccs3)c(=O)n(Cc4ccccc4)c1=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 K12 compound treatment 0.162 0.0912 23.49 0.158 0.0831 23.13 32.9707 1.0 3179156 Maybridge4_002696 O=S(=O)(c1ccccc1)n2ccc(n2)c3ccc(C#Cc4ccccc4)cc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 K13 compound treatment 0.086 0.0153 3.93 0.078 0.00307 0.85 3.3803 0.8412 1572994 Maybridge4_002697 CC(C)n1cc(c2nc(cs2)C(=O)NN)c(=O)n(Cc3ccccc3)c1=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 K14 compound treatment 0.078 0.00725 1.87 0.078 0.00307 0.85 1.9238 0.9372 1626520 Maybridge4_002698 O=C(CSc1nc2ccccc2o1)N3CCC(CC3)n4cccc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 K15 compound treatment 0.117 0.0462 11.91 0.123 0.0481 13.39 17.8857 0.9983 3179157 Maybridge4_002699 COc1cc(nc2ccc(C#CCOC(=O)c3ccccc3)cc12)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 K16 compound treatment 0.068 -0.00275 -0.71 0.075 6.67E-5 0.02 -0.4875 -0.6883 3064565 Maybridge4_002700 CCOC(=O)N1CCC(CC1)N/C=C(\C#N)/S(=O)(=O)c2cccnc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 K17 compound treatment 0.073 0.00225 0.58 0.08 0.00507 1.41 1.4074 0.9227 3179158 Maybridge4_002701 Cc1ccc(cc1)S(=O)(=O)CCN2CCC(CC2)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 K18 compound treatment 0.098 0.0273 7.02 0.107 0.0321 8.93 11.2758 0.9929 3064567 Maybridge4_002702 CSc1scc(NC(=O)c2ccc(Cl)cc2)c1S(=O)(=O)C(C)C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 K19 compound treatment 0.17 0.0993 25.55 0.156 0.0811 22.58 34.0334 0.9981 3179159 Maybridge4_002703 O=S(=O)(/C(=C/N1CCN(CC1)C(c2ccccc2)c3ccccc3)/C#N)c4ccccc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 K20 compound treatment 0.204 0.133 34.31 0.201 0.126 35.11 49.085 0.9999 3064568 Maybridge4_002704 COC(=O)c1scc2c(cc(nc12)C(F)(F)F)N3CCC(CC3)n4cccc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 K21 compound treatment 0.07 -7.5E-4 -0.19 0.077 0.00207 0.58 0.2704 0.4455 3179160 Maybridge4_002705 CCOC(=O)C1CCN(CC1)/C=C(\C#N)/S(=O)(=O)c2ccccc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 K22 compound treatment 0.118 0.0473 12.17 0.134 0.0591 16.45 20.234 0.989 1717162 Maybridge4_002706 CCCS(=O)(=O)c1cnc(nc1N)C2COc3ccccc3O2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 K23 mock treatment 0.073 0.00225 0.58 0.075 6.67E-5 0.02 0.4228 0.7294 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 K24 positive control 0.08 0.00925 2.38 0.079 0.00407 1.13 2.4849 0.9423 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 L01 compound treatment 0.077 0.00625 1.61 0.081 0.00607 1.69 2.3325 0.9997 1068568 Maybridge4_002707 CCOC(=O)c1c(C)oc(=O)c(Br)c1C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 L02 compound treatment 0.097 0.0262 6.76 0.102 0.0271 7.54 10.1091 0.9985 3064569 Maybridge4_002708 Clc1sc2ccc(Cl)cc2c1CC#N 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 L03 compound treatment 0.116 0.0452 11.65 0.116 0.0411 11.44 16.3252 1.0 1726018 Maybridge4_002709 Clc1ccc(cc1)S(=O)(=O)CCN2CCN(CC2)C(c3ccccc3)c4ccccc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 L04 compound treatment 0.146 0.0752 19.37 0.149 0.0741 20.63 28.2855 0.9995 3064570 Maybridge4_002710 CCOC(=O)c1csc(Cc2c(Cl)sc3ccc(Cl)cc23)n1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 L05 compound treatment 0.092 0.0213 5.47 0.09 0.0151 4.2 6.8357 0.9914 3179161 Maybridge4_002711 Fc1ccc(NC(=O)NC(=O)CC#N)c(F)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 L06 compound treatment 0.111 0.0403 10.36 0.117 0.0421 11.72 15.6118 0.9981 1493566 Maybridge4_002712 O=C(SC1=NCCc2ccccc12)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 L07 compound treatment 0.074 0.00325 0.84 0.073 -0.00193 -0.54 0.211 0.212 3064593 Maybridge4_002713 OC1(CC(=NN1)c2nccs2)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 L08 compound treatment 0.203 0.132 34.05 0.221 0.146 40.68 52.8414 0.9961 3064595 Maybridge4_002714 Cc1c(/C=C/C(=O)Oc2ccc(C#N)cc2)sc3ccccc13 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 L09 compound treatment 0.119 0.0483 12.42 0.122 0.0471 13.11 18.0529 0.9996 3064596 Maybridge4_002715 CCOC(=O)C1CCN(CC1)c2cc(nc3ccc(C)cc23)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 L10 compound treatment 0.094 0.0233 5.99 0.112 0.0371 10.32 11.5322 0.9664 3064597 Maybridge4_002716 CC(C)c1ccc(NC2=NNC(=O)C2)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 L11 compound treatment 0.069 -0.00175 -0.45 0.077 0.00207 0.58 0.0884 0.1209 3482130 Maybridge4_002717 CC(C)(C)OC(=O)Nc1ncnc2n(cnc12)C3OC(CO)C4OC(C)(C)OC34 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 L12 compound treatment 0.072 0.00125 0.32 0.082 0.00707 1.97 1.6192 0.812 3064598 Maybridge4_002718 Cc1n[nH]c(C)c1Sc2nccc(n2)c3cccnc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 L13 compound treatment 0.072 0.00125 0.32 0.076 0.00107 0.3 0.4376 0.9992 1572567 Maybridge4_002719 O=C(NCc1ccc(s1)S(=O)(=O)NCCN2CCOCC2)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 L14 compound treatment 0.068 -0.00275 -0.71 0.069 -0.00593 -1.65 -1.6691 -0.9285 3064599 Maybridge4_002720 NC(=O)c1csc(n1)c2cccnc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 L15 compound treatment 0.078 0.00725 1.87 0.081 0.00607 1.69 2.5146 0.9988 3064600 Maybridge4_002721 Clc1ccc(cc1)c2nnc(o2)c3ccc(Cl)cc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 L16 compound treatment 0.074 0.00325 0.84 0.081 0.00607 1.69 1.7864 0.9475 3179162 Maybridge4_002722 CN(C)c1ccc(cc1)C2OCCN2C(=S)Nc3ccccc3F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 L17 compound treatment 0.463 0.392 100.99 0.447 0.372 103.62 144.6817 0.9999 3064601 Maybridge4_002723 Cc1ccc(cc1)C(=O)CSC2=NCCCCC2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 L18 compound treatment 0.072 0.00125 0.32 0.073 -0.00193 -0.54 -0.1531 -0.2441 3179163 Maybridge4_002724 CC(C)CNC(=S)N1CCCC1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 L19 compound treatment 0.094 0.0233 5.99 0.101 0.0261 7.26 9.366 0.9954 1286430 Maybridge4_002725 S=C1NCN(CN1)C(Cc2ccccc2)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 L20 compound treatment 0.101 0.0302 7.79 0.1 0.0251 6.98 10.4435 0.9985 3064602 Maybridge4_002726 CCOC(=O)NC(=S)Nc1ccc(cc1)N2CC(C)OC(C)C2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 L21 compound treatment 0.114 0.0432 11.14 0.127 0.0521 14.5 18.1273 0.9915 3179164 Maybridge4_002727 NNC(=O)C1CCC(CC1)c2ccc(Cl)cc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 L22 compound treatment 0.144 0.0732 18.86 0.148 0.0731 20.35 27.7244 0.9993 1090059 Maybridge4_002728 CCOC(=O)NC(=S)c1ccc[nH]1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 L23 mock treatment 0.072 0.00125 0.32 0.074 -9.33E-4 -0.26 0.0438 0.1058 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 L24 positive control 0.078 0.00725 1.87 0.085 0.0101 2.8 3.3023 0.9805 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 M01 compound treatment 0.084 0.0133 3.41 0.095 0.0201 5.59 6.3639 0.972 3179165 Maybridge4_002729 O=S(=O)(Cc1ccc2nonc2c1)c3cccs3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 M02 compound treatment 0.078 0.00725 1.87 0.084 0.00907 2.53 3.1054 0.9889 3179166 Maybridge4_002730 CCOC(=O)c1cncc(C#CCOC(=O)c2ccc(Cl)cn2)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 M03 compound treatment 0.082 0.0113 2.9 0.087 0.0121 3.36 4.4244 0.9973 3064603 Maybridge4_002731 CN1c2sc(C)c(C)c2-c3nc(SCC(=O)C(C)(C)C)ncc3S1(=O)=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 M04 compound treatment 0.1 0.0293 7.53 0.1 0.0251 6.98 10.2615 0.9993 3179167 Maybridge4_002732 Clc1cc(Cl)cc(NC(=O)Nc2cc(n[nH]2)c3ccccc3)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 M05 compound treatment 0.091 0.0203 5.21 0.093 0.0181 5.03 7.2445 0.9998 1536304 Maybridge4_002733 Clc1ccc(cc1)c2csc(COc3ccc4nonc4c3)n2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 M06 compound treatment 0.073 0.00225 0.58 0.086 0.0111 3.08 2.5889 0.8256 3179168 Maybridge4_002734 O=S(=O)(/C(=C/N1CCC(CC1)n2cccc2)/C#N)c3ccccn3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 M07 compound treatment 0.062 -0.00875 -2.25 0.07 -0.00493 -1.37 -2.5645 -0.9719 1203004 Maybridge4_002735 Cn1c(S)nnc1CC2Sc3ccccc3NC2=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 M08 compound treatment 0.083 0.0123 3.15 0.088 0.0131 3.64 4.8034 0.9975 1245628 Maybridge4_002736 CCCn1c(=O)c(C#N)nn(c2ccc(OC)cc2)c1=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 M09 compound treatment 0.09 0.0193 4.96 0.089 0.0141 3.92 6.2747 0.9932 1544442 Maybridge4_002737 CCOC(=O)NC(=O)c1cn(Cc2ccco2)c(=O)n(Cc3ccccc3)c1=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 M10 compound treatment 0.123 0.0522 13.45 0.12 0.0451 12.55 18.3873 0.9994 3064605 Maybridge4_002738 FC(F)(F)Oc1ccc(NC(=O)OC2CN(C2)C(c3ccccc3)c4ccccc4)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 M11 compound treatment 0.125 0.0543 13.97 0.117 0.0421 11.72 18.1607 0.9962 3179169 Maybridge4_002739 Cn1c(CSc2cc(nc3ccccc23)C(F)(F)F)nnc1SCC(=O)c4ccccc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 M12 compound treatment 0.14 0.0693 17.83 0.135 0.0601 16.73 24.4362 0.9995 3179170 Maybridge4_002740 Cc1ccc2nc(cc(N3CCN(CC3)/C=C(/C#N)\S(=O)(=O)c4ccccn4)c2c1)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 M13 compound treatment 0.107 0.0362 9.33 0.109 0.0341 9.49 13.3082 1.0 3064606 Maybridge4_002741 COC(=O)c1scc2c(Sc3ccc(Cl)cc3)cc(nc12)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 M14 compound treatment 0.088 0.0173 4.44 0.086 0.0111 3.08 5.3198 0.9841 1624356 Maybridge4_002742 Cn1c(S)nnc1CSC2CN(C2)C(c3ccccc3)c4ccccc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 M15 compound treatment 0.07 -7.5E-4 -0.19 0.071 -0.00393 -1.1 -0.9111 -0.8191 1609003 Maybridge4_002743 Clc1ccc(Cn2ccnc2COC(=O)c3ccccc3Cl)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 M16 compound treatment 0.069 -0.00175 -0.45 0.072 -0.00293 -0.82 -0.8962 -0.9607 3179171 Maybridge4_002744 CCOC(=O)N1CCC(CC1)N/C=C(\C#N)/S(=O)(=O)C(C)C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 M17 compound treatment 0.082 0.0113 2.9 0.087 0.0121 3.36 4.4244 0.9973 3064607 Maybridge4_002745 Clc1ccc(SC2CS(=O)(=O)c3ccccc23)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 M18 compound treatment 0.072 0.00125 0.32 0.078 0.00307 0.85 0.8315 0.911 3179261 Maybridge4_002746 COc1ccc(cc1OC)S(=O)(=O)N(CCC(=O)O)Cc2ccco2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 M19 compound treatment 0.146 0.0752 19.37 0.139 0.0641 17.84 26.3162 0.9992 3064609 Maybridge4_002747 CC(C)(C)S(=O)(=O)/C(=C/N1CCN(CC1)C(c2ccccc2)c3ccccc3)/C#N 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 M20 compound treatment 0.071 2.5E-4 0.06 0.078 0.00307 0.85 0.6494 0.7582 1049769 Maybridge4_002748 CC(C)NC(=O)c1ccccc1N 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 M21 compound treatment 0.072 0.00125 0.32 0.078 0.00307 0.85 0.8315 0.911 3063912 Maybridge4_002749 CCOC(=O)C1CCN(CC1)/C=C(\C#N)/S(=O)(=O)C(C)(C)C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 M22 compound treatment 0.069 -0.00175 -0.45 0.074 -9.33E-4 -0.26 -0.5024 -0.9658 1471006 Maybridge4_002750 Nc1cc(=O)n(Cc2ccccc2)c(=O)n1c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 M23 mock treatment 0.068 -0.00275 -0.71 0.075 6.67E-5 0.02 -0.4875 -0.6883 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 M24 positive control 0.082 0.0113 2.9 0.079 0.00407 1.13 2.849 0.9161 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 N01 compound treatment 0.075 0.00425 1.09 0.077 0.00207 0.58 1.1807 0.955 3063913 Maybridge4_002751 Cn1c(SCC(=O)NCC=C)nnc1c2ccc3nonc3c2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 N02 compound treatment 0.114 0.0432 11.14 0.123 0.0481 13.39 17.3396 0.9958 3063914 Maybridge4_002752 Cc1c(sc2ccc(Cl)cc12)S(=O)(=O)Nc3ccc(Cl)cc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 N03 compound treatment 0.155 0.0843 21.69 0.172 0.0971 27.03 34.4533 0.994 1156673 Maybridge4_002753 O=S(=O)(N1CCC(CC1)C(c2ccccc2)c3ccccc3)c4cccs4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 N04 compound treatment 0.129 0.0583 15.0 0.13 0.0551 15.34 21.4489 0.9999 3063915 Maybridge4_002754 CNC(=O)c1csc(Cc2c(Cl)sc3ccc(Cl)cc23)n1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 N05 compound treatment 0.07 -7.5E-4 -0.19 0.101 0.0261 7.26 4.9966 0.6881 1656700 Maybridge4_002755 COc1ccc(cc1)n2c(N)cc(=O)[nH]c2=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 N06 compound treatment 0.183 0.112 28.9 0.2 0.125 34.83 45.0648 0.9957 3063916 Maybridge4_002756 CN(c1ccccc1)S(=O)(=O)c2sc3ccc(Cl)cc3c2C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 N07 compound treatment 0.082 0.0113 2.9 0.088 0.0131 3.64 4.6213 0.9936 3179262 Maybridge4_002757 CCOC(=O)N1CCN(CC1)c2cc(nc3c(Cl)cccc23)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 N08 compound treatment 0.167 0.0963 24.78 0.173 0.0981 27.31 36.8349 0.9988 3179263 Maybridge4_002758 COc1ccc(OC(=O)/C=C/c2sc3ccccc3c2C)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 N09 compound treatment 0.12 0.0493 12.68 0.127 0.0521 14.5 19.2196 0.9978 3063917 Maybridge4_002759 CCOC(=O)c1ccc2nc(cc(NC3CCN(Cc4ccccc4)CC3)c2c1)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 N10 compound treatment 0.076 0.00525 1.35 0.073 -0.00193 -0.54 0.5751 0.3952 3179264 Maybridge4_002760 CNC(=S)NCc1sc2ccccc2c1C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 N11 compound treatment 0.113 0.0423 10.88 0.115 0.0401 11.16 15.5821 0.9999 1569047 Maybridge4_002761 CCc1ccc2[nH]c(cc2c1)C(=O)NCc3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 N12 compound treatment 0.095 0.0243 6.24 0.095 0.0201 5.59 8.3665 0.9985 3063918 Maybridge4_002762 Cc1nc2cc(nn2c(C)c1Sc3nccc(n3)c4cccnc4)c5ccccc5 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 N13 compound treatment 0.141 0.0703 18.09 0.148 0.0731 20.35 27.1783 0.9983 1306797 Maybridge4_002763 COc1cc2CCN=C(c3ccc(Cl)cc3)c2cc1OC 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 N14 compound treatment 0.077 0.00625 1.61 0.083 0.00807 2.25 2.7264 0.9866 3063920 Maybridge4_002764 C(N1CCC(=N1)c2cccs2)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 N15 compound treatment 0.352 0.281 72.41 0.371 0.296 82.45 109.5069 0.9979 3179265 Maybridge4_002765 CC(C)(C)Sc1nc2ccccc2[nH]c1=S 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 N16 compound treatment 0.092 0.0213 5.47 0.093 0.0181 5.03 7.4265 0.9991 1707053 Maybridge4_002766 CCOC(=O)NC(=S)c1ccc(OC)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 N17 compound treatment 0.077 0.00625 1.61 0.077 0.00207 0.58 1.5448 0.9039 3179266 Maybridge4_002767 Clc1cccc(c1)C(=O)Nc2nccs2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 N18 compound treatment 0.074 0.00325 0.84 0.075 6.67E-5 0.02 0.6048 0.7226 1022738 Maybridge4_002768 NS(=O)(=O)c1ccc(Cl)c(Cl)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 N19 compound treatment 0.092 0.0213 5.47 0.093 0.0181 5.03 7.4265 0.9991 3179267 Maybridge4_002769 Cc1nnsc1c2nnc(S)n2C3CC3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 N20 compound treatment 0.103 0.0323 8.3 0.115 0.0401 11.16 13.7615 0.9894 1602154 Maybridge4_002770 CC1CN(CC(C)O1)c2ccc(NC(=S)Nc3ccc(cc3)N4CC(C)OC(C)C4)cc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 N21 compound treatment 0.096 0.0253 6.5 0.102 0.0271 7.54 9.9271 0.9973 1095185 Maybridge4_002771 Nc1c(sc2ncccc12)C(=O)O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 N22 compound treatment 0.075 0.00425 1.09 0.08 0.00507 1.41 1.7715 0.9921 3063921 Maybridge4_002772 OCCNC(=S)NC1CCCC1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 N23 mock treatment 0.066 -0.00475 -1.22 0.077 0.00207 0.58 -0.4578 -0.3387 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 N24 positive control 0.078 0.00725 1.87 0.088 0.0131 3.64 3.8931 0.9519 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 O01 compound treatment 0.079 0.00825 2.12 0.074 -9.33E-4 -0.26 1.3182 0.616 1227681 Maybridge4_002773 CSc1ncc(C(=O)NN)n1C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 O02 compound treatment 0.072 0.00125 0.32 0.073 -0.00193 -0.54 -0.1531 -0.2441 3179268 Maybridge4_002774 Cn1c(CN2C(=O)CSc3ccc(cc23)C(F)(F)F)nnc1SCc4ccccc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 O03 compound treatment 0.075 0.00425 1.09 0.074 -9.33E-4 -0.26 0.59 0.5245 1733846 Maybridge4_002775 CNC(=O)c1cc(Br)cc2CCOc21 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 O04 compound treatment 0.09 0.0193 4.96 0.094 0.0191 5.31 7.2593 0.9994 3179269 Maybridge4_002776 FC(F)(F)Oc1ccc(NC(=O)Nc2cc(n[nH]2)c3ccccc3)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 O05 compound treatment 0.086 0.0153 3.93 0.087 0.0121 3.36 5.1526 0.997 3063922 Maybridge4_002777 CCOC(=O)c1sc(COc2ccc3nonc3c2)nc1C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 O06 compound treatment 0.071 2.5E-4 0.06 0.072 -0.00293 -0.82 -0.5321 -0.6494 3179270 Maybridge4_002778 CC(C)(C)S(=O)(=O)/C(=C/N1CCC(CC1)n2cccc2)/C#N 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 O07 compound treatment 0.133 0.0623 16.03 0.136 0.0611 17.01 23.3587 0.9996 3063923 Maybridge4_002779 CCSc1cc(nc2cc(nn12)C(C)(C)C)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 O08 compound treatment 0.173 0.102 26.33 0.196 0.121 33.72 42.4565 0.9925 3063924 Maybridge4_002780 CSc1nn(cc1C(=O)Nc2ccc(Cl)cc2)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 O09 compound treatment 0.073 0.00225 0.58 0.089 0.0141 3.92 3.1797 0.8029 1030103 Maybridge4_002781 O=c1[nH]c(=O)n(cc1C#N)C2CCCCC2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 O10 compound treatment 0.086 0.0153 3.93 0.099 0.0241 6.7 7.5157 0.9675 1309716 Maybridge4_002782 CSc1nc2c(Cl)cccc2c3n(C)[nH]c(=O)c13 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 O11 compound treatment 0.08 0.00925 2.38 0.086 0.0111 3.08 3.8633 0.9919 1606150 Maybridge4_002783 Cc1[nH]c2ccccc2c1SCC(=O)NN 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 O12 compound treatment 0.103 0.0323 8.3 0.11 0.0351 9.77 12.7769 0.9967 1579140 Maybridge4_002784 CCOC(=O)Cn1n(C)c2c(cnc3n(C)nc(C)c32)c1=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 O13 compound treatment 0.078 0.00725 1.87 0.086 0.0111 3.08 3.4992 0.9711 1697318 Maybridge4_002785 CCOC(=O)Cn1c(=O)c(cn(C(C)C)c1=O)C(=S)N 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 O14 compound treatment 0.124 0.0532 13.71 0.141 0.0661 18.4 22.7048 0.9895 1214988 Maybridge4_002786 Clc1ccc(OC(=O)c2c(nnc3ccccc23)c4ccccc4)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 O15 compound treatment 0.126 0.0553 14.23 0.138 0.0631 17.56 22.4781 0.9945 3063958 Maybridge4_002787 COc1cc(nc2ccc(C#CCOC(=O)Nc3ccccc3)cc12)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 O16 compound treatment 0.193 0.122 31.48 0.219 0.144 40.12 50.627 0.9928 3063959 Maybridge4_002788 Clc1ccc(SCc2n[nH]c(=O)c3ccccc23)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 O17 compound treatment 0.073 0.00225 0.58 0.076 0.00107 0.3 0.6197 0.9519 1427896 Maybridge4_002789 Cc1ccc(cc1)S(=O)(=O)C2CS(=O)(=O)c3ccccc23 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 O18 compound treatment 0.108 0.0372 9.59 0.105 0.0301 8.37 12.7026 0.9977 3063960 Maybridge4_002790 COc1ccc(cc1OC)S(=O)(=O)N(CCC#N)C2CCCc3ccccc23 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 O19 compound treatment 0.072 0.00125 0.32 0.08 0.00507 1.41 1.2253 0.8466 1698976 Maybridge4_002791 Cn1c(=O)c(cn(c2ccccc2)c1=O)c3nc(cs3)c4ccccc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 O20 compound treatment 0.073 0.00225 0.58 0.078 0.00307 0.85 1.0135 0.9821 3179271 Maybridge4_002792 CCOC(=O)C1CCC(N1C(=O)Nc2ccc(Cl)cc2)C(=O)OCC 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 O21 compound treatment 0.12 0.0493 12.68 0.121 0.0461 12.83 18.0381 1.0 3063961 Maybridge4_002793 FC(F)(F)c1cccc(NC(=O)CN2C(=O)CSc3ccc(cc23)C(F)(F)F)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 O22 compound treatment 0.155 0.0843 21.69 0.157 0.0821 22.86 31.4994 0.9997 1142886 Maybridge4_002794 Nc1nc(ncc1S(=O)(=O)c2ccccc2)C3COc4ccccc4O3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 O23 mock treatment 0.072 0.00125 0.32 0.079 0.00407 1.13 1.0284 0.8735 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 O24 positive control 0.079 0.00825 2.12 0.087 0.0121 3.36 3.8782 0.9755 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 P01 compound treatment 0.085 0.0143 3.67 0.08 0.00507 1.41 3.5921 0.9138 1672516 Maybridge4_002795 O=C(Nc1ccc2nonc2c1)N3CCOCC3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 P02 compound treatment 0.194 0.123 31.73 0.192 0.117 32.6 45.4921 0.9999 3179272 Maybridge4_002796 FC(F)(F)c1ccccc1NC(=S)Nc2ccc3C=CS(=O)(=O)c3c2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 P03 compound treatment 0.076 0.00525 1.35 0.076 0.00107 0.3 1.1659 0.8424 3063964 Maybridge4_002797 CCCn1c(=O)n(c2ccccc2C)c3[nH]cnc3c1=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 P04 compound treatment 0.092 0.0213 5.47 0.103 0.0281 7.82 9.3958 0.9848 1153341 Maybridge4_002798 Cc1c(CC(=O)NN)sc2ccc(Cl)cc12 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 P05 compound treatment 0.08 0.00925 2.38 0.084 0.00907 2.53 3.4695 0.9996 1289003 Maybridge4_002799 Cc1ccccc1n2ccc(=O)[nH]c2=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 P06 compound treatment 0.11 0.0393 10.11 0.11 0.0351 9.77 14.0513 0.9999 3179273 Maybridge4_002800 Cc1c(sc2ccc(Cl)cc12)C(=O)CC#N 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 P07 compound treatment 0.074 0.00325 0.84 0.086 0.0111 3.08 2.771 0.8677 3063965 Maybridge4_002801 CSc1nnc(CNC(=O)OC(C)(C)C)n1C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 P08 compound treatment 0.09 0.0193 4.96 0.092 0.0171 4.75 6.8655 0.9998 3179274 Maybridge4_002802 Cc1c(COC(=O)c2ccccc2)sc3ccccc13 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 P09 compound treatment 0.078 0.00725 1.87 0.089 0.0141 3.92 4.09 0.9425 3179275 Maybridge4_002803 Cn1c(CNC(=O)c2cccs2)nnc1SCc3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 P10 compound treatment 0.1 0.0293 7.53 0.11 0.0351 9.77 12.2307 0.9918 3063968 Maybridge4_002804 Cc1c(CNC(=O)c2ccc(cc2)C(F)(F)F)sc3ccccc13 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 P11 compound treatment 0.086 0.0153 3.93 0.09 0.0151 4.2 5.7434 0.9994 1496234 Maybridge4_002805 CCc1ccc2[nH]c(cc2c1)C(=O)NC(C)COC 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 P12 compound treatment 0.107 0.0362 9.33 0.111 0.0361 10.04 13.702 0.9993 1637130 Maybridge4_002806 Clc1ccc(cc1)N2N=C(CSc3nccc(n3)c4cccnc4)CC2=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 P13 compound treatment 0.123 0.0522 13.45 0.135 0.0601 16.73 21.3412 0.9942 3179276 Maybridge4_002807 Clc1ccc(cc1)c2ccc(s2)C(=O)OCc3ccco3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 P14 compound treatment 0.084 0.0133 3.41 0.089 0.0141 3.92 5.1824 0.9976 3063969 Maybridge4_002808 CN1CCC(=N1)c2cccs2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 P15 compound treatment 0.111 0.0403 10.36 0.118 0.0431 11.99 15.8088 0.9974 3179277 Maybridge4_002809 FC(F)(F)c1ccc(CNC(=O)N/C=C/c2cccs2)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 P16 compound treatment 0.092 0.0213 5.47 0.097 0.0221 6.15 8.2142 0.9983 3063970 Maybridge4_002810 Oc1nnc(c2cc(cc(c2)C(F)(F)F)C(F)(F)F)c3ccccc13 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 P17 compound treatment 0.123 0.0522 13.45 0.147 0.0721 20.07 23.7043 0.9811 3179278 Maybridge4_002811 COc1ccc(cc1)c2nc(cs2)c3ccc(C)cc3C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 P18 compound treatment 0.079 0.00825 2.12 0.08 0.00507 1.41 2.4997 0.9803 1676105 Maybridge4_002812 COc1ccc(cc1)c2nc(nc(=O)[nH]2)c3ccncc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 P19 compound treatment 0.071 2.5E-4 0.06 0.074 -9.33E-4 -0.26 -0.1383 -0.5164 3063971 Maybridge4_002813 OCc1cnc(S)n1Cc2ccccc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 P20 compound treatment 0.079 0.00825 2.12 0.075 6.67E-5 0.02 1.5151 0.7133 1134458 Maybridge4_002814 CC1CN(CC(C)O1)c2ccc(NC(=S)NN)cc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 P21 compound treatment 0.073 0.00225 0.58 0.079 0.00407 1.13 1.2105 0.9515 3063972 Maybridge4_002815 Cc1ccc2sc(cc2c1)C(=O)O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 P22 compound treatment 0.085 0.0143 3.67 0.092 0.0171 4.75 5.9552 0.9918 3063973 Maybridge4_002816 CCCc1ccc(NC(=S)OCC)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 P23 mock treatment 0.069 -0.00175 -0.45 0.081 0.00607 1.69 0.8761 0.501 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2056 P24 positive control 0.08 0.00925 2.38 0.092 0.0171 4.75 5.0449 0.949 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 A01 compound treatment 0.091 0.0206 5.31 0.088 0.0131 3.64 6.3273 0.983 3179279 Maybridge4_002817 CCOC(=S)Nc1ccc(I)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 A02 compound treatment 0.358 0.288 74.05 0.338 0.263 73.26 104.1682 1.0 3179280 Maybridge4_002818 Cn1c(/C=C/C=C/N2CCCC2)nc3ccccc3c1=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 A03 compound treatment 0.079 0.00863 2.22 0.083 0.00806 2.25 3.158 1.0 3063974 Maybridge4_002819 CCCn1c(n[nH]c1=O)c2ccc(F)cc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 A04 compound treatment 0.105 0.0346 8.91 0.113 0.0381 10.6 13.7992 0.9963 3179380 Maybridge4_002820 CCOC(=O)c1cnc(S/C=C/C(=O)c2ccc(Cl)cc2)nc1N 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 A05 compound treatment 0.078 0.00763 1.96 0.079 0.00406 1.13 2.1882 0.9657 1487054 Maybridge4_002821 Cc1ccccc1S(=O)c2ccccc2C(=O)O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 A06 compound treatment 0.126 0.0556 14.32 0.13 0.0551 15.33 20.9702 0.9994 3064003 Maybridge4_002822 N(/C=N/c1ccc2ccccc2c1)c3ccc4ccccc4c3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 A07 compound treatment 0.077 0.00663 1.71 0.081 0.00606 1.69 2.4 1.0 1198685 Maybridge4_002823 CC(C)CC(NC(=O)Nc1cccc2ccccc12)C(=O)O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 A08 compound treatment 0.078 0.00763 1.96 0.08 0.00506 1.41 2.3851 0.9868 3064005 Maybridge4_002824 FC(F)(F)c1ncncc1c2nnnn2c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 A09 compound treatment 0.284 0.214 55.0 0.27 0.195 54.32 77.3049 1.0 3064006 Maybridge4_002825 CN(C)/C=C(\C(=S)c1ccccc1)/c2ccccc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 A10 compound treatment 0.169 0.0986 25.39 0.169 0.0941 26.2 36.4788 0.9999 3064007 Maybridge4_002826 Clc1ccc(O/C=C/C(=O)c2ccc(Br)cc2)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 A11 compound treatment 0.105 0.0346 8.91 0.117 0.0421 11.71 14.5869 0.9909 1652788 Maybridge4_002827 CN1C(=O)C(Cc2ccccc2)(Cc3ccccc3)c4ccccc14 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 A12 compound treatment 0.079 0.00863 2.22 0.095 0.0201 5.59 5.5211 0.9183 3064008 Maybridge4_002828 O=c1[nH]c2ccccc2c(=O)n1CCNCc3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 A13 compound treatment 0.076 0.00563 1.45 0.081 0.00606 1.69 2.2179 0.9971 3064009 Maybridge4_002829 C/C(=N\O)/C(=O)Nc1cccc(c1)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 A14 compound treatment 0.206 0.136 34.92 0.212 0.137 38.17 51.6827 0.999 3179381 Maybridge4_002830 Clc1ccc(/C=C(\C#N)/c2c[nH]c3ccccc23)c(Cl)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 A15 compound treatment 0.385 0.315 81.01 0.379 0.304 84.68 117.1577 0.9998 3179382 Maybridge4_002831 O=C(/C=C\1/Nc2[nH]c(=S)[nH]c(=O)c2NC1=O)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 A16 compound treatment 0.235 0.165 42.39 0.251 0.176 49.03 64.6425 0.9974 3064010 Maybridge4_002832 FC(F)(F)c1ccc(/C=C(\C#N)/c2cn(C(=O)C3CCC3)c4ccccc24)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 A17 compound treatment 0.08 0.00963 2.48 0.081 0.00606 1.69 2.9462 0.9825 1477955 Maybridge4_002833 Cc1c(O)c(C(=O)c2nn[nH]n2)c(=O)n(c3ccccc3)c1c4ccccc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 A18 compound treatment 0.076 0.00563 1.45 0.079 0.00406 1.13 1.8241 0.9925 1152993 Maybridge4_002834 COc1ccc(CC(=O)NN2C(=O)CSCC2=O)cc1OC 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 A19 compound treatment 0.264 0.194 49.85 0.268 0.193 53.77 73.2699 0.9993 3179383 Maybridge4_002835 O=C(C/C(=C\1/CCc2ccccc2C1=O)/c3ccccc3)c4ccccc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 A20 compound treatment 0.208 0.138 35.43 0.222 0.147 40.96 54.0161 0.9974 3179384 Maybridge4_002836 CC1CC(CC(C)(C)C1)NC(=S)NCc2csc3ccccc23 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 A21 compound treatment 0.1 0.0296 7.63 0.1 0.0251 6.98 10.3289 0.999 1438428 Maybridge4_002837 CC12CCC3C(CC=C4CC(O)CCC34CO)C2CCC1OC(=O)c5ccccc5 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 A22 compound treatment 0.109 0.0386 9.94 0.108 0.0331 9.21 13.5428 0.9993 3179385 Maybridge4_002838 CC(=O)Nc1ccc(cc1)C2=N/C(=C/c3cn(C(=O)C)c4ccccc34)/C(=O)O2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 A23 mock treatment 0.074 0.00363 0.93 0.078 0.00306 0.85 1.263 0.999 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 A24 positive control 0.079 0.00863 2.22 0.08 0.00506 1.41 2.5672 0.976 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 B01 compound treatment 0.08 0.00963 2.48 0.08 0.00506 1.41 2.7492 0.9643 1595249 Maybridge4_002839 COc1ccc(cc1)C2C(C(=O)O)c3ccccc3C(=O)N2Cc4ccc(Cl)cc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 B02 compound treatment 0.079 0.00863 2.22 0.08 0.00506 1.41 2.5672 0.976 3064011 Maybridge4_002840 FC(F)(F)c1nnc(Nc2cccnc2)s1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 B03 compound treatment 0.109 0.0386 9.94 0.128 0.0531 14.78 17.4813 0.9814 1011958 Maybridge4_002841 CC(=O)Nc1ccc(Cc2ccc(NC(=O)C)cc2)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 B04 compound treatment 0.096 0.0256 6.6 0.099 0.0241 6.7 9.4038 1.0 3179386 Maybridge4_002842 O=C1N(C2CCCCC2)/C(=N/C3CCCCC3)/SC41CC4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 B05 compound treatment 0.073 0.00263 0.68 0.077 0.00206 0.57 0.8841 0.9967 3064012 Maybridge4_002843 CS/C(=N\C#N)/N=c\1/nc(SC)n(C)n1C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 B06 compound treatment 0.256 0.186 47.79 0.249 0.174 48.48 68.0719 1.0 3179387 Maybridge4_002844 Cc1cc(S)nc(n1)c2ccccn2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 B07 compound treatment 0.079 0.00863 2.22 0.082 0.00706 1.97 2.961 0.9982 3064013 Maybridge4_002845 Cc1csc(Nc2c(C)cccc2C)[n+]1C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 B08 compound treatment 0.078 0.00763 1.96 0.082 0.00706 1.97 2.779 1.0 3179388 Maybridge4_002846 Cc1nc(nc(NCCNc2cc(ccn2)C(F)(F)F)c1Cl)c3ccncc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 B09 compound treatment 0.11 0.0396 10.2 0.116 0.0411 11.44 15.3003 0.9984 3064014 Maybridge4_002847 Clc1ccc(/C=C(\C#N)/c2ccccc2)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 B10 compound treatment 0.172 0.102 26.17 0.175 0.1 27.87 38.2065 0.9995 1673007 Maybridge4_002848 COc1ccc(CCNC(=O)C(Sc2ccc(Cl)cc2)c3ccccc3)cc1OC 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 B11 compound treatment 0.096 0.0256 6.6 0.094 0.0191 5.31 8.4191 0.9942 1278976 Maybridge4_002849 CSc1nc2ccccc2c(=O)n1CCc3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 B12 compound treatment 0.179 0.109 27.97 0.18 0.105 29.26 40.4655 0.9997 3179389 Maybridge4_002850 CCOC(=O)/C(=N\O)/C1=CSC2=NNC(C)(C)N12 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 B13 compound treatment 0.129 0.0586 15.09 0.144 0.0691 19.23 24.2733 0.9928 1697626 Maybridge4_002851 Oc1ccccc1C(=O)Nc2ccc(NC(=O)c3ccc(Cl)cc3)cc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 B14 compound treatment 0.079 0.00863 2.22 0.08 0.00506 1.41 2.5672 0.976 1029066 Maybridge4_002852 OC(Cc1cccnc1)(c2ccccc2)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 B15 compound treatment 0.166 0.0956 24.62 0.216 0.141 39.29 45.1881 0.9747 3179390 Maybridge4_002853 Cn/1c(cs\c1=N/C(=S)NCCc2ccccc2)c3ccc(Cl)cc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 B16 compound treatment 0.074 0.00363 0.93 0.078 0.00306 0.85 1.263 0.999 1414388 Maybridge4_002854 Cc1ccc2onc(OC(=O)NC(C)(C)C)c2c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 B17 compound treatment 0.078 0.00763 1.96 0.08 0.00506 1.41 2.3851 0.9868 3064015 Maybridge4_002855 CS/C(=N\c1ccc(Cl)cc1)/N(C)C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 B18 compound treatment 0.212 0.142 36.46 0.227 0.152 42.35 55.7289 0.9972 1450668 Maybridge4_002856 CNC(=O)Nc1cccc(c1)c2cc(no2)c3c(Cl)cccc3Cl 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 B19 compound treatment 0.128 0.0576 14.84 0.124 0.0491 13.66 20.1528 0.9992 1567287 Maybridge4_002857 COc1cc(CSc2nnnn2c3ccc(C)cc3C)cc(OC)c1OC 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 B20 compound treatment 0.073 0.00263 0.68 0.076 0.00106 0.3 0.6871 0.9313 1505699 Maybridge4_002858 COC(=O)c1c(NC(=O)N(C)C)onc1c2c(Cl)cccc2Cl 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 B21 compound treatment 0.485 0.415 106.75 0.447 0.372 103.62 148.7544 0.9999 1506761 Maybridge4_002859 NCCSC(=S)NC1CCCCCCC1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 B22 compound treatment 0.073 0.00263 0.68 0.074 -9.38E-4 -0.26 0.2933 0.4048 3064016 Maybridge4_002860 CN(C)/C=N/C1NC(=O)N(C)C(=N1)C2CC2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 B23 mock treatment 0.071 6.25E-4 0.16 0.077 0.00206 0.57 0.5199 0.8716 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 B24 positive control 0.075 0.00462 1.19 0.078 0.00306 0.85 1.4451 0.9866 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 C01 compound treatment 0.088 0.0176 4.54 0.092 0.0171 4.75 6.5688 0.9997 1030385 Maybridge4_002861 S=C(NC1CCCCC1)C(=S)NC2CCCCC2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 C02 compound treatment 0.131 0.0606 15.61 0.132 0.0571 15.89 22.2743 1.0 3064017 Maybridge4_002862 Clc1ccc(cc1)C(=O)c2[n+]([N-]C#N)ccc3ccccc23 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 C03 compound treatment 0.075 0.00462 1.19 0.075 6.25E-5 0.02 0.8543 0.7174 3179391 Maybridge4_002863 CCCn1c(n[nH]c1=O)c2cccs2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 C04 compound treatment 0.091 0.0206 5.31 0.097 0.0221 6.14 8.0996 0.9974 3064018 Maybridge4_002864 O=C(/C=C/Sc1ccccn1)c2ccccc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 C05 compound treatment 0.072 0.00162 0.42 0.075 6.25E-5 0.02 0.3082 0.7359 3179392 Maybridge4_002865 CCNS(=O)(=O)c1ccc(Cl)cc1I 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 C06 compound treatment 0.075 0.00462 1.19 0.077 0.00206 0.57 1.2482 0.9441 3064054 Maybridge4_002866 CC1C(O/C(=N\S(=O)(=O)c2ccc(Cl)cc2)/N1C)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 C07 compound treatment 0.074 0.00363 0.93 0.078 0.00306 0.85 1.263 0.999 1049317 Maybridge4_002867 OC(=O)CCNC(=O)Nc1ccccc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 C08 compound treatment 0.074 0.00363 0.93 0.08 0.00506 1.41 1.6569 0.9799 3064055 Maybridge4_002868 Oc1c([I+]c2ccccc2)c(=O)[nH]c3ccccc13 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 C09 compound treatment 0.096 0.0256 6.6 0.102 0.0271 7.54 9.9945 0.9978 3064056 Maybridge4_002869 N#CC(Cc1ccccc1)(Cc2ccccc2)C#N 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 C10 compound treatment 0.076 0.00563 1.45 0.076 0.00106 0.3 1.2333 0.8343 1357025 Maybridge4_002870 CC1(C)c2cc(Cl)ccc2-n3c1cc(O)c(c4ccccc4)c3=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 C11 compound treatment 0.075 0.00462 1.19 0.074 -9.38E-4 -0.26 0.6574 0.5393 1019915 Maybridge4_002871 Cc1ccc(cc1)C(O)c2nccc3ccccc23 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 C12 compound treatment 0.078 0.00763 1.96 0.081 0.00606 1.69 2.5821 0.9972 3064058 Maybridge4_002872 O/N=C/C(=O)Nc1cc(cc(c1)C(F)(F)F)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 C13 compound treatment 0.073 0.00263 0.68 0.076 0.00106 0.3 0.6871 0.9313 3064059 Maybridge4_002873 CC(C)/C(=N/O)/c1ccccc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 C14 compound treatment 0.078 0.00763 1.96 0.075 6.25E-5 0.02 1.4005 0.7133 1733383 Maybridge4_002874 CCCCC1(CO)C(=O)N(N(C1=O)c2ccccc2)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 C15 compound treatment 0.073 0.00263 0.68 0.075 6.25E-5 0.02 0.4902 0.7251 1134906 Maybridge4_002875 NC(=O)NC1C(Oc2ccccc2C1=O)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 C16 compound treatment 0.079 0.00863 2.22 0.081 0.00606 1.69 2.7641 0.9909 1708436 Maybridge4_002876 CSc1[nH]nc(NS(=O)(=O)c2ccc(Cl)cc2)c1c3ccccn3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 C17 compound treatment 0.121 0.0506 13.03 0.119 0.0441 12.27 17.8937 0.9995 1325632 Maybridge4_002877 CCCCc1c(O)c2cccc3c4ccccc4n(c1=O)c32 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 C18 compound treatment 0.074 0.00363 0.93 0.076 0.00106 0.3 0.8692 0.8877 3179393 Maybridge4_002878 O=C1NCCN1CC/N=C/c2ccc(C#N)cc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 C19 compound treatment 0.086 0.0156 4.02 0.089 0.0141 3.92 5.6139 0.9999 3064061 Maybridge4_002879 c1c2ccccc2c3ccc(oc13)c4ccccc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 C20 compound treatment 0.139 0.0686 17.67 0.157 0.0821 22.85 28.6539 0.9919 1357662 Maybridge4_002880 CC(C)c1ccc(NN2C(=O)CC(C2=O)c3ccccc3)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 C21 compound treatment 0.115 0.0446 11.49 0.108 0.0331 9.21 14.6352 0.994 1704922 Maybridge4_002881 COc1cc(C)c2C3CCC4(C)C(O)CCC4C3CCc2c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 C22 compound treatment 0.072 0.00162 0.42 0.074 -9.38E-4 -0.26 0.1112 0.2255 1187010 Maybridge4_002882 Fc1ccc(C(=O)OCCn2ncc3ccccc3c2=O)c(Cl)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 C23 mock treatment 0.07 -3.75E-4 -0.1 0.075 6.25E-5 0.02 -0.056 -0.5704 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 C24 positive control 0.076 0.00563 1.45 0.081 0.00606 1.69 2.2179 0.9971 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 D01 compound treatment 0.079 0.00863 2.22 0.079 0.00406 1.13 2.3703 0.951 1248994 Maybridge4_002883 CC(C)(C)OC(=O)NC1CCN(CC1)C(=O)CSCC(=O)O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 D02 compound treatment 0.122 0.0516 13.29 0.128 0.0531 14.78 19.8481 0.9986 3064062 Maybridge4_002884 Cc1ccc(/N=C/2\SC3(CC3)C(=O)N2c4ccc(C)cc4)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 D03 compound treatment 0.417 0.347 89.25 0.398 0.323 89.97 126.7251 1.0 3179394 Maybridge4_002885 Clc1cccc(c1)/C(=C/C=C/c2ccccc2)/C#N 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 D04 compound treatment 0.133 0.0626 16.12 0.151 0.0761 21.18 26.38 0.9909 3064063 Maybridge4_002886 Clc1cccc(/N=C/2\SC3(CC3)C(=O)N2c4cccc(Cl)c4)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 D05 compound treatment 0.078 0.00763 1.96 0.079 0.00406 1.13 2.1882 0.9657 3179395 Maybridge4_002887 CCc1nn(C)c2c(=O)c(=O)c2n(C)[nH]1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 D06 compound treatment 0.096 0.0256 6.6 0.109 0.0341 9.49 11.373 0.9843 3064064 Maybridge4_002888 CC1=NNC(=O)C1Oc2ccc(Cl)cc2Cl 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 D07 compound treatment 0.077 0.00663 1.71 0.078 0.00306 0.85 1.8092 0.9487 3179396 Maybridge4_002889 CSC(=N)Nc1c(Cl)cccc1Cl 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 D08 compound treatment 0.122 0.0516 13.29 0.126 0.0511 14.22 19.4543 0.9994 3179397 Maybridge4_002890 Cc1nc(nc(NCCNc2ccc(cn2)C(F)(F)F)c1Cl)c3ccncc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 D09 compound treatment 0.072 0.00162 0.42 0.078 0.00306 0.85 0.8989 0.9463 3064065 Maybridge4_002891 Cc1cc(O)nc(SCC(=O)c2ccc(F)cc2)n1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 D10 compound treatment 0.116 0.0456 11.75 0.132 0.0571 15.89 19.5435 0.9889 1513804 Maybridge4_002892 CCOC(=O)c1c(C)c(ccc1N(C)C)C2NC(=O)NC=C2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 D11 compound treatment 0.159 0.0886 22.82 0.157 0.0821 22.85 32.2951 1.0 3064066 Maybridge4_002893 O=C(CSc1nc2ccccc2c(=O)n1Cc3ccco3)c4ccccc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 D12 compound treatment 0.075 0.00462 1.19 0.077 0.00206 0.57 1.2482 0.9441 3179501 Maybridge4_002894 CC(C)(C)c1ccc(cc1)/C(=N/O)/N 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 D13 compound treatment 0.19 0.12 30.8 0.218 0.143 39.84 49.9513 0.9919 1669360 Maybridge4_002895 Clc1ccc(cc1)C(=O)Nc2cc(Cl)ccc2C(=O)OCC(=O)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 D14 compound treatment 0.176 0.106 27.2 0.174 0.0991 27.59 38.7378 1.0 3064067 Maybridge4_002896 CC(C)Nc1nc(cc(c1C#N)C(F)(F)F)c2cccs2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 D15 compound treatment 0.069 -0.00137 -0.35 0.071 -0.00394 -1.1 -1.0257 -0.8902 3064068 Maybridge4_002897 S=C(NC1CCCCC1)N2CCCCC2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 D16 compound treatment 0.075 0.00462 1.19 0.077 0.00206 0.57 1.2482 0.9441 1715674 Maybridge4_002898 CN(C)c1nc(cc2C(=O)NC(=O)c21)C(C)(C)C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 D17 compound treatment 0.074 0.00363 0.93 0.076 0.00106 0.3 0.8692 0.8877 3064069 Maybridge4_002899 CN(C)/C(=N/c1cc(C)c(C)cc1C)/NN 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 D18 compound treatment 0.106 0.0356 9.17 0.115 0.0401 11.16 14.3751 0.9953 3179502 Maybridge4_002900 COc1ccc(/N=c/2\scc(C)n2C(=O)c3ccccc3Cl)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 D19 compound treatment 0.07 -3.75E-4 -0.1 0.074 -9.38E-4 -0.26 -0.2529 -0.9085 1153907 Maybridge4_002901 COc1ccc(OCC(O)CNC(C)(C)C)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 D20 compound treatment 0.086 0.0156 4.02 0.088 0.0131 3.64 5.417 0.9987 3064070 Maybridge4_002902 Clc1cccc(Cl)c1c2cc(on2)c3ccccn3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 D21 compound treatment 0.086 0.0156 4.02 0.086 0.0111 3.08 5.0231 0.9913 1636805 Maybridge4_002903 Brc1ccc(OCC2CN(C(=O)O2)c3ccccc3)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 D22 compound treatment 0.071 6.25E-4 0.16 0.072 -0.00294 -0.82 -0.4647 -0.5573 3064071 Maybridge4_002904 CC(C)c1nc(/N=C/N(C)C)nc(=O)n1C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 D23 mock treatment 0.071 6.25E-4 0.16 0.075 6.25E-5 0.02 0.1261 0.779 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 D24 positive control 0.076 0.00563 1.45 0.081 0.00606 1.69 2.2179 0.9971 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 E01 compound treatment 0.08 0.00963 2.48 0.076 0.00106 0.3 1.9615 0.786 3179503 Maybridge4_002905 O=C(CSc1ccccn1)Nc2ccccc2C#N 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 E02 compound treatment 0.105 0.0346 8.91 0.101 0.0261 7.26 11.4361 0.9948 3179504 Maybridge4_002906 N#CC1(N=C2C=CC=CN2N=C1c3ccccc3)c4ccccc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 E03 compound treatment 0.076 0.00563 1.45 0.078 0.00306 0.85 1.6272 0.9681 3064072 Maybridge4_002907 O=C1OC2(CCCCC2)OC(=O)C1=Cc3ccoc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 E04 compound treatment 0.268 0.198 50.88 0.315 0.24 66.86 83.2536 0.9909 3179505 Maybridge4_002908 FC(F)(F)c1cc(nc(S/C=C/C(=O)c2ccccc2)c1C#N)c3cccs3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 E05 compound treatment 0.074 0.00363 0.93 0.075 6.25E-5 0.02 0.6723 0.7202 3064073 Maybridge4_002909 CNS(=O)(=O)c1ccc(Br)cc1I 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 E06 compound treatment 0.09 0.0196 5.05 0.095 0.0201 5.59 7.5237 0.9987 3179506 Maybridge4_002910 CC(=O)O[C@@H]1O[C@@H]2CO[C@H](O[C@H]2[C@H](OC(=O)C)[C@H]1OC(=O)C)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 E07 compound treatment 0.096 0.0256 6.6 0.098 0.0231 6.42 9.2068 0.9999 1547193 Maybridge4_002911 CCNS(=O)(=O)c1cccc2c(N)cccc12 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 E08 compound treatment 0.074 0.00363 0.93 0.08 0.00506 1.41 1.6569 0.9799 1448662 Maybridge4_002912 CCc1c(O)c(Cc2ccccc2)c(=O)n(c3nccs3)c1c4ccccc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 E09 compound treatment 0.105 0.0346 8.91 0.106 0.0311 8.65 12.4208 0.9999 3179507 Maybridge4_002913 CCOC(=O)C(C#N)C1(C(=NN(C1=O)c2ccccc2)C)c3c(C)nn(c3O)c4ccccc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 E10 compound treatment 0.066 -0.00437 -1.13 0.069 -0.00594 -1.65 -1.9657 -0.9825 3064074 Maybridge4_002914 Fc1ccc(cc1)C(=O)/C=C/S(=O)(=O)c2ccc(Cl)cc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 E11 compound treatment 0.087 0.0166 4.28 0.083 0.00806 2.25 4.6144 0.9547 1495930 Maybridge4_002915 CC(C)C(OC(=O)c1ccccc1)c2nccc3ccccc23 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 E12 compound treatment 0.128 0.0576 14.84 0.136 0.0611 17.01 22.5159 0.9977 1260619 Maybridge4_002916 COC(=O)c1sc2c(C)cc(Cl)c(C)c2c1C(=O)Oc3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 E13 compound treatment 0.074 0.00363 0.93 0.082 0.00706 1.97 2.0507 0.942 1268159 Maybridge4_002917 CCn1c(=O)cc(O)c2ccccc12 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 E14 compound treatment 0.147 0.0766 19.73 0.156 0.0811 22.58 29.9135 0.9977 1134720 Maybridge4_002918 CCCCC1(COC(=O)c2ccc(OC)cc2)C(=O)N(N(C1=O)c3ccccc3)c4ccccc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 E15 compound treatment 0.149 0.0786 20.24 0.153 0.0781 21.74 29.6868 0.9994 3063981 Maybridge4_002919 Clc1cc(Cl)c2c(=O)cc(oc2c1)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 E16 compound treatment 0.172 0.102 26.17 0.173 0.0981 27.31 37.8127 0.9998 3063982 Maybridge4_002920 O=C(CSc1nc(SCC(=O)c2ccccc2)c3ccccc3n1)c4ccccc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 E17 compound treatment 0.079 0.00863 2.22 0.08 0.00506 1.41 2.5672 0.976 1617223 Maybridge4_002921 Oc1c(Cc2ccccc2)c(=O)n3c4ccccc4c5cccc1c53 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 E18 compound treatment 0.08 0.00963 2.48 0.083 0.00806 2.25 3.34 0.9988 3063983 Maybridge4_002922 Clc1ccc(CCN2C(=O)CSC2=S)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 E19 compound treatment 0.128 0.0576 14.84 0.129 0.0541 15.06 21.1374 1.0 3179508 Maybridge4_002923 CCc1c(C)oc2cc3ccccc3c2c1C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 E20 compound treatment 0.167 0.0966 24.88 0.168 0.0931 25.92 35.9177 0.9998 1212790 Maybridge4_002924 O=C(CSc1nc2ccccc2c(=O)[nH]1)c3ccc(cc3)c4ccccc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 E21 compound treatment 0.088 0.0176 4.54 0.087 0.0121 3.36 5.5842 0.989 3179509 Maybridge4_002925 CC(OC(=O)C)C1CCC2C3CC[C@H]4CC(=O)CCC4(C)C3CCC12C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 E22 compound treatment 0.07 -3.75E-4 -0.1 0.072 -0.00294 -0.82 -0.6467 -0.7851 1296117 Maybridge4_002926 O=C(OCCn1ncc2ccccc2c1=O)c3cccs3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 E23 mock treatment 0.07 -3.75E-4 -0.1 0.075 6.25E-5 0.02 -0.056 -0.5704 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 E24 positive control 0.077 0.00663 1.71 0.083 0.00806 2.25 2.7938 0.9908 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 F01 compound treatment 0.078 0.00763 1.96 0.075 6.25E-5 0.02 1.4005 0.7133 1646144 Maybridge4_002927 CCCCC1(CN2CCN(Cc3ccccc3)CC2)C(=O)N(N(C1=O)c4ccccc4)c5ccccc5 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 F02 compound treatment 0.091 0.0206 5.31 0.097 0.0221 6.14 8.0996 0.9974 1353488 Maybridge4_002928 OC(COc1ccc(F)cc1)CS(=O)(=O)Cc2ccc(Cl)cc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 F03 compound treatment 0.26 0.19 48.82 0.29 0.215 59.89 76.874 0.9949 3064021 Maybridge4_002929 CCc1ccc(cc1)/C(=C/C=C/c2ccccc2)/C#N 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 F04 compound treatment 0.094 0.0236 6.08 0.093 0.0181 5.03 7.8581 0.9955 1107774 Maybridge4_002930 Fc1ccc(NC(=S)C#N)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 F05 compound treatment 0.113 0.0426 10.97 0.117 0.0421 11.71 16.0434 0.9995 1733993 Maybridge4_002931 CCc1cccc(CC)c1NC(=S)Nc2ccc(C)cc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 F06 compound treatment 0.094 0.0236 6.08 0.101 0.0261 7.26 9.4335 0.9961 3179510 Maybridge4_002932 FC(F)(F)c1ccc(cc1)C(=O)Nc2ccc(cc2)C3=NCCO3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 F07 compound treatment 0.124 0.0536 13.81 0.127 0.0521 14.5 20.0153 0.9997 3064024 Maybridge4_002933 Cc1cccc(Cl)c1NC(=S)NC(Cc2ccccc2)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 F08 compound treatment 0.075 0.00462 1.19 0.078 0.00306 0.85 1.4451 0.9866 1491434 Maybridge4_002934 C1CN(CCO1)c2nc(ns2)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 F09 compound treatment 0.091 0.0206 5.31 0.091 0.0161 4.47 6.9181 0.9964 1641045 Maybridge4_002935 CC(C)(CO)NC(=S)NCC1CCCO1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 F10 compound treatment 0.07 -3.75E-4 -0.1 0.073 -0.00194 -0.54 -0.4498 -0.8206 3179511 Maybridge4_002936 O/N=C/c1c(F)cccc1F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 F11 compound treatment 0.13 0.0596 15.35 0.13 0.0551 15.33 21.6984 1.0 3179512 Maybridge4_002937 Sc1nc2ccccc2c(=O)n1c3ccc(Cl)c(Cl)c3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 F12 compound treatment 0.073 0.00263 0.68 0.076 0.00106 0.3 0.6871 0.9313 3064025 Maybridge4_002938 Cc1cc(nn1c2ccccc2)C(=O)O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 F13 compound treatment 0.088 0.0176 4.54 0.088 0.0131 3.64 5.7811 0.994 3064027 Maybridge4_002939 Clc1ccc(cc1)C(=O)COC(=O)c2ccccc2Cl 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 F14 compound treatment 0.23 0.16 41.1 0.224 0.149 41.51 58.4152 1.0 3179513 Maybridge4_002940 CC(C)Sc1nc(cc(c1C#N)C(F)(F)F)c2cccs2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 F15 compound treatment 0.104 0.0336 8.66 0.1 0.0251 6.98 11.0572 0.9943 3179514 Maybridge4_002941 CCOC(=O)c1ccc(NC(=N)SCc2ccc(Cl)cc2)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 F16 compound treatment 0.077 0.00663 1.71 0.077 0.00206 0.57 1.6123 0.8958 3064028 Maybridge4_002942 Cc1onc(c1N)c2c(Cl)cccc2Cl 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 F17 compound treatment 0.075 0.00462 1.19 0.076 0.00106 0.3 1.0513 0.8568 3064029 Maybridge4_002943 Cc1cc(C)c(NC(=N)NN)cc1C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 F18 compound treatment 0.076 0.00563 1.45 0.077 0.00206 0.57 1.4302 0.918 3179515 Maybridge4_002944 COC(=O)c1c(noc1C(=O)NN)c2c(Cl)cccc2Cl 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 F19 compound treatment 0.082 0.0116 2.99 0.09 0.0151 4.19 5.0826 0.9863 1249379 Maybridge4_002945 COc1c(Cl)cccc1c2cn3ccc(C)cc3n2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 F20 compound treatment 0.078 0.00763 1.96 0.081 0.00606 1.69 2.5821 0.9972 1721352 Maybridge4_002946 Oc1nsc(Nc2ccccc2)c1C#N 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 F21 compound treatment 0.074 0.00363 0.93 0.073 -0.00194 -0.54 0.2784 0.2583 1132779 Maybridge4_002947 COc1ccc(COCC(O)CS(=O)(=O)c2ccc(OC)c(OC)c2)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 F22 compound treatment 0.08 0.00963 2.48 0.079 0.00406 1.13 2.5523 0.9369 3064075 Maybridge4_002948 CC(C)(C)C(=O)OCc1nc(cs1)c2ccc(Cl)cc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 F23 mock treatment 0.07 -3.75E-4 -0.1 0.074 -9.38E-4 -0.26 -0.2529 -0.9085 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 F24 positive control 0.076 0.00563 1.45 0.084 0.00906 2.52 2.8087 0.9652 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 G01 compound treatment 0.095 0.0246 6.34 0.098 0.0231 6.42 9.0248 1.0 1511541 Maybridge4_002949 Fc1ccc(NC(=O)C(=S)NC2CCCCC2)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 G02 compound treatment 0.075 0.00462 1.19 0.08 0.00506 1.41 1.839 0.9965 1391130 Maybridge4_002950 Clc1ccc(Nc2nnc3c4ccccc4c5ccccc5c3n2)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 G03 compound treatment 0.095 0.0246 6.34 0.096 0.0211 5.87 8.6309 0.9992 3179516 Maybridge4_002951 CC1C(=NN(C1=O)c2ccccc2)C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 G04 compound treatment 0.244 0.174 44.7 0.304 0.229 63.79 76.718 0.9849 3179517 Maybridge4_002952 Cc1ccc2[nH]c(S/C=C/C(=O)c3ccccc3)nc2c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 G05 compound treatment 0.075 0.00462 1.19 0.076 0.00106 0.3 1.0513 0.8568 1247714 Maybridge4_002953 CNS(=O)(=O)c1c(I)ccc2ccccc12 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 G06 compound treatment 0.083 0.0126 3.25 0.083 0.00806 2.25 3.8862 0.9837 3179612 Maybridge4_002954 CC(=O)N1[C@H](SC(C)(C)[C@@H]1C(=O)O)c2ccc(C)cc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 G07 compound treatment 0.076 0.00563 1.45 0.078 0.00306 0.85 1.6272 0.9681 1286617 Maybridge4_002955 COc1cc2OC(C)(C)CC(=O)c2cc1OC 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 G08 compound treatment 0.075 0.00462 1.19 0.076 0.00106 0.3 1.0513 0.8568 3179613 Maybridge4_002956 CC(=O)OC(C#N)[C@H]1O[C@@H]2OC(C)(C)O[C@@H]2[C@H]1OC(=O)C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 G09 compound treatment 0.074 0.00363 0.93 0.075 6.25E-5 0.02 0.6723 0.7202 3064077 Maybridge4_002957 OC(=O)CCc1n[nH]c(=O)[nH]c1=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 G10 compound treatment 0.074 0.00363 0.93 0.076 0.00106 0.3 0.8692 0.8877 3064078 Maybridge4_002958 Cc1c(cnn1c2ccccc2)c3nnnn3c4ccc(C)cc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 G11 compound treatment 0.072 0.00162 0.42 0.072 -0.00294 -0.82 -0.2826 -0.3076 3179614 Maybridge4_002959 O=S(CC#N)c1ccccc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 G12 compound treatment 0.167 0.0966 24.88 0.18 0.105 29.26 38.2808 0.9967 3179615 Maybridge4_002960 FC(F)(F)c1cccc(OC(=O)c2cc3ccc4ccccc4c3s2)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 G13 compound treatment 0.071 6.25E-4 0.16 0.078 0.00306 0.85 0.7169 0.8259 3064081 Maybridge4_002961 CC(C)CC(C(O)c1ccccc1)c2ccccc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 G14 compound treatment 0.136 0.0656 16.9 0.13 0.0551 15.33 22.7908 0.9988 1388837 Maybridge4_002962 CCCCC1(COC(=O)Nc2cccc(Cl)c2)C(=O)N(N(C1=O)c3ccccc3)c4ccccc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 G15 compound treatment 0.071 6.25E-4 0.16 0.072 -0.00294 -0.82 -0.4647 -0.5573 3064082 Maybridge4_002963 NC1=NC(C(N1)C(=O)c2ccccc2)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 G16 compound treatment 0.073 0.00263 0.68 0.074 -9.38E-4 -0.26 0.2933 0.4048 3179616 Maybridge4_002964 CSc1nc2ccccc2c(=O)n1C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 G17 compound treatment 0.129 0.0586 15.09 0.127 0.0521 14.5 20.9256 0.9998 3179617 Maybridge4_002965 O=c1ss/c(=N/Cc2ccccc2)/n1Cc3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 G18 compound treatment 0.076 0.00563 1.45 0.08 0.00506 1.41 2.021 0.9999 3064083 Maybridge4_002966 S=C(NCC1CC1)NCc2csc3ccccc23 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 G19 compound treatment 0.073 0.00263 0.68 0.076 0.00106 0.3 0.6871 0.9313 1378931 Maybridge4_002967 C(NC1CCCCC1)C(CNC2CCCCC2)OCc3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 G20 compound treatment 0.108 0.0376 9.69 0.105 0.0301 8.37 12.77 0.9974 3064084 Maybridge4_002968 CC(C)(C)c1ccc(NC(=O)c2cnccn2)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 G21 compound treatment 0.071 6.25E-4 0.16 0.073 -0.00194 -0.54 -0.2678 -0.4755 1050158 Maybridge4_002969 COc1ccc2C3CCC4(C)C(CCC4=O)C3CCc2c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 G22 compound treatment 0.24 0.17 43.67 0.217 0.142 39.56 58.8573 0.9988 1218870 Maybridge4_002970 O=C(Nc1cccnc1)c2cc3CCc4ccccc4-c3s2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 G23 mock treatment 0.071 6.25E-4 0.16 0.074 -9.38E-4 -0.26 -0.0708 -0.2309 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 G24 positive control 0.078 0.00763 1.96 0.084 0.00906 2.52 3.1728 0.9923 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 H01 compound treatment 0.079 0.00863 2.22 0.077 0.00206 0.57 1.9764 0.8616 1264780 Maybridge4_002971 COc1ccc(NC(=O)C2CC(=C(C)CC2C(=O)O)C)c(n1)N3CCOCC3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 H02 compound treatment 0.076 0.00563 1.45 0.076 0.00106 0.3 1.2333 0.8343 1569864 Maybridge4_002972 COc1ccc(COCC(O)CS(=O)(=O)Cc2ccc(C)cc2)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 H03 compound treatment 0.076 0.00563 1.45 0.078 0.00306 0.85 1.6272 0.9681 1169171 Maybridge4_002973 OCCNN1C(=O)c2cccc3cccc(C1=O)c23 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 H04 compound treatment 0.072 0.00162 0.42 0.074 -9.38E-4 -0.26 0.1112 0.2255 1600308 Maybridge4_002974 Cc1onc(c1C2=NCCO2)c3ccccc3Cl 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 H05 compound treatment 0.172 0.102 26.17 0.182 0.107 29.82 39.585 0.9979 3179618 Maybridge4_002975 Cc1cccc(C)c1Nc2nc3c(C)cc(C)c(C)c3s2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 H06 compound treatment 0.074 0.00363 0.93 0.077 0.00206 0.57 1.0661 0.9728 1417835 Maybridge4_002976 OC1CCCCC1S(=O)(=O)Cc2ccc(Cl)cc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 H07 compound treatment 0.099 0.0286 7.37 0.097 0.0221 6.14 9.5561 0.9959 3064223 Maybridge4_002977 CCC(CO)NC(=S)Nc1cc(cc(c1)C(F)(F)F)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 H08 compound treatment 0.076 0.00563 1.45 0.078 0.00306 0.85 1.6272 0.9681 3179619 Maybridge4_002978 Clc1ccc2oc(=S)n(Cc3ccccc3)c2c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 H09 compound treatment 0.091 0.0206 5.31 0.091 0.0161 4.47 6.9181 0.9964 3064225 Maybridge4_002979 CNC(=S)NCCc1ccccc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 H10 compound treatment 0.087 0.0166 4.28 0.093 0.0181 5.03 6.5837 0.9968 3179620 Maybridge4_002980 O=C(OCc1ccc2OCOc2c1)OCc3ccc4OCOc4c3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 H11 compound treatment 0.074 0.00363 0.93 0.076 0.00106 0.3 0.8692 0.8877 3179621 Maybridge4_002981 Cc1cc(C)nc(NC(=S)c2ccc(NC(=O)/C=C/C(=O)O)cc2)n1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 H12 compound treatment 0.074 0.00363 0.93 0.076 0.00106 0.3 0.8692 0.8877 3064227 Maybridge4_002982 NC(=N)c1cc(cc(c1)C(F)(F)F)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 H13 compound treatment 0.072 0.00162 0.42 0.076 0.00106 0.3 0.5051 0.9856 1447884 Maybridge4_002983 COc1cccc(C(=O)OCC(=O)c2ccccc2)c1OC 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 H14 compound treatment 0.283 0.213 54.74 0.276 0.201 55.99 78.3044 0.9999 3179622 Maybridge4_002984 CCOC(=O)c1cc(nc(S)c1C#N)C(C)(C)C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 H15 compound treatment 0.071 6.25E-4 0.16 0.072 -0.00294 -0.82 -0.4647 -0.5573 2077819 Maybridge4_002985 C[n+]1c(NC2CCCCC2)scc1c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 H16 compound treatment 0.087 0.0166 4.28 0.085 0.0101 2.8 5.0083 0.9789 1009495 Maybridge4_002986 CC(C)(C)C1=CC(=O)C(=CC1=O)C(C)(C)C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 H17 compound treatment 0.075 0.00462 1.19 0.076 0.00106 0.3 1.0513 0.8568 3179623 Maybridge4_002987 CCc1ccc(NC(=N)NC(=N)N)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 H18 compound treatment 0.098 0.0276 7.11 0.108 0.0331 9.21 11.5402 0.9919 1395086 Maybridge4_002988 Cc1nc(nc(O)c1Cl)C2(CC3CC4CC(C3)C2)C4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 H19 compound treatment 0.132 0.0616 15.87 0.141 0.0661 18.4 24.2287 0.9973 1725570 Maybridge4_002989 CC(C)(C)C(=O)Nc1ccc(cc1)c2cc3cc(Cl)ccc3o2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 H20 compound treatment 0.094 0.0236 6.08 0.094 0.0191 5.31 8.055 0.9977 1661405 Maybridge4_002990 Cc1ccc(NC(=S)C(C#N)C(=O)N)cc1Cl 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 H21 compound treatment 0.115 0.0446 11.49 0.123 0.0481 13.39 17.5891 0.9971 1723738 Maybridge4_002991 Clc1ccc(N2C(CC(=O)NC2=S)c3ccccc3)c(Cl)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 H22 compound treatment 0.093 0.0226 5.83 0.087 0.0121 3.36 6.4945 0.9658 3179624 Maybridge4_002992 OCc1noc(n1)c2ccc(Cl)c(Cl)c2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 H23 mock treatment 0.071 6.25E-4 0.16 0.073 -0.00194 -0.54 -0.2678 -0.4755 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 H24 positive control 0.077 0.00663 1.71 0.085 0.0101 2.8 3.1877 0.9717 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 I01 compound treatment 0.144 0.0736 18.96 0.144 0.0691 19.23 27.0042 1.0 1401560 Maybridge4_002993 Clc1ccc(NC(=O)Nc2ccccc2)c(SCc3ccccc3)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 I02 compound treatment 0.097 0.0266 6.86 0.093 0.0181 5.03 8.4043 0.9884 1509609 Maybridge4_002994 CCSc1nnc2nc3c4ccccc4c5ccccc5c3nn12 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 I03 compound treatment 0.394 0.324 83.32 0.388 0.313 87.19 120.5685 0.9997 3179625 Maybridge4_002995 O=C/1N(N=C(Nc2ccccc2)\C1=C\Nc3ccccc3)c4ccccc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 I04 compound treatment 0.08 0.00963 2.48 0.081 0.00606 1.69 2.9462 0.9825 3064579 Maybridge4_002996 Cn1cnnc1S/C=C/C(=O)c2ccc(Cl)cc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 I05 compound treatment 0.074 0.00363 0.93 0.075 6.25E-5 0.02 0.6723 0.7202 1063036 Maybridge4_002997 COc1cc(c(OC)cc1C(C)(C)C)C(C)(C)C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 I06 compound treatment 0.074 0.00363 0.93 0.076 0.00106 0.3 0.8692 0.8877 3179626 Maybridge4_002998 CSc1ccc(cc1)C2N[C@@H](C(=O)O)C(C)(C)S2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 I07 compound treatment 0.112 0.0416 10.72 0.11 0.0351 9.76 14.4829 0.9989 1248980 Maybridge4_002999 CCNS(=O)(=O)c1ccc(cc1)c2oc3cc(ccc3c2Cl)S(=O)(=O)NCC 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 I08 compound treatment 0.244 0.174 44.7 0.24 0.165 45.97 64.1148 0.9999 3064580 Maybridge4_003000 O=C/1N2CCCCSC2=N\C1=C\c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 I09 compound treatment 0.072 0.00162 0.42 0.08 0.00506 1.41 1.2928 0.8791 1326747 Maybridge4_003001 CN(C)c1ccc(cc1)C2Nc3[nH]nc(C)c3C4=C2C(=O)CCC4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 I10 compound treatment 0.293 0.223 57.32 0.282 0.207 57.67 81.3066 1.0 3179627 Maybridge4_003002 S=c1[nH]nc(c2ccccc2)c(c1C#N)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 I11 compound treatment 0.072 0.00162 0.42 0.073 -0.00194 -0.54 -0.0857 -0.1255 3063889 Maybridge4_003003 COc1ccc2CC(=O)CCc2c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 I12 compound treatment 0.116 0.0456 11.75 0.12 0.0451 12.55 17.1804 0.9995 1333404 Maybridge4_003004 CCCC1C2C(ON1c3ccc(Cl)c(Cl)c3)C(=O)N(C2=O)c4ccccc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 I13 compound treatment 0.074 0.00363 0.93 0.075 6.25E-5 0.02 0.6723 0.7202 3063891 Maybridge4_003005 CC(C)CC(C(=O)c1ccccc1)c2ccccc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 I14 compound treatment 0.083 0.0126 3.25 0.082 0.00706 1.97 3.6893 0.971 1366549 Maybridge4_003006 Clc1cc(Cl)cc(c1)N2C(=O)CC(C2=O)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 I15 compound treatment 0.07 -3.75E-4 -0.1 0.07 -0.00494 -1.38 -1.0406 -0.7549 1552090 Maybridge4_003007 O=c1c(coc2ccccc12)c3nnn[nH]3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 I16 compound treatment 0.093 0.0226 5.83 0.092 0.0171 4.75 7.4791 0.9949 1232818 Maybridge4_003008 CSc1nc2ccccc2c(=O)n1CC(=O)C(C)(C)C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 I17 compound treatment 0.076 0.00563 1.45 0.08 0.00506 1.41 2.021 0.9999 3063892 Maybridge4_003009 COc1cc2ccc(=O)oc2cc1OC 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 I18 compound treatment 0.78 0.71 182.71 0.755 0.68 189.39 263.1146 0.9998 3063893 Maybridge4_003010 CN/1\C(=N/C(=O)C)\NC(=O)\C1=C/c2cccs2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 I19 compound treatment 0.073 0.00263 0.68 0.076 0.00106 0.3 0.6871 0.9313 1630014 Maybridge4_003011 NC(CCc1ccccc1Cl)c2ccc3OCCOc3c2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 I20 compound treatment 0.073 0.00263 0.68 0.076 0.00106 0.3 0.6871 0.9313 1530797 Maybridge4_003012 CCC1(CC)COC2(OC1)C(=O)Nc3ccc(F)cc32 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 I21 compound treatment 0.333 0.263 67.62 0.37 0.295 82.17 105.9183 0.9953 3063895 Maybridge4_003013 Cc1cc(oc2cc3ccccc3c12)c4ccccc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 I22 compound treatment 0.071 6.25E-4 0.16 0.073 -0.00194 -0.54 -0.2678 -0.4755 3179717 Maybridge4_003014 Cc1cccc(c1)n2ncc3ccccc3c2=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 I23 mock treatment 0.07 -3.75E-4 -0.1 0.073 -0.00194 -0.54 -0.4498 -0.8206 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 I24 positive control 0.078 0.00763 1.96 0.084 0.00906 2.52 3.1728 0.9923 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 J01 compound treatment 0.08 0.00963 2.48 0.079 0.00406 1.13 2.5523 0.9369 1715355 Maybridge4_003015 OC(=O)COCC(=O)Nc1cnccn1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 J02 compound treatment 0.072 0.00162 0.42 0.07 -0.00494 -1.38 -0.6765 -0.4707 1137874 Maybridge4_003016 Cc1cccc(C)c1n2c(n[nH]c2=S)C3CC4CCC3O4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 J03 compound treatment 0.075 0.00462 1.19 0.077 0.00206 0.57 1.2482 0.9441 1593696 Maybridge4_003017 CN(C)N1C(=O)c2cccc3cccc(C1=O)c23 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 J04 compound treatment 0.073 0.00263 0.68 0.075 6.25E-5 0.02 0.4902 0.7251 3063897 Maybridge4_003018 CC(=O)Nc1ccc(Br)c(c1)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 J05 compound treatment 0.097 0.0266 6.86 0.101 0.0261 7.26 9.9797 0.9996 1249809 Maybridge4_003019 CC(C)c1ccc(Nc2nnns2)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 J06 compound treatment 0.116 0.0456 11.75 0.115 0.0401 11.16 16.1957 0.9997 1591476 Maybridge4_003020 CCN(CC)c1nc2ccccc2c(=O)s1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 J07 compound treatment 0.115 0.0446 11.49 0.114 0.0391 10.88 15.8167 0.9996 1593840 Maybridge4_003021 CCN(CC)C(=S)Oc1ccccc1C(=O)Nc2ccc(Cl)c(Cl)c2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 J08 compound treatment 0.134 0.0636 16.38 0.14 0.0651 18.12 24.3959 0.9987 3063932 Maybridge4_003022 Clc1cc(Cl)cc(Oc2nc(ns2)c3ccccc3)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 J09 compound treatment 0.071 6.25E-4 0.16 0.077 0.00206 0.57 0.5199 0.8716 1389101 Maybridge4_003023 OC(=O)CCC(=O)Nc1cccc(F)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 J10 compound treatment 0.155 0.0846 21.79 0.148 0.0731 20.35 29.7945 0.9994 3063933 Maybridge4_003024 Cc1nc(S)c(C#N)c(C)c1CCC#N 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 J11 compound treatment 0.079 0.00863 2.22 0.081 0.00606 1.69 2.7641 0.9909 3179718 Maybridge4_003025 Cc1nnc(Nc2cccc(Cl)c2C)s1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 J12 compound treatment 0.085 0.0146 3.77 0.086 0.0111 3.08 4.8411 0.995 3063934 Maybridge4_003026 CNC(=O)Nc1cc(cc(c1)C(F)(F)F)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 J13 compound treatment 0.148 0.0776 19.99 0.141 0.0661 18.4 27.1417 0.9991 1446584 Maybridge4_003027 Cc1cc(Br)ccc1NC(=S)Nc2cccc(NC(=O)c3ccccc3O)c2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 J14 compound treatment 0.174 0.104 26.68 0.189 0.114 31.77 41.3276 0.9962 3179719 Maybridge4_003028 CCOC(=O)c1cc(nc(O)c1C#N)c2ccc(Cl)cc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 J15 compound treatment 0.148 0.0776 19.99 0.155 0.0801 22.3 29.8986 0.9985 3063936 Maybridge4_003029 O=c1cc(nc2scc(c3ccccc3)n12)c4ccccc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 J16 compound treatment 0.096 0.0256 6.6 0.094 0.0191 5.31 8.4191 0.9942 3179720 Maybridge4_003030 CCOC(=O)NC(=S)Nc1ccc(cc1)C(C)(C)C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 J17 compound treatment 0.074 0.00363 0.93 0.073 -0.00194 -0.54 0.2784 0.2583 3063937 Maybridge4_003031 Cc1nc(S)nc(O)c1CC=C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 J18 compound treatment 0.105 0.0346 8.91 0.102 0.0271 7.54 11.6331 0.9965 3179721 Maybridge4_003032 Sc1nnc([nH]1)C2(CC3CC4CC(C3)C2)C4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 J19 compound treatment 0.079 0.00863 2.22 0.082 0.00706 1.97 2.961 0.9982 3063939 Maybridge4_003033 COc1ccc(CCn2c(=S)[nH]c3cc(ccc23)C(F)(F)F)cc1OC 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 J20 compound treatment 0.073 0.00263 0.68 0.076 0.00106 0.3 0.6871 0.9313 3179722 Maybridge4_003034 N#Cc1ccc(cc1)C2SCCCS2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 J21 compound treatment 0.074 0.00363 0.93 0.076 0.00106 0.3 0.8692 0.8877 3179723 Maybridge4_003035 FC(F)(F)c1cccc(c1)N2C(CC(=O)NC2=S)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 J22 compound treatment 0.071 6.25E-4 0.16 0.073 -0.00194 -0.54 -0.2678 -0.4755 3063940 Maybridge4_003036 Oc1nnc(n2cccc12)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 J23 mock treatment 0.07 -3.75E-4 -0.1 0.074 -9.38E-4 -0.26 -0.2529 -0.9085 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 J24 positive control 0.079 0.00863 2.22 0.081 0.00606 1.69 2.7641 0.9909 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 K01 compound treatment 0.114 0.0436 11.23 0.107 0.0321 8.93 14.2562 0.9935 1466072 Maybridge4_003037 CC(C)(C)c1ccc(CSCC(=O)Nc2ccccc2C#N)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 K02 compound treatment 0.177 0.107 27.45 0.168 0.0931 25.92 37.7383 0.9996 1417054 Maybridge4_003038 COc1ccc(Cc2nc(n[nH]c2=S)c3ccccc3)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 K03 compound treatment 0.074 0.00363 0.93 0.075 6.25E-5 0.02 0.6723 0.7202 1566854 Maybridge4_003039 Cc1ccc(C(=O)Nc2ccccc2)c(C)n1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 K04 compound treatment 0.077 0.00663 1.71 0.078 0.00306 0.85 1.8092 0.9487 1404328 Maybridge4_003040 CCC1(CC)C(=O)c2cc3ccccc3cc2C1=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 K05 compound treatment 0.075 0.00462 1.19 0.076 0.00106 0.3 1.0513 0.8568 1489684 Maybridge4_003041 CNC(=O)c1ccccc1Sc2ccccc2C(=O)NC 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 K06 compound treatment 0.073 0.00263 0.68 0.076 0.00106 0.3 0.6871 0.9313 3179724 Maybridge4_003042 NC(=N)/N=C(\N)/Nc1ccc(Cl)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 K07 compound treatment 0.114 0.0436 11.23 0.115 0.0401 11.16 15.8316 1.0 3063986 Maybridge4_003043 COC(=O)c1c2ccccc2c(C)c3ccccc13 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 K08 compound treatment 0.644 0.574 147.69 0.633 0.558 155.42 214.3298 0.9997 3179725 Maybridge4_003044 COc1ccc(/C=C\2/N=C3SC(C)C(=O)N3C2=O)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 K09 compound treatment 0.076 0.00563 1.45 0.08 0.00506 1.41 2.021 0.9999 3063988 Maybridge4_003045 C/C(=C\c1ccccc1)/C(=N/O)/C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 K10 compound treatment 0.293 0.223 57.32 0.343 0.268 74.65 93.319 0.9915 3179726 Maybridge4_003046 N#C/C(=C\C(=C\N1CCOCC1)\c2ccccc2)/c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 K11 compound treatment 0.073 0.00263 0.68 0.073 -0.00194 -0.54 0.0964 0.1114 1700846 Maybridge4_003047 CC(C)c1cc(C(C)C)c(c(c1)C(C)C)S(=O)(=O)n2ccnc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 K12 compound treatment 0.075 0.00462 1.19 0.075 6.25E-5 0.02 0.8543 0.7174 1550463 Maybridge4_003048 O=C1CSCC(=O)N1c2cccnc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 K13 compound treatment 0.075 0.00462 1.19 0.074 -9.38E-4 -0.26 0.6574 0.5393 1209004 Maybridge4_003049 COC(=O)C1=C(O)C2(CC(=C(O)C(C1)(C2)C(=O)O)C(=O)OC)C(=O)O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 K14 compound treatment 0.118 0.0476 12.26 0.124 0.0491 13.66 18.3322 0.9985 3063990 Maybridge4_003050 FC(F)(F)Oc1ccc(/N=c/2\[nH]c(=O)c3ccccc3o2)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 K15 compound treatment 0.081 0.0106 2.74 0.089 0.0141 3.92 4.7036 0.9846 3179727 Maybridge4_003051 FC(F)(F)c1ccc(Oc2ccc(Oc3ccc(cn3)C(F)(F)F)cc2)nc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 K16 compound treatment 0.113 0.0426 10.97 0.107 0.0321 8.93 14.0742 0.9948 3063992 Maybridge4_003052 COC(=O)/C=C\1/NCC(CNC1=O)OC(=O)c2ccc(cc2)C(C)(C)C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 K17 compound treatment 0.147 0.0766 19.73 0.154 0.0791 22.02 29.5196 0.9985 1628564 Maybridge4_003053 C1Cc2nc(ccc2-c3ccccc13)c4ccccc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 K18 compound treatment 0.149 0.0786 20.24 0.161 0.0861 23.97 31.2622 0.9965 3179728 Maybridge4_003054 CC1CC(CC(C)(C)C1)NC(=S)Nc2ccc(I)cc2F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 K19 compound treatment 0.072 0.00162 0.42 0.074 -9.38E-4 -0.26 0.1112 0.2255 3063993 Maybridge4_003055 Cn1c(=O)n(C)c2ncn(CCCCn3cnc4n(C)c(=O)n(C)c(=O)c34)c2c1=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 K20 compound treatment 0.073 0.00263 0.68 0.074 -9.38E-4 -0.26 0.2933 0.4048 3179729 Maybridge4_003056 CSc1cccc(c1)N2C(=O)C3CC=C(C)CC3C2=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 K21 compound treatment 0.074 0.00363 0.93 0.075 6.25E-5 0.02 0.6723 0.7202 1568172 Maybridge4_003057 OCC(C(O)c1ccccc1)N2C(=O)c3ccccc3C2=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 K22 compound treatment 0.074 0.00363 0.93 0.074 -9.38E-4 -0.26 0.4753 0.4905 1396421 Maybridge4_003058 NNC(=O)c1cc2CCc3ccccc3-c2s1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 K23 mock treatment 0.069 -0.00137 -0.35 0.074 -9.38E-4 -0.26 -0.4349 -0.9888 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 K24 positive control 0.08 0.00963 2.48 0.081 0.00606 1.69 2.9462 0.9825 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 L01 compound treatment 0.088 0.0176 4.54 0.086 0.0111 3.08 5.3873 0.9822 3179730 Maybridge4_003059 Cc1c(sc2nc(nn12)C(F)(F)F)C(=O)Cc3c(O)c4ccccc4oc3=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 L02 compound treatment 0.081 0.0106 2.74 0.082 0.00706 1.97 3.3252 0.9869 3063994 Maybridge4_003060 FC(F)(F)c1cc(cc(c1)C(F)(F)F)N2C(=O)CC3(CCCC3)C2=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 L03 compound treatment 0.189 0.119 30.54 0.194 0.119 33.16 45.0431 0.9992 3179731 Maybridge4_003061 CCOc1ccc(Br)cc1/C=N/c2ccc3OCOc3c2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 L04 compound treatment 0.077 0.00663 1.71 0.077 0.00206 0.57 1.6123 0.8958 1505741 Maybridge4_003062 CC(C)c1ccc(NS(=O)(=O)c2ccc(cc2)N3C(=O)CCC3=O)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 L05 compound treatment 0.153 0.0826 21.27 0.145 0.0701 19.51 28.8396 0.9991 3064031 Maybridge4_003063 Nc1ccccc1NC(=S)Nc2ccccc2C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 L06 compound treatment 0.159 0.0886 22.82 0.159 0.0841 23.41 32.6889 0.9999 3064032 Maybridge4_003064 CN(C)c1nc2ccccc2c(=O)s1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 L07 compound treatment 0.085 0.0146 3.77 0.093 0.0181 5.03 6.2196 0.9898 3179732 Maybridge4_003065 CCN(CC)C(=S)Oc1ccc(I)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 L08 compound treatment 0.08 0.00963 2.48 0.082 0.00706 1.97 3.1431 0.9934 3179733 Maybridge4_003066 FC(F)(F)c1cc(Cl)c2nc(cn2c1)C(=O)NC(=O)Nc3ccc(Cl)cc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 L09 compound treatment 0.072 0.00162 0.42 0.077 0.00206 0.57 0.702 0.9879 1015049 Maybridge4_003067 CC(=O)Nc1ccc(Cl)c(Cl)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 L10 compound treatment 0.08 0.00963 2.48 0.08 0.00506 1.41 2.7492 0.9643 3064035 Maybridge4_003068 CCOC(=O)/C(=N/O)/C1=NN=C(N)SC1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 L11 compound treatment 0.072 0.00162 0.42 0.072 -0.00294 -0.82 -0.2826 -0.3076 3179734 Maybridge4_003069 CC(C)Nc1nnc(C)s1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 L12 compound treatment 0.076 0.00563 1.45 0.075 6.25E-5 0.02 1.0364 0.7156 3064037 Maybridge4_003070 CN(C)C(=O)Nc1cc(C)n(n1)c2ccccc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 L13 compound treatment 0.075 0.00462 1.19 0.074 -9.38E-4 -0.26 0.6574 0.5393 3179735 Maybridge4_003071 Cc1cccc(C)c1/N=C/2\NC(C)(CO)CS2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 L14 compound treatment 0.154 0.0836 21.53 0.147 0.0721 20.07 29.4156 0.9994 1316254 Maybridge4_003072 Cc1cc2C(=O)NC(=O)c2c(Sc3ccc(Cl)cc3)n1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 L15 compound treatment 0.075 0.00462 1.19 0.076 0.00106 0.3 1.0513 0.8568 3064038 Maybridge4_003073 Clc1ccc(cc1)c2csc3nc(cc(=O)n23)c4ccccc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 L16 compound treatment 0.077 0.00663 1.71 0.075 6.25E-5 0.02 1.2184 0.7143 1158628 Maybridge4_003074 CNC(=O)Nc1ccc(cc1Br)C(C)(C)C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 L17 compound treatment 0.11 0.0396 10.2 0.116 0.0411 11.44 15.3003 0.9984 3064039 Maybridge4_003075 FC(F)(F)c1cc(cc(c1)C(F)(F)F)n2c(S)nc3ccccc3c2=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 L18 compound treatment 0.118 0.0476 12.26 0.113 0.0381 10.6 16.166 0.9974 1188106 Maybridge4_003076 Clc1cccc(Cl)c1c2nscc2NC(=O)NN3CCCCC3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 L19 compound treatment 0.109 0.0386 9.94 0.11 0.0351 9.76 13.9367 1.0 3064040 Maybridge4_003077 FC(F)(F)c1cc(cc(c1)C(F)(F)F)c2cn3ccccc3n2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 L20 compound treatment 0.165 0.0946 24.36 0.18 0.105 29.26 37.9167 0.9959 3178150 Maybridge4_003078 CNC(=O)Oc1ccc(cc1)c2nc(CSc3ccc(Cl)cc3)cs2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 L21 compound treatment 0.079 0.00863 2.22 0.085 0.0101 2.8 3.5518 0.9934 1216087 Maybridge4_003079 CC(C)c1ccc(NCC(O)CSc2ccccc2)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 L22 compound treatment 0.083 0.0126 3.25 0.085 0.0101 2.8 4.28 0.9973 3064086 Maybridge4_003080 OCc1nc(cs1)c2cc(cc(c2)C(F)(F)F)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 L23 mock treatment 0.07 -3.75E-4 -0.1 0.075 6.25E-5 0.02 -0.056 -0.5704 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 L24 positive control 0.078 0.00763 1.96 0.084 0.00906 2.52 3.1728 0.9923 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 M01 compound treatment 0.144 0.0736 18.96 0.142 0.0671 18.68 26.6103 1.0 1228182 Maybridge4_003081 O=C(Nc1ccc2OCOc2c1)C(=S)NCc3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 M02 compound treatment 0.098 0.0276 7.11 0.095 0.0201 5.59 8.9802 0.9929 3064088 Maybridge4_003082 CCOC(=O)CSc1nnc(c2ccccc2)c(=O)n1c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 M03 compound treatment 0.075 0.00462 1.19 0.076 0.00106 0.3 1.0513 0.8568 3178151 Maybridge4_003083 CC1(C)OC(=O)C(=Cc2ccoc2)C(=O)O1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 M04 compound treatment 0.073 0.00263 0.68 0.076 0.00106 0.3 0.6871 0.9313 3178152 Maybridge4_003084 C[C@]1(O)CCC2C3CC[C@H]4CC(=O)/C(=C/c5ccccc5)/CC4(C)C3CCC21C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 M05 compound treatment 0.081 0.0106 2.74 0.081 0.00606 1.69 3.1282 0.9731 2077623 Maybridge4_003085 CNC(=O)c1ccccc1[S+]2N(C)C(=O)c3ccccc23 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 M06 compound treatment 0.128 0.0576 14.84 0.143 0.0681 18.95 23.8943 0.9927 3064090 Maybridge4_003086 Cc1ccc(cc1)C(=O)/C=C/Nc2ccc(cc2)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 M07 compound treatment 0.073 0.00263 0.68 0.075 6.25E-5 0.02 0.4902 0.7251 3064091 Maybridge4_003087 FC(F)(F)C(=O)N1CCCc2ccccc12 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 M08 compound treatment 1.07 1.0 257.37 1.002 0.927 258.18 364.552 1.0 3178153 Maybridge4_003088 CN(C)/C=C/C=C/1\N=C(OC1=O)c2ccccc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 M09 compound treatment 0.113 0.0426 10.97 0.12 0.0451 12.55 16.6342 0.9978 1045240 Maybridge4_003089 O(c1ccccc1)c2nc(Oc3ccccc3)nc(Oc4ccccc4)n2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 M10 compound treatment 0.072 0.00162 0.42 0.073 -0.00194 -0.54 -0.0857 -0.1255 1341049 Maybridge4_003090 Oc1c(Cc2ccccc2)c(=O)n(c3ccccc3)c4ccccc14 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 M11 compound treatment 0.094 0.0236 6.08 0.092 0.0171 4.75 7.6612 0.9925 1250198 Maybridge4_003091 CCN1c2cc(NC(=O)CC)ccc2C(C)CC1(C)C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 M12 compound treatment 0.08 0.00963 2.48 0.079 0.00406 1.13 2.5523 0.9369 1276296 Maybridge4_003092 COC(=O)c1cc(=O)n2CCSc2c1C(=O)c3ccc(Cl)cc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 M13 compound treatment 0.085 0.0146 3.77 0.083 0.00806 2.25 4.2503 0.9695 1660543 Maybridge4_003093 CCC(C)c1cc(N)nc2nc3ccccc3n12 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 M14 compound treatment 0.076 0.00563 1.45 0.076 0.00106 0.3 1.2333 0.8343 1341769 Maybridge4_003094 Fc1ccc(cc1)N2C(=O)CC(C2=O)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 M15 compound treatment 0.102 0.0316 8.14 0.103 0.0281 7.82 11.2838 0.9998 3178154 Maybridge4_003095 CCOC(=O)CCc1c(CC(=O)OCC)c[nH]c1/C=N/O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 M16 compound treatment 0.262 0.192 49.34 0.246 0.171 47.64 68.5734 0.9998 3064093 Maybridge4_003096 OC(=O)c1ccccc1SC(CC(=O)c2ccc(F)cc2)c3ccc(F)cc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 M17 compound treatment 0.137 0.0666 17.15 0.141 0.0661 18.4 25.139 0.9994 3178155 Maybridge4_003097 Clc1ccccc1N/C=C\C2=NN=NC2c3ccc(Br)cc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 M18 compound treatment 0.074 0.00363 0.93 0.075 6.25E-5 0.02 0.6723 0.7202 3064095 Maybridge4_003098 CN(C)NC(=S)NCc1ccc(F)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 M19 compound treatment 0.112 0.0416 10.72 0.117 0.0421 11.71 15.8613 0.999 3178156 Maybridge4_003099 CC(=O)OC1CCC2C3CC[C@H]4C[C@@H]5C[C@@H]5[C@H](O)C4(C)C3CCC12C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 M20 compound treatment 0.073 0.00263 0.68 0.075 6.25E-5 0.02 0.4902 0.7251 1273753 Maybridge4_003100 S=C(N1CCN(Cc2ccccc2)CC1)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 M21 compound treatment 0.089 0.0186 4.8 0.09 0.0151 4.19 6.357 0.9978 3064162 Maybridge4_003101 CCOC(=O)/N=C(/c1ccc(Cl)cc1)\c2cc3ccccc3cn2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 M22 compound treatment 0.072 0.00162 0.42 0.074 -9.38E-4 -0.26 0.1112 0.2255 1623253 Maybridge4_003102 CCOC(=O)CC(Sc1ccccc1N)c2cc(OC)c(OC)c(OC)c2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 M23 mock treatment 0.07 -3.75E-4 -0.1 0.076 0.00106 0.3 0.141 0.4529 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 M24 positive control 0.079 0.00863 2.22 0.081 0.00606 1.69 2.7641 0.9909 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 N01 compound treatment 0.192 0.122 31.31 0.194 0.119 33.16 45.5893 0.9996 3178157 Maybridge4_003103 CN(C)c1ccc(/C=C(\C#N)/c2ccc(C)cc2)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 N02 compound treatment 0.076 0.00563 1.45 0.076 0.00106 0.3 1.2333 0.8343 3178158 Maybridge4_003104 FC(F)(F)Oc1ccc(OCc2n[nH]c(=S)o2)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 N03 compound treatment 0.098 0.0276 7.11 0.104 0.0291 8.09 10.7525 0.9979 1090055 Maybridge4_003105 CC(C)c1ccc(cc1)N2Cc3cc(ccc3N=C2)C(C)C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 N04 compound treatment 0.083 0.0126 3.25 0.083 0.00806 2.25 3.8862 0.9837 3064190 Maybridge4_003106 FC(F)(F)Oc1ccc(OC(=O)C2=Cc3cc(Cl)ccc3OC2)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 N05 compound treatment 0.08 0.00963 2.48 0.081 0.00606 1.69 2.9462 0.9825 3178159 Maybridge4_003107 Cc1cc(Cl)ccc1NC(=N)NN 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 N06 compound treatment 0.082 0.0116 2.99 0.082 0.00706 1.97 3.5072 0.9793 3178160 Maybridge4_003108 FC(F)(F)c1cnc(NCCNC(=O)C(F)(F)Sc2ccccc2)c(Cl)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 N07 compound treatment 0.074 0.00363 0.93 0.074 -9.38E-4 -0.26 0.4753 0.4905 3064194 Maybridge4_003109 CCN(CC)C(=S)Oc1ccc(C#N)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 N08 compound treatment 0.102 0.0316 8.14 0.102 0.0271 7.54 11.0869 0.9993 3064195 Maybridge4_003110 CC(C)(C)CC(C)(C)NC(=O)c1cccc(/N=C/c2ccccc2O)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 N09 compound treatment 0.175 0.105 26.94 0.18 0.105 29.26 39.7373 0.9991 1463402 Maybridge4_003111 CCc1ccccc1NC(=S)Nc2ccc(Oc3ccc(Cl)cc3)cc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 N10 compound treatment 0.312 0.242 62.21 0.302 0.227 63.24 88.7042 1.0 3064198 Maybridge4_003112 Clc1ccc(SC(=S)NC2CCCCC2)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 N11 compound treatment 0.196 0.126 32.34 0.193 0.118 32.88 46.1206 1.0 1288025 Maybridge4_003113 Clc1ccc(cc1)C(=O)COC(=O)c2ccccc2NCc3ccco3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 N12 compound treatment 0.076 0.00563 1.45 0.074 -9.38E-4 -0.26 0.8395 0.5704 3064199 Maybridge4_003114 OC(=O)c1cc(O)nc2c(cccc12)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 N13 compound treatment 0.078 0.00763 1.96 0.076 0.00106 0.3 1.5974 0.8046 3178161 Maybridge4_003115 CC1CCCC(C)N1C(=S)NCCCN2CCOCC2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 N14 compound treatment 0.076 0.00563 1.45 0.073 -0.00194 -0.54 0.6425 0.4157 3178162 Maybridge4_003116 CCOC(=O)c1cc(nc(OC(=O)N(C)C)c1C#N)C(C)(C)C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 N15 compound treatment 0.086 0.0156 4.02 0.088 0.0131 3.64 5.417 0.9987 3064201 Maybridge4_003117 COc1ccc(/N=C/2\SCC(=O)N2CCc3ccc(OC)c(OC)c3)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 N16 compound treatment 0.075 0.00462 1.19 0.073 -0.00194 -0.54 0.4605 0.3522 3178163 Maybridge4_003118 Clc1cn(CCC#N)cc(Cl)c1=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 N17 compound treatment 0.08 0.00963 2.48 0.082 0.00706 1.97 3.1431 0.9934 3064203 Maybridge4_003119 CC1=NNC(=O)C1Cc2ccccc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 N18 compound treatment 0.074 0.00363 0.93 0.075 6.25E-5 0.02 0.6723 0.7202 1440599 Maybridge4_003120 CCOC(=O)Cn1c(noc1=O)c2c(Cl)cccc2Cl 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 N19 compound treatment 0.156 0.0856 22.05 0.158 0.0831 23.13 31.9458 0.9997 3178164 Maybridge4_003121 Cc1cc(C)c(OC(=O)/C=C/c2cccs2)c(C)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 N20 compound treatment 0.073 0.00263 0.68 0.075 6.25E-5 0.02 0.4902 0.7251 3064205 Maybridge4_003122 CSc1nc(NC(=O)NS(=O)(=O)c2ccccc2C(F)(F)F)nc(n1)c3ccccn3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 N21 compound treatment 0.144 0.0736 18.96 0.151 0.0761 21.18 28.3827 0.9985 1468063 Maybridge4_003123 CC(C)c1ccc(NCC(O)COc2ccc(Cl)c(Cl)c2)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 N22 compound treatment 0.079 0.00863 2.22 0.08 0.00506 1.41 2.5672 0.976 3064206 Maybridge4_003124 O=C1CNC(=S)N1CCc2ccccc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 N23 mock treatment 0.068 -0.00237 -0.61 0.074 -9.38E-4 -0.26 -0.617 -0.928 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 N24 positive control 0.079 0.00863 2.22 0.082 0.00706 1.97 2.961 0.9982 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 O01 compound treatment 0.083 0.0126 3.25 0.084 0.00906 2.52 4.0831 0.9922 1118081 Maybridge4_003125 NNC(=O)CNc1ccc2OCOc2c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 O02 compound treatment 0.155 0.0846 21.79 0.159 0.0841 23.41 31.9607 0.9994 3178165 Maybridge4_003126 CCOC(=O)c1cnc(S/C=C/C(=O)c2ccc(C)cc2)nc1N 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 O03 compound treatment 0.072 0.00162 0.42 0.076 0.00106 0.3 0.5051 0.9856 1121873 Maybridge4_003127 OC(=O)c1ccccc1S(=O)c2ccc(Cl)cc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 O04 compound treatment 0.111 0.0406 10.46 0.114 0.0391 10.88 15.0885 0.9998 3064232 Maybridge4_003128 Clc1ccc(cc1)C(=O)O/C=C/C(=O)c2ccc(Cl)cc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 O05 compound treatment 0.074 0.00363 0.93 0.076 0.00106 0.3 0.8692 0.8877 3178166 Maybridge4_003129 CNC(=O)c1cccc2cccc(Br)c12 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 O06 compound treatment 0.139 0.0686 17.67 0.15 0.0751 20.9 27.2754 0.9965 3178167 Maybridge4_003130 COc1ccc(cc1)C(=O)/C=C/Nc2ccc(cc2)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 O07 compound treatment 0.081 0.0106 2.74 0.084 0.00906 2.52 3.719 0.9992 3064235 Maybridge4_003131 N#CN=C(NC1CCCCC1)NC2CCCCC2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 O08 compound treatment 0.16 0.0896 23.08 0.184 0.109 30.37 37.7941 0.9908 3178168 Maybridge4_003132 Fc1ccc(cc1)C(=O)/C=C/Sc2nc3cc(Cl)ccc3s2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 O09 compound treatment 0.098 0.0276 7.11 0.1 0.0251 6.98 9.9648 1.0 1715504 Maybridge4_003133 CN1C(=O)C(Cc2ccccc2)(c3ccccc13)c4ccccc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 O10 compound treatment 0.072 0.00162 0.42 0.073 -0.00194 -0.54 -0.0857 -0.1255 1565110 Maybridge4_003134 CN(C)C(=O)Oc1cc(C)n(C)c(=O)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 O11 compound treatment 0.072 0.00162 0.42 0.072 -0.00294 -0.82 -0.2826 -0.3076 3064240 Maybridge4_003135 C/C=C(\C(=N\O)\C)/c1ccccc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 O12 compound treatment 0.143 0.0726 18.7 0.152 0.0771 21.46 28.3975 0.9976 1124022 Maybridge4_003136 CC(=O)n1c(cc(c(C#N)c1=O)c2ccc(C)cc2)c3ccc(C)cc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 O13 compound treatment 0.102 0.0316 8.14 0.107 0.0321 8.93 12.0715 0.9989 1736617 Maybridge4_003137 COc1ccc(cc1)c2nc([nH]c(=O)c2C#N)N(C)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 O14 compound treatment 0.212 0.142 36.46 0.227 0.152 42.35 55.7289 0.9972 3178250 Maybridge4_003138 FC(F)(F)c1ccc(/C=C(\C#N)/c2c[nH]c3ccccc23)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 O15 compound treatment 0.071 6.25E-4 0.16 0.075 6.25E-5 0.02 0.1261 0.779 1429244 Maybridge4_003139 CCOC(=O)Cc1c(C)[nH]c(C(=O)OCC)c1CC(=O)OCC 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 O16 compound treatment 0.087 0.0166 4.28 0.086 0.0111 3.08 5.2052 0.987 1373405 Maybridge4_003140 CC(=O)SC1CC(=O)N(C1=O)c2ccc(cc2)C(C)(C)C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 O17 compound treatment 0.239 0.169 43.42 0.229 0.154 42.91 61.0384 1.0 3178251 Maybridge4_003141 O=C(C/C(=C\1/Cc2ccccc2C1=O)/c3ccccc3)c4ccccc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 O18 compound treatment 0.073 0.00263 0.68 0.075 6.25E-5 0.02 0.4902 0.7251 3064242 Maybridge4_003142 CN(C)NC(=S)NCc1ccc(C)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 O19 compound treatment 0.086 0.0156 4.02 0.094 0.0191 5.31 6.5985 0.9906 3178252 Maybridge4_003143 CCOC(=O)OC1CCC2C3CCC4=CC(=O)C(=C)CC4(C)C3CCC12C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 O20 compound treatment 0.124 0.0536 13.81 0.135 0.0601 16.73 21.5907 0.9955 1442612 Maybridge4_003144 Cc1cc(NCn2ncc3ccccc3c2=O)ccc1Br 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 O21 compound treatment 0.097 0.0266 6.86 0.093 0.0181 5.03 8.4043 0.9884 3178253 Maybridge4_003145 Brc1ccc(cc1)c2cnc(/C=C/C=C/N3CCOCC3)s2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 O22 compound treatment 0.108 0.0376 9.69 0.102 0.0271 7.54 12.1792 0.9923 1286622 Maybridge4_003146 O=C1c2ccccc2-c3c1c4ccccc4c(=O)n3CC5CC5 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 O23 mock treatment 0.07 -3.75E-4 -0.1 0.075 6.25E-5 0.02 -0.056 -0.5704 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 O24 positive control 0.08 0.00963 2.48 0.081 0.00606 1.69 2.9462 0.9825 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 P01 compound treatment 0.157 0.0866 22.3 0.173 0.0981 27.31 35.0818 0.9949 3178254 Maybridge4_003147 COc1ccc(/C=C(\C#N)/c2ccc(OC)cc2)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 P02 compound treatment 0.203 0.133 34.15 0.207 0.132 36.78 50.1519 0.9993 1202102 Maybridge4_003148 COc1ccc(cc1OC)C2SC(=S)NC(=C2)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 P03 compound treatment 0.081 0.0106 2.74 0.078 0.00306 0.85 2.5375 0.8855 3178255 Maybridge4_003149 O=C(NC(=S)N1CCCCC1)c2ccccc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 P04 compound treatment 0.079 0.00863 2.22 0.078 0.00306 0.85 2.1733 0.9136 3178256 Maybridge4_003150 Cc1cc(Sc2ccc(Cl)cc2)nc(n1)c3ccccn3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 P05 compound treatment 0.113 0.0426 10.97 0.112 0.0371 10.32 15.0588 0.9995 3064323 Maybridge4_003151 CCOC(=O)NC(=S)Nc1ccc(F)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 P06 compound treatment 0.081 0.0106 2.74 0.08 0.00506 1.41 2.9313 0.9525 1496124 Maybridge4_003152 Nc1nc(Cc2ccc(F)cc2F)no1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 P07 compound treatment 0.086 0.0156 4.02 0.084 0.00906 2.52 4.6293 0.9748 1646965 Maybridge4_003153 Oc1cc(O)n(Cc2ccco2)c(=S)n1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 P08 compound treatment 0.127 0.0566 14.58 0.146 0.0711 19.79 24.303 0.9887 3178257 Maybridge4_003154 COc1cc(NC(=O)C(Sc2nc(C)cc(C)c2C#N)c3ccccc3)c(OC)cc1Cl 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 P09 compound treatment 0.114 0.0436 11.23 0.151 0.0761 21.18 22.9209 0.956 1555108 Maybridge4_003155 Sc1nc2ccccc2c(=O)n1CCc3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 P10 compound treatment 0.074 0.00363 0.93 0.075 6.25E-5 0.02 0.6723 0.7202 1688911 Maybridge4_003156 CN(C(=O)N(C)C(=O)c1ccccc1)C(=O)c2ccccc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 P11 compound treatment 0.081 0.0106 2.74 0.079 0.00406 1.13 2.7344 0.9237 1186033 Maybridge4_003157 CCNC(=S)Nc1ccc(NC(=O)c2ccccc2O)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 P12 compound treatment 0.079 0.00863 2.22 0.077 0.00206 0.57 1.9764 0.8616 3064360 Maybridge4_003158 CN(C)/C=N/c1nonc1c2ccccc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 P13 compound treatment 0.097 0.0266 6.86 0.104 0.0291 8.09 10.5704 0.9966 3178258 Maybridge4_003159 COc1ccccc1/C=C(\C#N)/c2ccc(C)cc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 P14 compound treatment 0.074 0.00363 0.93 0.074 -9.38E-4 -0.26 0.4753 0.4905 1641024 Maybridge4_003160 CC(C)NC(=O)Oc1noc2ccc(Cl)cc12 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 P15 compound treatment 0.077 0.00663 1.71 0.079 0.00406 1.13 2.0061 0.9801 3178259 Maybridge4_003161 CS/C(=N\c1c(C)cccc1C)/N(C)C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 P16 compound treatment 0.115 0.0446 11.49 0.119 0.0441 12.27 16.8014 0.9995 1687023 Maybridge4_003162 CC(C)(C)C(=O)Nc1cccc(c1)c2cc(no2)c3c(Cl)cccc3Cl 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 P17 compound treatment 0.074 0.00363 0.93 0.077 0.00206 0.57 1.0661 0.9728 3064362 Maybridge4_003163 Cc1nc(S)nc(O)c1Cc2ccccc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 P18 compound treatment 0.09 0.0196 5.05 0.091 0.0161 4.47 6.736 0.9982 1159384 Maybridge4_003164 COC(=O)c1c(NC(=O)NCc2ccccc2)onc1c3c(Cl)cccc3Cl 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 P19 compound treatment 0.15 0.0796 20.5 0.154 0.0791 22.02 30.0658 0.9994 1135236 Maybridge4_003165 Clc1ccc(cc1)C(=O)Oc2ccccc2OCC(=O)NCc3ccccc3Cl 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 P20 compound treatment 0.077 0.00663 1.71 0.078 0.00306 0.85 1.8092 0.9487 3178260 Maybridge4_003166 CSc1nc(NC(=O)NS(=O)(=O)Cc2ccc(Cl)cc2Cl)nc(n1)N3CCCC3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 P21 compound treatment 0.074 0.00363 0.93 0.076 0.00106 0.3 0.8692 0.8877 1287410 Maybridge4_003167 CSc1nc2ccccc2c(=O)n1c3cccnc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 P22 compound treatment 0.081 0.0106 2.74 0.082 0.00706 1.97 3.3252 0.9869 3178261 Maybridge4_003168 COC(=O)c1ccc(nc1)C(=O)Nc2ccc(cc2)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 P23 mock treatment 0.071 6.25E-4 0.16 0.077 0.00206 0.57 0.5199 0.8716 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2057 P24 positive control 0.08 0.00963 2.48 0.085 0.0101 2.8 3.7339 0.9981 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 A01 compound treatment 0.09 0.0204 5.25 0.089 0.0202 5.62 7.6849 0.9994 3064365 Maybridge4_003169 Clc1ccccc1CN2C(=O)CNC2=S 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 A02 compound treatment 0.078 0.00837 2.16 0.08 0.0112 3.12 3.7278 0.9838 3178262 Maybridge4_003170 Cc1cc(SCC(=O)NN)c(C)cc1Cl 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 A03 compound treatment 0.086 0.0164 4.22 0.084 0.0152 4.23 5.972 1.0 1123055 Maybridge4_003171 Clc1ccccc1OCCN2C(=O)CNC2=S 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 A04 compound treatment 0.078 0.00837 2.16 0.078 0.00919 2.56 3.334 0.9964 3178263 Maybridge4_003172 CC(=O)N1c2ccccc2C=Cc3ccccc13 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 A05 compound treatment 0.09 0.0204 5.25 0.09 0.0212 5.9 7.8818 0.9983 3178264 Maybridge4_003173 COc1nc(NC(=O)NS(=O)(=O)Nc2cccc3cccnc23)nc(OC)n1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 A06 compound treatment 0.092 0.0224 5.76 0.092 0.0232 6.46 8.6398 0.9984 1697760 Maybridge4_003174 S=C(NC1CC2CC1C=C2)Nc3ccc4[nH]ccc4c3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 A07 compound treatment 0.159 0.0894 23.01 0.17 0.101 28.18 36.1978 0.9949 3064405 Maybridge4_003175 CNc1nc2c(Cl)cc(Cl)cc2s1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 A08 compound treatment 0.074 0.00437 1.13 0.074 0.00519 1.44 1.8181 0.9924 3064407 Maybridge4_003176 CC(C)OC(=S)Nc1cccc(Cl)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 A09 compound treatment 0.076 0.00637 1.64 0.075 0.00619 1.72 2.3791 0.9997 3178265 Maybridge4_003177 CCN(C(=O)c1cnccc1C(F)(F)F)c2c(C)cccc2C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 A10 compound treatment 0.078 0.00837 2.16 0.079 0.0102 2.84 3.5309 0.9908 1316937 Maybridge4_003178 Cc1ccc(C)c(COc2ccc(C)nc2NC(=S)NCc3ccccc3)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 A11 compound treatment 0.074 0.00437 1.13 0.074 0.00519 1.44 1.8181 0.9924 3064408 Maybridge4_003179 CC1(C)ONC(=O)N(C1=O)c2ccccc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 A12 compound treatment 0.125 0.0554 14.26 0.118 0.0492 13.7 19.7677 0.9998 1490878 Maybridge4_003180 COc1ccccc1C2CCN(CC2)C(=O)c3cccnc3Sc4ccc(C)cc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 A13 compound treatment 0.076 0.00637 1.64 0.076 0.00719 2.0 2.576 0.9951 3064412 Maybridge4_003181 FC(F)(F)c1cccc(c1)n2c(noc2=O)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 A14 compound treatment 0.183 0.113 29.19 0.167 0.0982 27.34 39.9765 0.9995 1158023 Maybridge4_003182 Sc1nnc(CSCc2cccc3ccccc23)n1C4CCCCC4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 A15 compound treatment 0.118 0.0484 12.46 0.111 0.0422 11.75 17.1149 0.9996 3064413 Maybridge4_003183 Brc1ccc(cc1)C(=O)CSc2nc(c3cccs3)c(C#N)c(=O)[nH]2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 A16 compound treatment 0.074 0.00437 1.13 0.073 0.00419 1.17 1.6211 0.9998 1059941 Maybridge4_003184 OC(=O)c1cc2cc(Cl)ccc2oc1=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 A17 compound treatment 0.11 0.0404 10.4 0.105 0.0362 10.08 14.4768 0.9999 3178266 Maybridge4_003185 Cc1cc(C)cc(Sc2ccc3nnc(c4ccccc4)n3n2)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 A18 compound treatment 0.267 0.197 50.82 0.269 0.2 55.75 75.3557 0.9989 3178267 Maybridge4_003186 CC(C)c1ccc(/C=C/2\CSc3ccccc3C2=O)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 A19 compound treatment 0.074 0.00437 1.13 0.074 0.00519 1.44 1.8181 0.9924 3064415 Maybridge4_003187 Cc1cc(Cc2ccc(Cl)cc2)c(=O)[nH]n1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 A20 compound treatment 0.147 0.0774 19.92 0.141 0.0722 20.1 28.3023 1.0 3178268 Maybridge4_003188 O=C(/C=C\1/Nc2ccccc2OC1=O)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 A21 compound treatment 0.073 0.00337 0.87 0.072 0.00319 0.89 1.2421 0.9999 3064418 Maybridge4_003189 CCOC(=O)CSc1nc2cccnc2s1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 A22 compound treatment 0.263 0.193 49.79 0.258 0.189 52.69 72.4613 0.9996 3178269 Maybridge4_003190 COc1ccc(cc1)C2=Nc3ccccc3SC(C2)c4ccccc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 A23 mock treatment 0.074 0.00437 1.13 0.074 0.00519 1.44 1.8181 0.9924 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 A24 positive control 0.077 0.00737 1.9 0.076 0.00719 2.0 2.7581 0.9997 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 B01 compound treatment 0.296 0.226 58.28 0.278 0.209 58.26 82.4077 1.0 1225177 Maybridge4_003191 CCOC(=O)c1c(C)c(=O)oc2n(nc(O)c12)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 B02 compound treatment 0.088 0.0184 4.73 0.091 0.0222 6.18 7.7146 0.9913 1739696 Maybridge4_003192 O=C1N(Cc2ccccc2)S(=O)(=O)c3ccccc3S(=O)c4ccccc14 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 B03 compound treatment 0.074 0.00437 1.13 0.074 0.00519 1.44 1.8181 0.9924 3064449 Maybridge4_003193 CC(=O)OC[C@H]1O[C@@H](NC(=O)N)[C@H](OC(=O)C)[C@@H](OC(=O)C)[C@@H]1OC(=O)C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 B04 compound treatment 0.074 0.00437 1.13 0.075 0.00619 1.72 2.015 0.9788 2101805 Maybridge4_003194 CCC(=O)NC(Nc1ccc(O)cc1)(C(F)(F)F)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 B05 compound treatment 0.093 0.0234 6.02 0.093 0.0242 6.74 9.0187 0.9984 1443369 Maybridge4_003195 CCc1ccc2oc3nc(N)c(C#N)cc3c(=O)c2c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 B06 compound treatment 0.087 0.0174 4.47 0.086 0.0172 4.79 6.5479 0.9994 1585673 Maybridge4_003196 CCOC(=O)CCc1ccc(OCc2ccccc2)c(I)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 B07 compound treatment 0.075 0.00537 1.38 0.075 0.00619 1.72 2.197 0.9941 3064452 Maybridge4_003197 CC(=O)OC[C@H]1OC[C@H](OC(=O)C)[C@@H](OC(=O)C)[C@H]1OC(=O)C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 B08 compound treatment 0.091 0.0214 5.5 0.095 0.0262 7.29 9.0485 0.9904 3178366 Maybridge4_003198 CC1(C)c2ccccc2N3CC(=O)NC31/C=C/c4ccc(F)cc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 B09 compound treatment 0.077 0.00737 1.9 0.1 0.0312 8.69 7.4843 0.8418 1005564 Maybridge4_003199 CC(=O)Nc1ccc(cc1)c2ccc(NC(=O)C)cc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 B10 compound treatment 0.089 0.0194 4.99 0.092 0.0232 6.46 8.0936 0.9919 3178367 Maybridge4_003200 Cc1nn(c(O)c1Cc2c(Cl)cccc2Cl)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 B11 compound treatment 0.073 0.00337 0.87 0.072 0.00319 0.89 1.2421 0.9999 1167085 Maybridge4_003201 COc1ccc(CC2CCc3ncc(C)cc3C2)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 B12 compound treatment 0.077 0.00737 1.9 0.076 0.00719 2.0 2.7581 0.9997 3178368 Maybridge4_003202 N/N=C(/Cn1nnc(n1)N2CCCCC2)\c3ccc(Cl)cc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 B13 compound treatment 0.095 0.0254 6.53 0.093 0.0242 6.74 9.3829 0.9999 3064453 Maybridge4_003203 S=c1sc2ccccc2n1CCn3c(=S)sc4ccccc34 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 B14 compound treatment 0.072 0.00237 0.61 0.072 0.00319 0.89 1.0601 0.9834 1238987 Maybridge4_003204 CCCc1c(C)nc(SCC(=O)C(C)(C)C)nc1OC(=O)N(C)C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 B15 compound treatment 0.125 0.0554 14.26 0.118 0.0492 13.7 19.7677 0.9998 3178369 Maybridge4_003205 CC1CN=C(S1)N(CCc2ccccc2)C(=O)Nc3ccc(Cl)cc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 B16 compound treatment 0.072 0.00237 0.61 0.079 0.0102 2.84 2.4386 0.8402 1004236 Maybridge4_003206 Cc1ccccc1NC(=N)NC(=N)N 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 B17 compound treatment 0.074 0.00437 1.13 0.075 0.00619 1.72 2.015 0.9788 1381247 Maybridge4_003207 Sc1nnc(CCCc2nnc(S)o2)o1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 B18 compound treatment 0.108 0.0384 9.88 0.122 0.0532 14.81 17.4604 0.9806 1184925 Maybridge4_003208 CN(C)C(=O)Oc1nc(SCC(=O)c2ccc(Cl)cc2)nc(C)c1CC(=C)C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 B19 compound treatment 0.071 0.00137 0.35 0.07 0.00119 0.33 0.4842 0.9994 3064457 Maybridge4_003209 COc1ccccc1C2CCN(CCCOc3ccc(Cl)cc3)CC2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 B20 compound treatment 0.071 0.00137 0.35 0.071 0.00219 0.61 0.6811 0.9667 3178370 Maybridge4_003210 CCNC(=S)NCC1CC1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 B21 compound treatment 0.073 0.00337 0.87 0.071 0.00219 0.61 1.0452 0.9849 1489027 Maybridge4_003211 Oc1c(Cl)c(=O)n(Cc2ccccc2)c3ccccc13 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 B22 compound treatment 0.109 0.0394 10.14 0.098 0.0292 8.13 12.9163 0.994 1250091 Maybridge4_003212 O=C(Nc1ccc(cc1)S(=O)(=O)NC2(CC3CC4CC(C3)C2)C4)C5CC5 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 B23 mock treatment 0.071 0.00137 0.35 0.07 0.00119 0.33 0.4842 0.9994 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 B24 positive control 0.074 0.00437 1.13 0.074 0.00519 1.44 1.8181 0.9924 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 C01 compound treatment 0.077 0.00737 1.9 0.076 0.00719 2.0 2.7581 0.9997 3064501 Maybridge4_003213 O=C(Nc1ccccc1)Nc2ccc3nnsc3c2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 C02 compound treatment 0.101 0.0314 8.08 0.099 0.0302 8.41 11.6568 0.9998 1507422 Maybridge4_003214 CC(C)(C)c1ccc(OCC(=O)n2ncc(C#N)c2N)c(c1)C(C)(C)C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 C03 compound treatment 0.078 0.00837 2.16 0.079 0.0102 2.84 3.5309 0.9908 1402640 Maybridge4_003215 COc1ccc(OCCN2C(=O)CNC2=S)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 C04 compound treatment 0.075 0.00537 1.38 0.076 0.00719 2.0 2.394 0.9838 1499674 Maybridge4_003216 Cc1ccc2N(CCCc2c1)C(=O)CC(=O)N3CCCc4cc(C)ccc34 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 C05 compound treatment 0.106 0.0364 9.37 0.107 0.0382 10.63 14.1425 0.998 3064504 Maybridge4_003217 CC(C)c1ccc(NC(=S)Sc2ccc(F)cc2F)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 C06 compound treatment 0.075 0.00537 1.38 0.076 0.00719 2.0 2.394 0.9838 1213648 Maybridge4_003218 Cc1ccc(CC(=S)N2CCOCC2)cn1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 C07 compound treatment 0.121 0.0514 13.23 0.117 0.0482 13.42 18.8426 1.0 3178371 Maybridge4_003219 CCN(C(=O)c1cnccc1C(F)(F)F)c2nc3cc(Cl)ccc3s2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 C08 compound treatment 0.114 0.0444 11.43 0.122 0.0532 14.81 18.5528 0.9918 1153252 Maybridge4_003220 COc1cc2cc(OCc3c(F)cccc3Cl)nc(C)c2cc1OC 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 C09 compound treatment 0.076 0.00637 1.64 0.077 0.00819 2.28 2.7729 0.987 3178372 Maybridge4_003221 CSc1cc(c(cn1)C(=O)Nc2c(C)cccc2C)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 C10 compound treatment 0.073 0.00337 0.87 0.072 0.00319 0.89 1.2421 0.9999 3064507 Maybridge4_003222 CCC/N=c/1\ssc(=O)n1CCC 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 C11 compound treatment 0.08 0.0104 2.67 0.082 0.0132 3.67 4.4858 0.9878 3178373 Maybridge4_003223 COc1nccc(c1C(=O)NC(=O)Nc2c(C)cccc2C)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 C12 compound treatment 0.105 0.0354 9.11 0.109 0.0402 11.19 14.3542 0.9948 3064509 Maybridge4_003224 FC(F)(F)c1ccc(NC(=O)CSCc2cccc3ccccc23)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 C13 compound treatment 0.072 0.00237 0.61 0.072 0.00319 0.89 1.0601 0.9834 1304317 Maybridge4_003225 Clc1cccc(c1)c2noc(=O)n2c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 C14 compound treatment 0.07 3.75E-4 0.1 0.069 1.88E-4 0.05 0.1052 0.9584 1154699 Maybridge4_003226 CC(C)COC(=O)c1cn(C2CCCCC2)c3ccccc3c1=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 C15 compound treatment 0.068 -0.00162 -0.42 0.07 0.00119 0.33 -0.062 -0.1162 1407275 Maybridge4_003227 COC(=O)C1c2ccccc2Oc3ccccc13 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 C16 compound treatment 0.072 0.00237 0.61 0.073 0.00419 1.17 1.257 0.9546 1661086 Maybridge4_003228 COc1ccc(CC2C(=O)OC(C)(C)OC2=O)c(Cl)c1OC 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 C17 compound treatment 0.074 0.00437 1.13 0.075 0.00619 1.72 2.015 0.9788 3178374 Maybridge4_003229 CC1=C(Sc2ccccc2N1)C(=O)NN 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 C18 compound treatment 0.212 0.142 36.66 0.217 0.148 41.27 55.1024 0.9983 3064548 Maybridge4_003230 O=C1/C(=C/c2c[nH]c3ccccc23)/CSc4ccccc14 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 C19 compound treatment 0.068 -0.00162 -0.42 0.07 0.00119 0.33 -0.062 -0.1162 3178375 Maybridge4_003231 Cc1cc(Cc2cccs2)c(=O)[nH]n1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 C20 compound treatment 0.134 0.0644 16.57 0.156 0.0872 24.28 28.8894 0.9827 1550561 Maybridge4_003232 OC(COc1ccc(F)cc1)(c2ccc(Cl)cc2)c3ccc(Cl)cc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 C21 compound treatment 0.169 0.0994 25.59 0.165 0.0962 26.79 37.0338 0.9997 1029711 Maybridge4_003233 CCOC(=O)c1cc(=O)c2ccc(OCc3ccccc3)cc2o1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 C22 compound treatment 0.259 0.189 48.76 0.274 0.205 57.14 74.8839 0.9969 3178376 Maybridge4_003234 Oc1ccc(cc1)C2CC(=Nc3ccccc3S2)c4ccccc4O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 C23 mock treatment 0.07 3.75E-4 0.1 0.069 1.88E-4 0.05 0.1052 0.9584 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 C24 positive control 0.077 0.00737 1.9 0.077 0.00819 2.28 2.955 0.9959 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 D01 compound treatment 0.075 0.00537 1.38 0.076 0.00719 2.0 2.394 0.9838 1653141 Maybridge4_003235 Nc1cc(=O)[nH]c(=O)n1c2ccc(Cl)cc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 D02 compound treatment 0.074 0.00437 1.13 0.072 0.00319 0.89 1.4242 0.993 3178377 Maybridge4_003236 CNS(=O)(=O)c1ccc(cc1S(=O)c2ccccc2C(=O)O)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 D03 compound treatment 0.081 0.0114 2.93 0.082 0.0132 3.67 4.6679 0.9937 1915933 Maybridge4_003237 COC(=O)Nc1nc2cc(ccc2[nH]1)c3n[nH]c(=O)c4ccccc34 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 D04 compound treatment 0.069 -6.25E-4 -0.16 0.07 0.00119 0.33 0.1201 0.3264 1252966 Maybridge4_003238 Oc1c(c2ccccc2)c(=O)[nH]c3ccc(F)cc13 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 D05 compound treatment 0.083 0.0134 3.44 0.085 0.0162 4.51 5.6228 0.9912 3178378 Maybridge4_003239 Brc1ccc(cc1)C(=O)Cc2ccccc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 D06 compound treatment 0.752 0.682 175.69 0.714 0.645 179.68 251.2857 0.9999 3064551 Maybridge4_003240 CCN1C(=O)N(CC)C(=O)C(=Cc2c(O)n(CC)c(=O)n(CC)c2=O)C1=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 D07 compound treatment 0.073 0.00337 0.87 0.076 0.00719 2.0 2.0298 0.9302 3178379 Maybridge4_003241 CC(=O)O[C@@H]1CO[C@@H]([C@@H](OC(=O)C)[C@@H]1OC(=O)C)c2nc3ccccc3s2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 D08 compound treatment 0.076 0.00637 1.64 0.076 0.00719 2.0 2.576 0.9951 3178380 Maybridge4_003242 CC1(C)c2ccccc2N3CC(=O)NC31/C=C/c4ccc(cc4)N5CCOCC5 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 D09 compound treatment 0.097 0.0274 7.05 0.106 0.0372 10.36 12.307 0.9824 1190502 Maybridge4_003243 Clc1ccc2n(CN3CCCCC3)c4ccc(Cl)cc4c2c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 D10 compound treatment 0.07 3.75E-4 0.1 0.073 0.00419 1.17 0.8929 0.763 3064581 Maybridge4_003244 CNC(=S)Nc1cc(Cl)cc(Cl)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 D11 compound treatment 0.068 -0.00162 -0.42 0.07 0.00119 0.33 -0.062 -0.1162 1208488 Maybridge4_003245 OC(=O)CCC1CCCCCCCCCCC1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 D12 compound treatment 0.074 0.00437 1.13 0.076 0.00719 2.0 2.2119 0.963 3064582 Maybridge4_003246 O/N=C(/Cn1nnc(n1)N2CCCC2)\c3ccc(Cl)cc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 D13 compound treatment 0.07 3.75E-4 0.1 0.071 0.00219 0.61 0.499 0.8091 3064584 Maybridge4_003247 C([n+]1ccccc1)[n+]2ccccc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 D14 compound treatment 0.11 0.0404 10.4 0.117 0.0482 13.42 16.8399 0.992 3178381 Maybridge4_003248 Cc1nc(SCC(=O)C(C)(C)C)nc(O)c1Cc2c(Cl)cccc2Cl 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 D15 compound treatment 0.155 0.0854 21.98 0.15 0.0812 22.61 31.5311 0.9999 3178382 Maybridge4_003249 CC(N(C(=O)Nc1ccc(Cl)cc1)C2=NCC(C)S2)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 D16 compound treatment 0.074 0.00437 1.13 0.079 0.0102 2.84 2.8027 0.9181 3064586 Maybridge4_003250 CC(C)(C)c1cs/c(=N\c2ccc(F)cc2F)/o1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 D17 compound treatment 0.095 0.0254 6.53 0.096 0.0272 7.57 9.9736 0.9973 3178383 Maybridge4_003251 C(CCc1nnc(SCc2ccccc2)o1)Cc3nnc(SCc4ccccc4)o3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 D18 compound treatment 0.114 0.0444 11.43 0.116 0.0472 13.14 17.3712 0.9976 3064589 Maybridge4_003252 FC(F)(F)c1ccc(Cl)c(Nc2ncnc(n2)n3cccc3)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 D19 compound treatment 0.069 -6.25E-4 -0.16 0.069 1.88E-4 0.05 -0.0769 -0.4543 1521138 Maybridge4_003253 COc1ccc(CCNC(=O)C2CCCCC2)cc1OC 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 D20 compound treatment 0.069 -6.25E-4 -0.16 0.069 1.88E-4 0.05 -0.0769 -0.4543 2078178 Maybridge4_003254 CC(C)[n+]1c(C)csc1Nc2ccc(F)c(Cl)c2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 D21 compound treatment 0.127 0.0574 14.77 0.127 0.0582 16.2 21.9042 0.9989 1308049 Maybridge4_003255 O=c1cc(NCc2ccccc2)[nH]nc1c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 D22 compound treatment 0.071 0.00137 0.35 0.07 0.00119 0.33 0.4842 0.9994 3178478 Maybridge4_003256 CCCC1=NNC(=O)C1Cc2c(Cl)cccc2Cl 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 D23 mock treatment 0.069 -6.25E-4 -0.16 0.069 1.88E-4 0.05 -0.0769 -0.4543 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 D24 positive control 0.077 0.00737 1.9 0.077 0.00819 2.28 2.955 0.9959 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 E01 compound treatment 0.095 0.0254 6.53 0.091 0.0222 6.18 8.989 0.9996 3064592 Maybridge4_003257 CSC1=NCC(=O)N1Cc2cccc(Cl)c2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 E02 compound treatment 0.07 3.75E-4 0.1 0.071 0.00219 0.61 0.499 0.8091 1522772 Maybridge4_003258 CCCCc1cc(C)c2ncc(C(=O)O)c(O)c2c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 E03 compound treatment 0.07 3.75E-4 0.1 0.07 0.00119 0.33 0.3021 0.8769 1340715 Maybridge4_003259 CC(C)NC(=O)N(Cc1cccs1)Cc2ccccc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 E04 compound treatment 0.078 0.00837 2.16 0.079 0.0102 2.84 3.5309 0.9908 1280280 Maybridge4_003260 Oc1c(c2ccccc2)c(=O)n3c4ccccc4c5cccc1c53 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 E05 compound treatment 0.07 3.75E-4 0.1 0.07 0.00119 0.33 0.3021 0.8769 3178479 Maybridge4_003261 COC(=O)c1ccccc1S(=O)(=O)NC(=O)Nc2nc(C)c3CS(=O)(=O)CCc3n2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 E06 compound treatment 0.075 0.00537 1.38 0.077 0.00819 2.28 2.5909 0.9714 1428973 Maybridge4_003262 COC(=O)C1=C(C)NC(=O)CC1c2ccccc2C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 E07 compound treatment 0.072 0.00237 0.61 0.073 0.00419 1.17 1.257 0.9546 3178480 Maybridge4_003263 CSc1nc(nc(N)c1C#N)c2ccccn2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 E08 compound treatment 0.096 0.0264 6.79 0.096 0.0272 7.57 10.1557 0.9985 1476870 Maybridge4_003264 COc1ccc2n(C3CC3)c(C)c(C(=O)ON4C(=O)CCC4=O)c2c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 E09 compound treatment 0.122 0.0524 13.48 0.125 0.0562 15.65 20.6 0.9973 3178481 Maybridge4_003265 Cc1cccc(C)c1NC(=O)c2cnc(NC3CCCCC3)cc2C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 E10 compound treatment 0.149 0.0794 20.44 0.159 0.0902 25.12 32.2111 0.9948 3063905 Maybridge4_003266 FC(F)(F)c1cc(Cl)c2ncc(nc2c1)c3ccc(Br)s3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 E11 compound treatment 0.078 0.00837 2.16 0.079 0.0102 2.84 3.5309 0.9908 3178482 Maybridge4_003267 FC(F)(F)c1ccc(nc1)S(=O)(=O)/C(=C/c2ccsc2)/C#N 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 E12 compound treatment 0.071 0.00137 0.35 0.071 0.00219 0.61 0.6811 0.9667 1329285 Maybridge4_003268 CC(C)C1CCC(C)CC1NCc2ccccc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 E13 compound treatment 0.071 0.00137 0.35 0.072 0.00319 0.89 0.878 0.9187 3063910 Maybridge4_003269 COc1ccccc1c2nn(c3cccc(n3)C(F)(F)F)c(=O)o2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 E14 compound treatment 0.077 0.00737 1.9 0.08 0.0112 3.12 3.5458 0.9718 1482860 Maybridge4_003270 COc1ccc(Oc2ncccc2NC(=O)c3ccc(OC)cc3)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 E15 compound treatment 0.104 0.0344 8.85 0.108 0.0392 10.91 13.9753 0.9946 1317058 Maybridge4_003271 COc1ccc(CNc2nc(c3cccs3)c(C#N)c(=O)n2C)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 E16 compound treatment 0.075 0.00537 1.38 0.075 0.00619 1.72 2.197 0.9941 3063941 Maybridge4_003272 Cc1n[nH]c(=S)n1/N=C\c2ccco2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 E17 compound treatment 0.074 0.00437 1.13 0.074 0.00519 1.44 1.8181 0.9924 1597311 Maybridge4_003273 CCOC(CNc1ccc2nnc(c3ccccc3)n2n1)OCC 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 E18 compound treatment 0.3 0.23 59.31 0.307 0.238 66.33 88.8468 0.9984 3063945 Maybridge4_003274 O=C1/C(=C\c2c[nH]c3ccccc23)/C(Oc4ccccc14)c5ccccc5 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 E19 compound treatment 0.073 0.00337 0.87 0.074 0.00519 1.44 1.636 0.9704 3178483 Maybridge4_003275 Cc1cc(Cc2ccc(cc2)C(F)(F)F)c(=O)[nH]n1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 E20 compound treatment 0.068 -0.00162 -0.42 0.068 -8.12E-4 -0.23 -0.4558 -0.9584 1460994 Maybridge4_003276 CN(C)CCC(O)(CCc1ccccc1)c2ccccc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 E21 compound treatment 0.068 -0.00162 -0.42 0.068 -8.12E-4 -0.23 -0.4558 -0.9584 3063949 Maybridge4_003277 CN(C)/C=N/c1nnc(Sc2ccnc3cc(Cl)ccc23)s1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 E22 compound treatment 0.15 0.0804 20.69 0.155 0.0862 24.0 31.6054 0.9973 1708827 Maybridge4_003278 CCOC(=O)COc1ccc(cc1)C2=Nc3ccccc3NC(C2)c4ccccc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 E23 mock treatment 0.069 -6.25E-4 -0.16 0.069 1.88E-4 0.05 -0.0769 -0.4543 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 E24 positive control 0.079 0.00937 2.41 0.079 0.0102 2.84 3.713 0.9968 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 F01 compound treatment 0.074 0.00437 1.13 0.075 0.00619 1.72 2.015 0.9788 3063951 Maybridge4_003279 Brc1ccc(cc1)C(=O)C2C(=O)OC(=CC2=O)c3ccc(Br)cc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 F02 compound treatment 0.073 0.00337 0.87 0.074 0.00519 1.44 1.636 0.9704 1535413 Maybridge4_003280 CN1CCN(CCN2C(=O)c3ccccc3Sc4cc(Cl)ccc4S2(=O)=O)CC1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 F03 compound treatment 0.071 0.00137 0.35 0.071 0.00219 0.61 0.6811 0.9667 1134402 Maybridge4_003281 O=S(=O)(N(CCC#N)C1CCCCC1)c2cccc3nsnc23 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 F04 compound treatment 0.177 0.107 27.65 0.182 0.113 31.52 41.838 0.9979 3178484 Maybridge4_003282 Cc1ccccc1/C=C/c2c[nH]c3ccccc23 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 F05 compound treatment 0.073 0.00337 0.87 0.074 0.00519 1.44 1.636 0.9704 3063955 Maybridge4_003283 OC(=O)c1ccc(cc1C(F)(F)F)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 F06 compound treatment 0.072 0.00237 0.61 0.074 0.00519 1.44 1.4539 0.9268 1062519 Maybridge4_003284 O=C(C1CCCCC1=O)c2ccccc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 F07 compound treatment 0.135 0.0654 16.83 0.145 0.0762 21.22 26.9053 0.9934 3178485 Maybridge4_003285 O=C(OC[C@H]1O[C@@H](C#N)[C@H](OC(=O)c2ccccc2)[C@@H]1OC(=O)c3ccccc3)c4ccccc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 F08 compound treatment 0.159 0.0894 23.01 0.164 0.0952 26.51 35.0163 0.9975 1658235 Maybridge4_003286 CC1(C)c2ccccc2N(CCC(=O)N)C31Oc4ccc5ccccc5c4C=C3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 F09 compound treatment 0.077 0.00737 1.9 0.077 0.00819 2.28 2.955 0.9959 1416171 Maybridge4_003287 OC(CN1CCNCC1)Cn2c3ccc(Br)cc3c4cc(Br)ccc24 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 F10 compound treatment 0.069 -6.25E-4 -0.16 0.069 1.88E-4 0.05 -0.0769 -0.4543 1438412 Maybridge4_003288 O=C(Cn1nnc(n1)N2CCOCC2)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 F11 compound treatment 0.07 3.75E-4 0.1 0.07 0.00119 0.33 0.3021 0.8769 3178486 Maybridge4_003289 COc1cc(COC(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)O)cc(OC)c1.C1CCC(CC1)NC2CCCCC2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 F12 compound treatment 0.073 0.00337 0.87 0.072 0.00319 0.89 1.2421 0.9999 1614817 Maybridge4_003290 COc1ccc(CCNC(=S)NC2CC2)cc1OC 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 F13 compound treatment 0.381 0.311 80.17 0.341 0.272 75.8 110.289 0.9996 3178487 Maybridge4_003291 CCN1/C(=C\C(=S)Nc2ccccc2)/Sc3ccccc13 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 F14 compound treatment 0.069 -6.25E-4 -0.16 0.068 -8.12E-4 -0.23 -0.2738 -0.9861 1593331 Maybridge4_003292 CC(C)(C)C(=O)Cn1nnc(n1)N2CCOCC2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 F15 compound treatment 0.066 -0.00363 -0.93 0.068 -8.12E-4 -0.23 -0.82 -0.8538 3063998 Maybridge4_003293 CC1=[N+](C)c2cc(ccc2C1(C)C)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 F16 compound treatment 0.101 0.0314 8.08 0.109 0.0402 11.19 13.626 0.9872 3178488 Maybridge4_003294 Fc1ccc(NC(=S)Nc2cc(ccc2N3CCCC3)C(F)(F)F)cc1Cl 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 F17 compound treatment 0.072 0.00237 0.61 0.073 0.00419 1.17 1.257 0.9546 1142281 Maybridge4_003295 CN1C(=C(C(NC1=O)c2ccccc2)C(=O)OCc3ccccc3)C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 F18 compound treatment 0.085 0.0154 3.96 0.084 0.0152 4.23 5.7899 0.9995 1704243 Maybridge4_003296 COCc1cc(O)n2nc(Nc3cc(Cl)ccc3C)nc2n1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 F19 compound treatment 0.071 0.00137 0.35 0.071 0.00219 0.61 0.6811 0.9667 1313602 Maybridge4_003297 O=c1cc(NCc2ccccc2)n(c3ccccc3)c(=O)n1c4ccccc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 F20 compound treatment 0.067 -0.00263 -0.68 0.068 -8.12E-4 -0.23 -0.6379 -0.895 1473392 Maybridge4_003298 CCN(CC)C(=O)Sc1nc2ccccc2c(=O)n1CC3CC3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 F21 compound treatment 0.068 -0.00162 -0.42 0.068 -8.12E-4 -0.23 -0.4558 -0.9584 1547311 Maybridge4_003299 OC(=O)C1(C2C3C14)C5C2CCC3C45C(=O)O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 F22 compound treatment 0.19 0.12 30.99 0.202 0.133 37.09 48.1432 0.996 3064002 Maybridge4_003300 CCCc1cc(=O)oc2cc(OC(=O)/C=C/c3cccs3)ccc12 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 F23 mock treatment 0.069 -6.25E-4 -0.16 0.068 -8.12E-4 -0.23 -0.2738 -0.9861 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 F24 positive control 0.079 0.00937 2.41 0.08 0.0112 3.12 3.9099 0.992 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 G01 compound treatment 0.12 0.0504 12.97 0.116 0.0472 13.14 18.4636 1.0 1507436 Maybridge4_003301 Cc1cc(no1)N(Cc2cccc(Cl)c2Cl)C(=O)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 G02 compound treatment 0.071 0.00137 0.35 0.071 0.00219 0.61 0.6811 0.9667 1593004 Maybridge4_003302 O=c1ccc(n[nH]1)c2ccncc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 G03 compound treatment 0.147 0.0774 19.92 0.159 0.0902 25.12 31.847 0.9934 3178489 Maybridge4_003303 CSC1=N/C(=C\c2ccccc2Cl)/C(=O)N1N(C)C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 G04 compound treatment 0.089 0.0194 4.99 0.089 0.0202 5.62 7.5028 0.9982 3178490 Maybridge4_003304 COc1ccc(C/N=C(\C)/c2c(O)c3ccccc3n(C)c2=O)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 G05 compound treatment 0.071 0.00137 0.35 0.072 0.00319 0.89 0.878 0.9187 3064042 Maybridge4_003305 CCN(C(=O)c1cnccc1C(F)(F)F)c2ccc(Cl)cc2Cl 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 G06 compound treatment 0.209 0.139 35.88 0.212 0.143 39.88 53.5716 0.9986 1261792 Maybridge4_003306 Cc1ccc(Oc2ncccc2NC(=O)C(=S)NCc3ccccc3)c4CCCc41 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 G07 compound treatment 0.075 0.00537 1.38 0.074 0.00519 1.44 2.0001 0.9998 3064045 Maybridge4_003307 Cc1nc(c2nnc(o2)c3ccccc3)c(o1)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 G08 compound treatment 0.076 0.00637 1.64 0.076 0.00719 2.0 2.576 0.9951 3178491 Maybridge4_003308 COc1ccc(cc1OC2CCCC2)C3CC(=O)NN3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 G09 compound treatment 0.071 0.00137 0.35 0.071 0.00219 0.61 0.6811 0.9667 3064046 Maybridge4_003309 CNC(=O)NC(=O)c1cnccc1C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 G10 compound treatment 0.119 0.0494 12.71 0.119 0.0502 13.98 18.8723 0.9989 1193128 Maybridge4_003310 Cc1c(OCc2ccc(Cl)cc2Cl)ccc3C(=O)CC(C)(C)Oc13 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 G11 compound treatment 0.084 0.0144 3.7 0.086 0.0172 4.79 6.0017 0.9919 3064048 Maybridge4_003311 COC(=O)c1cnc(Oc2c(Cl)cc(N)cc2Cl)cc1C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 G12 compound treatment 0.124 0.0544 14.0 0.132 0.0632 17.6 22.3426 0.9936 1126959 Maybridge4_003312 COc1ccccc1C2CCN(CC2)C(=O)CSCc3cccc4ccccc34 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 G13 compound treatment 0.078 0.00837 2.16 0.079 0.0102 2.84 3.5309 0.9908 3064052 Maybridge4_003313 COc1cccc(OC)c1CN(C)C(=O)c2cnc(Oc3ccccc3)cc2C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 G14 compound treatment 0.067 -0.00263 -0.68 0.068 -8.12E-4 -0.23 -0.6379 -0.895 1245694 Maybridge4_003314 NNC(=O)Cn1c2ccccc2c3ccccc13 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 G15 compound treatment 0.065 -0.00462 -1.19 0.069 1.88E-4 0.05 -0.8051 -0.6755 3064053 Maybridge4_003315 CC1CC(=O)NN=C1c2cccs2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 G16 compound treatment 0.075 0.00537 1.38 0.075 0.00619 1.72 2.197 0.9941 3178582 Maybridge4_003316 COc1cc(/C=N\n2cn[nH]c2=S)cc(OC)c1OC 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 G17 compound treatment 0.108 0.0384 9.88 0.11 0.0412 11.47 15.0973 0.9972 1565631 Maybridge4_003317 CSc1nc2cccc(F)c2c(=O)n1c3ccc(C)c(C)c3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 G18 compound treatment 0.085 0.0154 3.96 0.089 0.0202 5.62 6.7746 0.9853 1496711 Maybridge4_003318 Cc1ccccc1NC(=O)COc2ccc3C(=O)CC(C)(C)Oc3c2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 G19 compound treatment 0.104 0.0344 8.85 0.103 0.0342 9.52 12.9906 0.9993 3178583 Maybridge4_003319 CCc1nc(S)[nH]c(=O)c1C#N 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 G20 compound treatment 0.062 -0.00763 -1.96 0.069 1.88E-4 0.05 -1.3513 -0.6881 1520911 Maybridge4_003320 O=C1CC(Sc2ccccc2N1)c3coc4ccccc4c3=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 G21 compound treatment 0.121 0.0514 13.23 0.125 0.0562 15.65 20.418 0.9965 1387364 Maybridge4_003321 CC(=O)N1CCc2cc(NC(=S)Nc3ccccc3Cl)ccc12 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 G22 compound treatment 0.233 0.163 42.06 0.271 0.202 56.31 69.5596 0.9897 1175310 Maybridge4_003322 O=C(COc1ccc(cc1)C2=Nc3ccccc3NC(C2)c4ccccc4)Nc5ccccc5 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 G23 mock treatment 0.069 -6.25E-4 -0.16 0.067 -0.00181 -0.5 -0.4707 -0.8885 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 G24 positive control 0.08 0.0104 2.67 0.081 0.0122 3.39 4.2889 0.993 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 H01 compound treatment 1.094 1.02 263.75 1.072 1.0 279.38 384.0489 0.9996 3064847 Maybridge4_003323 N=C(NC(=S)Nc1ccccc1)N2CCOCC2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 H02 compound treatment 0.127 0.0574 14.77 0.136 0.0672 18.71 23.6765 0.9932 1265943 Maybridge4_003324 Oc1cc(c2ccc(F)cc2)n(c3ccccc3)c(=O)c1c4ccccc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 H03 compound treatment 0.231 0.161 41.55 0.266 0.197 54.92 68.2108 0.9905 1493327 Maybridge4_003325 CC(C)c1c(Br)c(=O)oc2c3CCCN4CCCc(cc12)c43 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 H04 compound treatment 0.069 -6.25E-4 -0.16 0.069 1.88E-4 0.05 -0.0769 -0.4543 1020946 Maybridge4_003326 NC(=O)NCCc1ccccc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 H05 compound treatment 0.072 0.00237 0.61 0.072 0.00319 0.89 1.0601 0.9834 3064848 Maybridge4_003327 C/C(=N/O)/CC(c1ccccc1)c2c(O)c3ccccc3oc2=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 H06 compound treatment 0.073 0.00337 0.87 0.073 0.00419 1.17 1.4391 0.9895 1378346 Maybridge4_003328 Cn1c(=O)n(C)c2ncn(CC(O)COc3ccccc3)c2c1=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 H07 compound treatment 0.133 0.0634 16.32 0.139 0.0702 19.55 25.3596 0.996 3064849 Maybridge4_003329 CO[C@@H]1O[C@H](COC(=O)c2ccccc2)[C@H](OC(=O)c3ccccc3)[C@H]1OC(=O)c4ccccc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 H08 compound treatment 0.19 0.12 30.99 0.196 0.127 35.42 46.9617 0.9978 1554777 Maybridge4_003330 CCn1c2C(=O)CCCc2c3cc(OCc4ccccc4)ccc13 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 H09 compound treatment 0.084 0.0144 3.7 0.084 0.0152 4.23 5.6079 0.9978 3064850 Maybridge4_003331 OC1=C(C(=O)c2ccccc12)c3ccc(I)cc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 H10 compound treatment 0.068 -0.00162 -0.42 0.068 -8.12E-4 -0.23 -0.4558 -0.9584 3178584 Maybridge4_003332 FC(F)(F)c1cccc(c1)n2c(S)nnc2Cn3nnc(n3)N4CCOCC4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 H11 compound treatment 0.107 0.0374 9.62 0.105 0.0362 10.08 13.9307 0.9997 1668484 Maybridge4_003333 Fc1ccc(cc1)N(C(=O)C2(CC3CC4CC(C3)C2)C4)c5ccccc5 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 H12 compound treatment 0.073 0.00337 0.87 0.073 0.00419 1.17 1.4391 0.9895 3064851 Maybridge4_003334 COc1ccc(CCN/2C(=O)CS\C2=N/C3CC3)cc1OC 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 H13 compound treatment 0.157 0.0874 22.5 0.183 0.114 31.8 38.3937 0.9856 1561039 Maybridge4_003335 O=c1[nH]c2ccccc2c(=O)n1CCSc3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 H14 compound treatment 0.069 -6.25E-4 -0.16 0.069 1.88E-4 0.05 -0.0769 -0.4543 3064852 Maybridge4_003336 CC/N=C(/Nc1ccc(cc1)C(C)(C)C)\SCC2CC2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 H15 compound treatment 0.071 0.00137 0.35 0.072 0.00319 0.89 0.878 0.9187 1155855 Maybridge4_003337 Oc1c(O)c(CN2CCCCC2)c3ccccc3c1CN4CCCCC4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 H16 compound treatment 0.069 -6.25E-4 -0.16 0.069 1.88E-4 0.05 -0.0769 -0.4543 3064853 Maybridge4_003338 COC(=O)c1cccc(NC(=N)NC(=N)N)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 H17 compound treatment 0.122 0.0524 13.48 0.128 0.0592 16.48 21.1908 0.995 3178585 Maybridge4_003339 Clc1ccc(cc1)S(=O)(=O)C2=CC34CCCC4(C2)C=C(C3)S(=O)(=O)c5ccc(Cl)cc5 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 H18 compound treatment 0.078 0.00837 2.16 0.078 0.00919 2.56 3.334 0.9964 3064854 Maybridge4_003340 CC(=C)CC1C(=NNC1=O)C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 H19 compound treatment 0.072 0.00237 0.61 0.071 0.00219 0.61 0.8632 1.0 3178586 Maybridge4_003341 CC1(C)O[C@@H]2[C@@H](CO)O[C@H]([C@@H]2O1)n3cnc4c(N)ncnc34 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 H20 compound treatment 0.103 0.0334 8.59 0.109 0.0402 11.19 13.9901 0.9915 3064855 Maybridge4_003342 Clc1ccc(NC(=S)NCC2CC2)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 H21 compound treatment 0.069 -6.25E-4 -0.16 0.07 0.00119 0.33 0.1201 0.3264 1331091 Maybridge4_003343 CN(C)CCNc1cc(nc2ccccc12)c3cccnc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 H22 compound treatment 0.206 0.136 35.11 0.203 0.134 37.37 51.2531 0.9995 1734961 Maybridge4_003344 CCCc1c(Cc2c(F)cccc2Cl)c(=O)oc3cc(O)ccc13 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 H23 mock treatment 0.068 -0.00162 -0.42 0.068 -8.12E-4 -0.23 -0.4558 -0.9584 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 H24 positive control 0.08 0.0104 2.67 0.08 0.0112 3.12 4.092 0.9971 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 I01 compound treatment 0.081 0.0114 2.93 0.072 0.00319 0.89 2.6986 0.8818 3178587 Maybridge4_003345 CC(C)(C)C(=O)OCc1nc(cs1)c2ccc(cc2)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 I02 compound treatment 0.087 0.0174 4.47 0.089 0.0202 5.62 7.1387 0.9936 1626253 Maybridge4_003346 CSc1c(C#N)c(N)nc2sc(C(=O)c3ccc(Cl)c(Cl)c3)c(N)c12 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 I03 compound treatment 0.069 -6.25E-4 -0.16 0.068 -8.12E-4 -0.23 -0.2738 -0.9861 1244996 Maybridge4_003347 CCNC(=O)N(Cc1ccccc1)Cc2cccnc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 I04 compound treatment 0.062 -0.00763 -1.96 0.068 -8.12E-4 -0.23 -1.5482 -0.7834 1073759 Maybridge4_003348 CSc1ncc(Br)c(n1)C(=O)O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 I05 compound treatment 0.07 3.75E-4 0.1 0.071 0.00219 0.61 0.499 0.8091 3178588 Maybridge4_003349 CC(C)(C)NC(=O)Nc1cnccc1C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 I06 compound treatment 0.074 0.00437 1.13 0.072 0.00319 0.89 1.4242 0.993 3064856 Maybridge4_003350 CCOC(=O)CC1=Nn2c(nnc2SC1)c3cccs3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 I07 compound treatment 0.075 0.00537 1.38 0.076 0.00719 2.0 2.394 0.9838 3178589 Maybridge4_003351 Cc1nc(C(=O)NCC(=O)c2ccc(Cl)cc2)c(o1)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 I08 compound treatment 0.072 0.00237 0.61 0.071 0.00219 0.61 0.8632 1.0 1403866 Maybridge4_003352 O=c1cc([nH]c(=O)[nH]1)c2ccccc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 I09 compound treatment 0.07 3.75E-4 0.1 0.071 0.00219 0.61 0.499 0.8091 3178590 Maybridge4_003353 COc1ccc(CN(C)C(=O)c2cnc(OC)cc2C(F)(F)F)c(OC)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 I10 compound treatment 0.072 0.00237 0.61 0.073 0.00419 1.17 1.257 0.9546 1529338 Maybridge4_003354 CCCCc1ccc(NC(=O)CSc2nc(C3CCCCC3)c(C#N)c(=O)[nH]2)c(C)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 I11 compound treatment 0.068 -0.00162 -0.42 0.068 -8.12E-4 -0.23 -0.4558 -0.9584 3064857 Maybridge4_003355 CN(C(=O)c1cn(C)c(=O)cc1C(F)(F)F)c2ccc(Cl)c(Cl)c2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 I12 compound treatment 0.086 0.0164 4.22 0.086 0.0172 4.79 6.3659 0.998 1141964 Maybridge4_003356 COC(=O)C(Cc1c[nH]c2ccccc12)NS(=O)(=O)c3cccc4nonc34 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 I13 compound treatment 0.116 0.0464 11.94 0.109 0.0402 11.19 16.3569 0.9995 3064858 Maybridge4_003357 CSc1nc(Nc2cccc(c2)C(F)(F)F)cc(c1C#N)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 I14 compound treatment 0.1 0.0304 7.82 0.104 0.0352 9.8 12.4593 0.9938 1260487 Maybridge4_003358 Cc1ccc(Sc2ncccc2NC(=O)c3cccc4ccccc34)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 I15 compound treatment 0.139 0.0694 17.86 0.14 0.0712 19.83 26.6489 0.9986 1269491 Maybridge4_003359 CCOC(=O)c1cnn2c1nc(Sc3cccc(OC)c3)c4ccccc42 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 I16 compound treatment 0.156 0.0864 22.24 0.149 0.0802 22.33 31.5162 1.0 1008109 Maybridge4_003360 S=C(Nc1ccccn1)Nc2ccccn2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 I17 compound treatment 0.092 0.0224 5.76 0.107 0.0382 10.63 11.5936 0.9585 3064859 Maybridge4_003361 O/N=C/Nc1ccc2nnc(c3ccccc3)n2n1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 I18 compound treatment 0.073 0.00337 0.87 0.073 0.00419 1.17 1.4391 0.9895 1290576 Maybridge4_003362 Oc1ccc2c(=O)c(coc2c1)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 I19 compound treatment 0.068 -0.00162 -0.42 0.07 0.00119 0.33 -0.062 -0.1162 3064860 Maybridge4_003363 Cc1ccc(Cc2cc(C)n[nH]c2=O)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 I20 compound treatment 0.069 -6.25E-4 -0.16 0.068 -8.12E-4 -0.23 -0.2738 -0.9861 1499068 Maybridge4_003364 CC(=O)NC1C(c2ccccc2)S(=O)(=O)c3ccccc3NC1=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 I21 compound treatment 0.076 0.00637 1.64 0.075 0.00619 1.72 2.3791 0.9997 1721722 Maybridge4_003365 CC(=O)N1CCc2cc(NC(=S)NCc3cccs3)ccc12 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 I22 compound treatment 0.068 -0.00162 -0.42 0.068 -8.12E-4 -0.23 -0.4558 -0.9584 1210152 Maybridge4_003366 CCC(=O)N1C(CC(=Nc2ccccc12)c3ccccc3)c4ccccc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 I23 mock treatment 0.069 -6.25E-4 -0.16 0.066 -0.00281 -0.78 -0.6676 -0.8349 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 I24 positive control 0.078 0.00837 2.16 0.078 0.00919 2.56 3.334 0.9964 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 J01 compound treatment 0.075 0.00537 1.38 0.075 0.00619 1.72 2.197 0.9941 1243119 Maybridge4_003367 Cc1c(O)c(c2ccccc2)c(=O)n(c3ccccn3)c1c4ccccc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 J02 compound treatment 0.141 0.0714 18.38 0.147 0.0782 21.77 28.3915 0.9964 1140611 Maybridge4_003368 CCCCc1c(O)cc(c2ccccc2)n(Cc3ccccc3)c1=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 J03 compound treatment 0.416 0.346 89.18 0.401 0.332 92.51 128.4765 0.9998 3178591 Maybridge4_003369 Cc1ccc(cc1)C(=O)/C=C\2/NCCNC2=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 J04 compound treatment 0.068 -0.00162 -0.42 0.07 0.00119 0.33 -0.062 -0.1162 3178682 Maybridge4_003370 CC(=O)O[C@H]1[C@H](O[C@@H]2OC(C)(C)O[C@H]12)C(O)CO 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 J05 compound treatment 0.096 0.0264 6.79 0.1 0.0312 8.69 10.9434 0.9926 1447328 Maybridge4_003371 CC(C)(C)C(=O)CC(Nc1ccccc1)c2ccc(Cl)cc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 J06 compound treatment 0.073 0.00337 0.87 0.072 0.00319 0.89 1.2421 0.9999 1256088 Maybridge4_003372 C=CCC1(CCCCC1)NCCc2ccccc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 J07 compound treatment 0.076 0.00637 1.64 0.076 0.00719 2.0 2.576 0.9951 1171716 Maybridge4_003373 CN1CCCC(C1)OC(=O)C2=C(C)NC3(O)c4ccccc4C(=O)C23O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 J08 compound treatment 0.093 0.0234 6.02 0.096 0.0272 7.57 9.6095 0.9935 1583880 Maybridge4_003374 CC(C)(C)Oc1ccc(CC(CO)NC(=O)OCC2c3ccccc3-c4ccccc24)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 J09 compound treatment 0.098 0.0284 7.31 0.11 0.0412 11.47 13.2768 0.9763 1604468 Maybridge4_003375 COc1ccccc1C2CCN(CC2)S(=O)(=O)c3ccccc3Br 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 J10 compound treatment 0.179 0.109 28.16 0.192 0.123 34.31 44.1713 0.9952 3064861 Maybridge4_003376 Cc1cc(OC(=O)c2ccco2)nc(SCc3c(Cl)cccc3Cl)n1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 J11 compound treatment 0.068 -0.00162 -0.42 0.069 1.88E-4 0.05 -0.2589 -0.6141 3178683 Maybridge4_003377 CC(C)C1(C)N2C(=O)c3ccccc3C2=NC1=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 J12 compound treatment 0.073 0.00337 0.87 0.073 0.00419 1.17 1.4391 0.9895 3064862 Maybridge4_003378 O=C1CS/C(=N\C2CC2)/N1Cc3cccs3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 J13 compound treatment 0.072 0.00237 0.61 0.073 0.00419 1.17 1.257 0.9546 1167872 Maybridge4_003379 OC(=O)CNC(=O)CSc1ccccn1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 J14 compound treatment 0.065 -0.00462 -1.19 0.068 -8.12E-4 -0.23 -1.002 -0.8267 1457281 Maybridge4_003380 COCc1cc(OC(=O)N(C)C)nc(n1)c2ccncc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 J15 compound treatment 0.067 -0.00263 -0.68 0.069 1.88E-4 0.05 -0.441 -0.6505 3178684 Maybridge4_003381 CN(C)/C=N/n1cnc2sc3CCCCc3c2c1=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 J16 compound treatment 0.094 0.0244 6.28 0.109 0.0402 11.19 12.3516 0.9626 3178685 Maybridge4_003382 NC(=N)NC(=N)Nc1cc(n[nH]1)c2cccs2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 J17 compound treatment 0.077 0.00737 1.9 0.082 0.0132 3.67 3.9396 0.9529 1294257 Maybridge4_003383 COc1cc(Cc2cc(OC)c(C)cc2OC)c(OC)cc1C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 J18 compound treatment 0.128 0.0584 15.03 0.105 0.0362 10.08 17.7539 0.9811 3178686 Maybridge4_003384 CCCCc1c(C)nc(nc1O)c2ccc(Cl)cc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 J19 compound treatment 0.07 3.75E-4 0.1 0.071 0.00219 0.61 0.499 0.8091 3176922 Maybridge4_003385 OC[C@H]1O[C@H](C[C@@H]1O)n2cc(Br)c(=O)[nH]c2=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 J20 compound treatment 0.156 0.0864 22.24 0.167 0.0982 27.34 35.0609 0.9947 3064863 Maybridge4_003386 COc1cc(/C=N/c2ccc(Cl)cc2)ccc1OC(=O)/C=C/c3cccs3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 J21 compound treatment 0.114 0.0444 11.43 0.121 0.0522 14.53 18.3559 0.9929 1169652 Maybridge4_003387 C1CN(CCO1)c2c3CCc4ccccc4-c3nc5ccccc25 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 J22 compound treatment 0.081 0.0114 2.93 0.084 0.0152 4.23 5.0617 0.9839 1608425 Maybridge4_003388 CCCC1=NN(C(=O)C(C)(C)C)C(=O)C1Cc2c(F)cccc2Cl 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 J23 mock treatment 0.069 -6.25E-4 -0.16 0.068 -8.12E-4 -0.23 -0.2738 -0.9861 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 J24 positive control 0.076 0.00637 1.64 0.077 0.00819 2.28 2.7729 0.987 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 K01 compound treatment 0.224 0.154 39.75 0.248 0.179 49.9 63.3918 0.9936 3064864 Maybridge4_003389 CSC1=N/C(=C\c2ccccc2O)/C(=O)N1Cc3ccc(Cl)cc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 K02 compound treatment 0.077 0.00737 1.9 0.079 0.0102 2.84 3.3489 0.9809 1422721 Maybridge4_003390 CCOC(=O)c1cnn(C(=O)COc2ccc(C)c3CCCc32)c1N 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 K03 compound treatment 0.252 0.182 46.96 0.246 0.177 49.35 68.0956 0.9997 3178687 Maybridge4_003391 CSC1=N/C(=C\c2ccc(Cl)cc2)/C(=O)N1CCc3c[nH]c4ccccc34 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 K04 compound treatment 0.176 0.106 27.39 0.176 0.107 29.85 40.4744 0.9991 1502240 Maybridge4_003392 COC(=O)c1[nH]c(C(=O)OC)c(O)c1O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 K05 compound treatment 0.075 0.00537 1.38 0.075 0.00619 1.72 2.197 0.9941 3064865 Maybridge4_003393 COc1cccc(NC(=O)c2cnccc2C(F)(F)F)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 K06 compound treatment 0.103 0.0334 8.59 0.103 0.0342 9.52 12.8086 0.9987 3178688 Maybridge4_003394 CCOC(=O)/C=C(\C)/Nc1cccc(N\C(=C\C(=O)OCC)\C)c1C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 K07 compound treatment 0.108 0.0384 9.88 0.128 0.0592 16.48 18.642 0.97 3064866 Maybridge4_003395 FC(F)(F)c1ccc(cc1)c2nc(NC(=O)Nc3ccccc3)cs2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 K08 compound treatment 0.149 0.0794 20.44 0.16 0.0912 25.4 32.408 0.9942 1570272 Maybridge4_003396 CCC1N(CCc2c1[nH]c3ccccc23)C(=O)c4ccc(Cl)cc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 K09 compound treatment 0.115 0.0454 11.68 0.131 0.0622 17.32 20.5072 0.9816 3064867 Maybridge4_003397 FC(F)(F)c1ccncc1C(=O)NC(=O)Nc2ccc(Cl)cc2Cl 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 K10 compound treatment 0.086 0.0164 4.22 0.088 0.0192 5.34 6.7597 0.9931 1687043 Maybridge4_003398 Cc1cc(C)c(COc2ccc3C(=O)CC(C)(C)Oc3c2C)c(C)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 K11 compound treatment 0.076 0.00637 1.64 0.078 0.00919 2.56 2.9699 0.977 3064868 Maybridge4_003399 FC(F)(F)c1ccc(nc1)n2nc(oc2=O)c3cccc(c3)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 K12 compound treatment 0.106 0.0364 9.37 0.107 0.0382 10.63 14.1425 0.998 1713701 Maybridge4_003400 COc1cccc(c1)C2CCN(CC2)C(=O)c3cccc4ccccc34 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 K13 compound treatment 0.113 0.0434 11.17 0.109 0.0402 11.19 15.8107 1.0 3064869 Maybridge4_003401 Cc1cc(C)c2c(=O)cc(oc2c1)c3ccccc3Cl 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 K14 compound treatment 0.106 0.0364 9.37 0.108 0.0392 10.91 14.3394 0.9971 3178689 Maybridge4_003402 FC(F)(F)c1ccc(cc1)C(=O)Nc2cccnc2Sc3ccc(Cl)cc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 K15 compound treatment 0.103 0.0334 8.59 0.102 0.0332 9.24 12.6117 0.9993 1294252 Maybridge4_003403 CCOC(=O)c1cnn2c1nc(Sc3ccc(C)cc3)c4ccccc42 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 K16 compound treatment 0.125 0.0554 14.26 0.124 0.0552 15.37 20.9493 0.9993 1553374 Maybridge4_003404 C1CN(CCO1)c2nnc(c3ccccc3)c(n2)c4ccccc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 K17 compound treatment 0.074 0.00437 1.13 0.074 0.00519 1.44 1.8181 0.9924 1663105 Maybridge4_003405 COc1ccc(Cc2cc(n[nH]c2=O)c3cccs3)c(OC)c1OC 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 K18 compound treatment 0.082 0.0124 3.19 0.08 0.0112 3.12 4.4561 0.9999 3064947 Maybridge4_003406 OC[C@H]1OC(Oc2ccc(cc2)c3coc4cc(O)cc(O)c4c3=O)[C@H](O)[C@@H](O)[C@@H]1O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 K19 compound treatment 0.079 0.00937 2.41 0.078 0.00919 2.56 3.516 0.9996 1252838 Maybridge4_003407 Cc1cc(C)n(NC(=S)NC2CCCC2)c(=O)c1C#N 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 K20 compound treatment 0.147 0.0774 19.92 0.144 0.0752 20.94 28.8931 0.9997 1353357 Maybridge4_003408 S=C1CC(Sc2ccccc2N1)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 K21 compound treatment 0.077 0.00737 1.9 0.076 0.00719 2.0 2.7581 0.9997 1332355 Maybridge4_003409 CC(=O)N1CCc2cc(NC(=S)NC3CCCCCC3)ccc12 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 K22 compound treatment 0.067 -0.00263 -0.68 0.068 -8.12E-4 -0.23 -0.6379 -0.895 3064948 Maybridge4_003410 CNC(=O)c1cc(OC)ccc1Br 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 K23 mock treatment 0.068 -0.00162 -0.42 0.069 1.88E-4 0.05 -0.2589 -0.6141 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 K24 positive control 0.077 0.00737 1.9 0.078 0.00919 2.56 3.1519 0.9892 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 L01 compound treatment 0.112 0.0424 10.91 0.112 0.0432 12.03 16.2194 0.9988 3064949 Maybridge4_003411 Cc1ncc(CO)c(/C=N/O)c1O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 L02 compound treatment 0.13 0.0604 15.54 0.117 0.0482 13.42 20.4811 0.9973 2085598 Maybridge4_003412 CSc1sc(=S)sc1SC 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 L03 compound treatment 0.072 0.00237 0.61 0.072 0.00319 0.89 1.0601 0.9834 1341478 Maybridge4_003413 NNC(=O)CC1(CC2CC3CC(C2)C1)C3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 L04 compound treatment 0.07 3.75E-4 0.1 0.071 0.00219 0.61 0.499 0.8091 1914392 Maybridge4_003414 O=C(c1ccccc1)n2ccc3ccccc23 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 L05 compound treatment 0.071 0.00137 0.35 0.072 0.00319 0.89 0.878 0.9187 3178690 Maybridge4_003415 C(SC1(CC2CC3CC(C2)C1)C3)c4ccccc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 L06 compound treatment 0.072 0.00237 0.61 0.073 0.00419 1.17 1.257 0.9546 1103414 Maybridge4_003416 OC(=O)C1CCCN1C(=O)OCC2c3ccccc3-c4ccccc24 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 L07 compound treatment 0.226 0.156 40.26 0.196 0.127 35.42 53.5158 0.998 3064950 Maybridge4_003417 Oc1ccccc1c2cc(c(C#N)c(=O)[nH]2)c3ccc4OCOc4c3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 L08 compound treatment 0.105 0.0354 9.11 0.112 0.0432 12.03 14.945 0.9906 3178691 Maybridge4_003418 FC(F)(F)c1cccc(c1)N2CCN(CC2)C3=Cc4ccccc4C3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 L09 compound treatment 0.099 0.0294 7.56 0.101 0.0322 8.96 11.6865 0.9964 3064952 Maybridge4_003419 O=C(/C=C\1/NCCOC1=O)c2ccccc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 L10 compound treatment 0.079 0.00937 2.41 0.081 0.0122 3.39 4.1068 0.9861 1604086 Maybridge4_003420 Clc1cccc(Cl)c1Cn2nnc(n2)N3CCCC3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 L11 compound treatment 0.067 -0.00263 -0.68 0.068 -8.12E-4 -0.23 -0.6379 -0.895 1004954 Maybridge4_003421 N(C(=Nc1ccccc1)Nc2ccccc2)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 L12 compound treatment 0.072 0.00237 0.61 0.072 0.00319 0.89 1.0601 0.9834 3178692 Maybridge4_003422 CC1CN(CC(C)O1)c2ccc(NC(=S)NCc3ccco3)cc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 L13 compound treatment 0.069 -6.25E-4 -0.16 0.07 0.00119 0.33 0.1201 0.3264 3178693 Maybridge4_003423 FC(F)(F)C(NC(=O)Oc1ccccc1)(Oc2ccccc2)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 L14 compound treatment 0.068 -0.00162 -0.42 0.068 -8.12E-4 -0.23 -0.4558 -0.9584 3064954 Maybridge4_003424 COCc1cc(O)nc(SCC(=O)C(C)(C)C)n1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 L15 compound treatment 0.068 -0.00162 -0.42 0.068 -8.12E-4 -0.23 -0.4558 -0.9584 1022292 Maybridge4_003425 O=C1NC(Cc2ccccc2)C(=O)N1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 L16 compound treatment 0.081 0.0114 2.93 0.084 0.0152 4.23 5.0617 0.9839 3064955 Maybridge4_003426 FC(F)(F)c1cc(cc(c1)C(F)(F)F)c2nnn(CC(=O)c3ccc(Cl)cc3)n2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 L17 compound treatment 0.092 0.0224 5.76 0.096 0.0272 7.57 9.4275 0.9909 1517030 Maybridge4_003427 CC(=O)Oc1ccc(OC(=O)C)c2cc3c(OC(=O)C)ccc(OC(=O)C)c3cc12 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 L18 compound treatment 0.174 0.104 26.87 0.167 0.0982 27.34 38.3379 1.0 3064957 Maybridge4_003428 CCN(CC)C(=S)Oc1nc(nc(C)c1CC(=C)C)c2ccc(Cl)cc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 L19 compound treatment 0.072 0.00237 0.61 0.071 0.00219 0.61 0.8632 1.0 1414175 Maybridge4_003429 NNC(=O)C1C(C1c2ccccc2)C(=O)NN 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 L20 compound treatment 0.118 0.0484 12.46 0.118 0.0492 13.7 18.4933 0.9989 1151671 Maybridge4_003430 CC(C)(C)C(=O)CSc1nc2ccccc2c(=O)n1CC3CC3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 L21 compound treatment 0.091 0.0214 5.5 0.096 0.0272 7.57 9.2454 0.9877 1294591 Maybridge4_003431 C1CCN(CC1)c2cc(nc3ccccc23)c4cccs4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 L22 compound treatment 0.142 0.0724 18.63 0.142 0.0732 20.38 27.5889 0.999 3178694 Maybridge4_003432 CCCC1=NN(C(=O)/C=C/c2cccs2)C(=O)C1Cc3c(F)cccc3Cl 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 L23 mock treatment 0.069 -6.25E-4 -0.16 0.067 -0.00181 -0.5 -0.4707 -0.8885 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 L24 positive control 0.075 0.00537 1.38 0.076 0.00719 2.0 2.394 0.9838 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 M01 compound treatment 0.075 0.00537 1.38 0.074 0.00519 1.44 2.0001 0.9998 1614322 Maybridge4_003433 CC(C)NC(=O)N(Cc1ccccc1)Cc2cccnc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 M02 compound treatment 0.077 0.00737 1.9 0.077 0.00819 2.28 2.955 0.9959 1632856 Maybridge4_003434 CCCCn1c(O)cc(C)c(C#N)c1=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 M03 compound treatment 0.315 0.245 63.18 0.343 0.274 76.36 98.667 0.9956 3178695 Maybridge4_003435 CSC1=N/C(=C\Nc2cccc(Cl)c2)/C(=O)N1Cc3cccc(Cl)c3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 M04 compound treatment 0.074 0.00437 1.13 0.074 0.00519 1.44 1.8181 0.9924 1626500 Maybridge4_003436 S=C(NCC1CC1)Nc2ccc3[nH]ccc3c2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 M05 compound treatment 0.075 0.00537 1.38 0.075 0.00619 1.72 2.197 0.9941 3178774 Maybridge4_003437 FC(F)(F)c1ccncc1C(=O)Nc2nc3ccccc3s2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 M06 compound treatment 0.076 0.00637 1.64 0.075 0.00619 1.72 2.3791 0.9997 3064958 Maybridge4_003438 NNC(=O)CC1=Nn2c(nnc2SC1)c3cccs3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 M07 compound treatment 0.104 0.0344 8.85 0.091 0.0222 6.18 10.6275 0.9846 3178775 Maybridge4_003439 CCN(Cc1cc(Cl)cc(Cl)c1)C(=O)c2cnc(OC)cc2C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 M08 compound treatment 0.07 3.75E-4 0.1 0.071 0.00219 0.61 0.499 0.8091 1042478 Maybridge4_003440 CNc1cc(=O)n(C)c(=O)n1C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 M09 compound treatment 0.072 0.00237 0.61 0.071 0.00219 0.61 0.8632 1.0 3064959 Maybridge4_003441 Fc1ccc(NC(=O)c2cnccc2C(F)(F)F)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 M10 compound treatment 0.075 0.00537 1.38 0.074 0.00519 1.44 2.0001 0.9998 1313888 Maybridge4_003442 COc1cc(ccc1O)C2=NC(O)C(=O)Nc3ccc(Cl)cc23 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 M11 compound treatment 0.069 -6.25E-4 -0.16 0.07 0.00119 0.33 0.1201 0.3264 3064960 Maybridge4_003443 NNC(=O)c1cc(OCC(F)(F)F)nc(OCC(F)(F)F)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 M12 compound treatment 0.117 0.0474 12.2 0.108 0.0392 10.91 16.342 0.9985 3178776 Maybridge4_003444 Fc1ccc(cc1)c2nnc(CSCc3cccc4ccccc34)o2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 M13 compound treatment 0.149 0.0794 20.44 0.148 0.0792 22.05 30.0449 0.9993 3178777 Maybridge4_003445 Clc1ccc(cc1)C(=O)CC(C(=O)c2ccccc2)c3cccs3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 M14 compound treatment 0.106 0.0364 9.37 0.104 0.0352 9.8 13.5517 0.9997 3064961 Maybridge4_003446 Nn1c(cc(c(C#N)c1=O)C(F)(F)F)c2ccccc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 M15 compound treatment 0.122 0.0524 13.48 0.125 0.0562 15.65 20.6 0.9973 3178778 Maybridge4_003447 CCOC(=O)c1cnn2c1nc(Oc3cc(cc(c3)C(F)(F)F)C(F)(F)F)c4ccccc42 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 M16 compound treatment 0.123 0.0534 13.74 0.131 0.0622 17.32 21.9636 0.9934 1593342 Maybridge4_003448 CC(C)NC(=O)c1cccc2cccc(Sc3ccccc3)c12 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 M17 compound treatment 0.11 0.0404 10.4 0.11 0.0412 11.47 15.4615 0.9988 1609655 Maybridge4_003449 O=c1[nH]nc(cc1CC2CCCCC2)c3cccs3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 M18 compound treatment 0.07 3.75E-4 0.1 0.07 0.00119 0.33 0.3021 0.8769 1690877 Maybridge4_003450 O=c1n(c2ccccc2)c(=O)n3C4CCC(C4)n31 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 M19 compound treatment 0.075 0.00537 1.38 0.075 0.00619 1.72 2.197 0.9941 1634815 Maybridge4_003451 Cc1cc(C)n(NC(=S)NCc2cccs2)c(=O)c1C#N 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 M20 compound treatment 0.147 0.0774 19.92 0.149 0.0802 22.33 29.8777 0.9984 3065001 Maybridge4_003452 C1Sc2ccccc2C3=Nc4ccccc4SC(C13)c5ccccc5 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 M21 compound treatment 0.149 0.0794 20.44 0.163 0.0942 26.23 32.9988 0.9924 3065002 Maybridge4_003453 CN(C)/C=C/C(=O)c1ccc(OCc2ccc(Cl)c(Cl)c2)c(C)c1O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 M22 compound treatment 0.068 -0.00162 -0.42 0.068 -8.12E-4 -0.23 -0.4558 -0.9584 3065003 Maybridge4_003454 NC(=O)c1cc(Cl)ccc1I 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 M23 mock treatment 0.07 3.75E-4 0.1 0.069 1.88E-4 0.05 0.1052 0.9584 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 M24 positive control 0.078 0.00837 2.16 0.077 0.00819 2.28 3.1371 0.9996 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 N01 compound treatment 0.083 0.0134 3.44 0.087 0.0182 5.07 6.0166 0.9823 1588083 Maybridge4_003455 CC(=O)Oc1ccc(cc1)c2coc3cc(OC(=O)C)cc(OC(=O)C)c3c2=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 N02 compound treatment 0.142 0.0724 18.63 0.135 0.0662 18.43 26.2105 1.0 1124592 Maybridge4_003456 CC1CC2(CCCCC2)N(Cc3ccccc13)S(=O)(=O)c4ccc(C)cc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 N03 compound treatment 0.074 0.00437 1.13 0.073 0.00419 1.17 1.6211 0.9998 3065004 Maybridge4_003457 CNC(=S)C1(CC2CC3CC(C2)C1)C3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 N04 compound treatment 0.069 -6.25E-4 -0.16 0.07 0.00119 0.33 0.1201 0.3264 1007974 Maybridge4_003458 O=C(Nc1ccccc1)OC2CCCC2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 N05 compound treatment 0.09 0.0204 5.25 0.092 0.0232 6.46 8.2756 0.9947 3178779 Maybridge4_003459 CC(CNc1ccccc1)/C(=N/c2ccccc2)/Nc3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 N06 compound treatment 0.072 0.00237 0.61 0.073 0.00419 1.17 1.257 0.9546 1711036 Maybridge4_003460 CC1(C)c2ccccc2N3CC(=O)N(CC=C)C31C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 N07 compound treatment 0.07 3.75E-4 0.1 0.071 0.00219 0.61 0.499 0.8091 854262 Maybridge4_003461 CC(N)(Cc1cccc(O)c1)C(=O)O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 N08 compound treatment 0.085 0.0154 3.96 0.087 0.0182 5.07 6.3807 0.9926 1129507 Maybridge4_003462 CC(N(C(=O)c1sc2ccccc2c1Cl)c3ccccn3)c4ccco4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 N09 compound treatment 0.076 0.00637 1.64 0.072 0.00319 0.89 1.7883 0.9584 1387784 Maybridge4_003463 COc1ccc(Sc2ccccc2COC(=O)C)c(c1)C(=O)O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 N10 compound treatment 0.069 -6.25E-4 -0.16 0.069 1.88E-4 0.05 -0.0769 -0.4543 1366361 Maybridge4_003464 NNC(=O)Cn1nnc(n1)N2CCCC2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 N11 compound treatment 0.068 -0.00162 -0.42 0.068 -8.12E-4 -0.23 -0.4558 -0.9584 3178780 Maybridge4_003465 CC1(C)NCS[C@H]1C(=O)O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 N12 compound treatment 0.069 -6.25E-4 -0.16 0.069 1.88E-4 0.05 -0.0769 -0.4543 2078075 Maybridge4_003466 CC[n+]1c(C)csc1Nc2ccc(cc2)N3CC(C)OC(C)C3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 N13 compound treatment 0.079 0.00937 2.41 0.079 0.0102 2.84 3.713 0.9968 3178781 Maybridge4_003467 CCOC(NC(=O)Nc1ccc(Br)cc1)(C(F)(F)F)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 N14 compound treatment 0.082 0.0124 3.19 0.089 0.0202 5.62 6.2284 0.9638 3065007 Maybridge4_003468 FC(F)(F)c1cc(=O)oc2cc(NC(=O)c3cc(Cl)cc(Cl)c3)ccc12 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 N15 compound treatment 0.23 0.16 41.29 0.223 0.154 42.94 59.561 0.9998 1675436 Maybridge4_003469 CCOC(=O)c1c(C)n(O)c2ccc3nonc3c12 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 N16 compound treatment 0.082 0.0124 3.19 0.099 0.0302 8.41 8.1976 0.9118 1084802 Maybridge4_003470 CC(C)CCc1c(C)nc(N)nc1O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 N17 compound treatment 0.072 0.00237 0.61 0.072 0.00319 0.89 1.0601 0.9834 1383041 Maybridge4_003471 Clc1ccc(C(=O)N2CCC(CC2)NC(=O)c3ccccc3)c(Cl)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 N18 compound treatment 0.072 0.00237 0.61 0.07 0.00119 0.33 0.6662 0.9584 3065008 Maybridge4_003472 CS/C(=N/C(C)(C)C)/Nc1ccccc1Cl 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 N19 compound treatment 0.069 -6.25E-4 -0.16 0.069 1.88E-4 0.05 -0.0769 -0.4543 1673966 Maybridge4_003473 Cc1c(NC(=O)C(C)(C)C)c(=O)n(c2ccccc2)n1C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 N20 compound treatment 0.074 0.00437 1.13 0.074 0.00519 1.44 1.8181 0.9924 1479223 Maybridge4_003474 Cc1cc(Nc2ccc(F)c(Cl)c2)nc(NC(=O)C(C)(C)C)n1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 N21 compound treatment 0.124 0.0544 14.0 0.121 0.0522 14.53 20.1765 0.9998 1920716 Maybridge4_003475 CC(C)COc1ccc(cc1)/C(=N\O)/c2ccccc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 N22 compound treatment 0.07 3.75E-4 0.1 0.069 1.88E-4 0.05 0.1052 0.9584 3178782 Maybridge4_003476 CC(=C)CC1C(=NN(C1=O)S(=O)(=O)c2ccccc2Cl)C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 N23 mock treatment 0.071 0.00137 0.35 0.07 0.00119 0.33 0.4842 0.9994 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 N24 positive control 0.076 0.00637 1.64 0.076 0.00719 2.0 2.576 0.9951 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 O01 compound treatment 0.139 0.0694 17.86 0.142 0.0732 20.38 27.0428 0.9978 3178783 Maybridge4_003477 CSC1=N/C(=C\c2ccc(Cl)cc2)/C(=O)N1CCOc3ccc(Cl)cc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 O02 compound treatment 0.156 0.0864 22.24 0.147 0.0782 21.77 31.1224 0.9999 3065009 Maybridge4_003478 Cc1ccc(OCc2nnc(S)n2C3CCCCC3)c4CCCc41 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 O03 compound treatment 0.069 -6.25E-4 -0.16 0.07 0.00119 0.33 0.1201 0.3264 1042314 Maybridge4_003479 CNC(=O)Nc1cccc2cccnc12 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 O04 compound treatment 0.078 0.00837 2.16 0.077 0.00819 2.28 3.1371 0.9996 1378461 Maybridge4_003480 S=C(NC1CCCCC1)Nc2ccc3[nH]ccc3c2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 O05 compound treatment 0.072 0.00237 0.61 0.072 0.00319 0.89 1.0601 0.9834 3178784 Maybridge4_003481 FC(F)(F)c1ccncc1C(=O)NCc2ccccc2Cl 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 O06 compound treatment 0.072 0.00237 0.61 0.072 0.00319 0.89 1.0601 0.9834 3065010 Maybridge4_003482 CC(C)(C)C(=S)Nc1cccc(Cl)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 O07 compound treatment 0.085 0.0154 3.96 0.091 0.0222 6.18 7.1684 0.9768 3178785 Maybridge4_003483 COc1cccc(CNC(=O)c2cnc(OC)cc2C(F)(F)F)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 O08 compound treatment 0.071 0.00137 0.35 0.071 0.00219 0.61 0.6811 0.9667 1115300 Maybridge4_003484 NNC(=O)COc1ccccc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 O09 compound treatment 0.134 0.0644 16.57 0.155 0.0862 24.0 28.6925 0.9837 3178786 Maybridge4_003485 NC(=O)C1=CN(CCC1C(F)(F)F)C(=O)Nc2ccc(Cl)cc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 O10 compound treatment 0.151 0.0814 20.95 0.151 0.0822 22.89 30.9998 0.999 1008942 Maybridge4_003486 Cc1cccc(NC(=O)Nc2cccc(C)c2)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 O11 compound treatment 0.083 0.0134 3.44 0.082 0.0132 3.67 5.032 0.9995 3178787 Maybridge4_003487 FC(F)(F)COc1ncccc1C(=O)NCc2ccc(Cl)c(Cl)c2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 O12 compound treatment 0.101 0.0314 8.08 0.113 0.0442 12.31 14.4137 0.9792 1449652 Maybridge4_003488 COC(=O)C(Cc1c[nH]c2ccccc12)NS(=O)(=O)c3ccc(CNC(=O)c4ccccc4)s3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 O13 compound treatment 0.129 0.0594 15.29 0.133 0.0642 17.88 23.4498 0.997 3178788 Maybridge4_003489 COC(=O)c1cc2cc(Br)ccc2c(Br)c1OC 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 O14 compound treatment 0.068 -0.00162 -0.42 0.068 -8.12E-4 -0.23 -0.4558 -0.9584 1523809 Maybridge4_003490 CCOC(=O)COc1nc(C)c(CC=C)c(C)c1C#N 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 O15 compound treatment 0.118 0.0484 12.46 0.11 0.0412 11.47 16.9179 0.9992 1444175 Maybridge4_003491 CCOC(=O)c1cnn2c1nc(N3CC(C)CC(C)C3)c4ccccc42 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 O16 compound treatment 0.373 0.303 78.11 0.344 0.275 76.64 109.4233 1.0 3065040 Maybridge4_003492 O=C1/C(=C/c2ccc3ccccc3c2)/COc4ccccc14 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 O17 compound treatment 0.072 0.00237 0.61 0.072 0.00319 0.89 1.0601 0.9834 3065041 Maybridge4_003493 Cc1cc(CO)cc(C)c1Br 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 O18 compound treatment 0.07 3.75E-4 0.1 0.069 1.88E-4 0.05 0.1052 0.9584 1280927 Maybridge4_003494 O=c1n(c2ccccc2)c(=O)n3C4CC(C=C4)n31 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 O19 compound treatment 0.07 3.75E-4 0.1 0.07 0.00119 0.33 0.3021 0.8769 3065042 Maybridge4_003495 CC1=C(Sc2ccccc2N1)C(=O)Nn3cnc4cccc(F)c4c3=N 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 O20 compound treatment 0.192 0.122 31.51 0.19 0.121 33.75 46.1443 0.9994 3065043 Maybridge4_003496 Cc1ccc(cc1)C2CC(=Nc3ccccc3S2)c4ccccc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 O21 compound treatment 0.09 0.0204 5.25 0.102 0.0332 9.24 10.2449 0.964 1222795 Maybridge4_003497 CCOC(=O)c1cnn(C(=O)COc2ccc(cc2C(C)(C)C)C(C)(C)C)c1N 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 O22 compound treatment 0.083 0.0134 3.44 0.083 0.0142 3.95 5.2289 0.9977 3065044 Maybridge4_003498 Cc1cc(nc2CC(C)(C)C/C(=N/O)/c12)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 O23 mock treatment 0.07 3.75E-4 0.1 0.069 1.88E-4 0.05 0.1052 0.9584 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 O24 positive control 0.076 0.00637 1.64 0.077 0.00819 2.28 2.7729 0.987 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 P01 compound treatment 0.088 0.0184 4.73 0.086 0.0172 4.79 6.73 1.0 1411988 Maybridge4_003499 O=C(CC#N)NC(=O)NC1(CC2CC3CC(C2)C1)C3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 P02 compound treatment 0.076 0.00637 1.64 0.076 0.00719 2.0 2.576 0.9951 1452749 Maybridge4_003500 CC1CC2(CCCCC2)N(Cc3ccccc13)C(=O)C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 P03 compound treatment 0.153 0.0834 21.47 0.152 0.0832 23.17 31.5608 0.9993 2102798 Maybridge4_003501 COC(=O)/C=C\1/OC(=CC1=O)c2ccccc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 P04 compound treatment 0.075 0.00537 1.38 0.075 0.00619 1.72 2.197 0.9941 1582498 Maybridge4_003502 CC(=O)NC(=O)NCc1ccccc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 P05 compound treatment 0.078 0.00837 2.16 0.083 0.0142 3.95 4.3186 0.9594 3065047 Maybridge4_003503 CCOC(=O)CC1=NC(=O)CS1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 P06 compound treatment 0.075 0.00537 1.38 0.075 0.00619 1.72 2.197 0.9941 1631994 Maybridge4_003504 Cc1ccc2N3CC(=O)N(Cc4ccccc4)C3(C)C(C)(C)c2c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 P07 compound treatment 0.072 0.00237 0.61 0.072 0.00319 0.89 1.0601 0.9834 3065048 Maybridge4_003505 CC(=O)N1CC(O)C[C@H]1C(=O)O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 P08 compound treatment 0.078 0.00837 2.16 0.077 0.00819 2.28 3.1371 0.9996 3178789 Maybridge4_003506 CN1N=C(C)C(Cc2c(Cl)cccc2Cl)C1=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 P09 compound treatment 0.08 0.0104 2.67 0.083 0.0142 3.95 4.6827 0.9818 1247915 Maybridge4_003507 O=C(Oc1ccc(Oc2ccccc2)cc1)N3CCC(CC3)OC(=O)n4ccnc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 P10 compound treatment 0.073 0.00337 0.87 0.071 0.00219 0.61 1.0452 0.9849 3065049 Maybridge4_003508 CN(C)/N=C(\Cn1nnc(n1)N2CCCC2)/c3ccc(Cl)cc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 P11 compound treatment 0.071 0.00137 0.35 0.07 0.00119 0.33 0.4842 0.9994 1294581 Maybridge4_003509 OC(=O)c1ccc2cc[nH]c2c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 P12 compound treatment 0.068 -0.00162 -0.42 0.073 0.00419 1.17 0.5288 0.4268 1153919 Maybridge4_003510 CC(C)(C)c1ccc(NC(=S)NCc2cccnc2)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 P13 compound treatment 0.069 -6.25E-4 -0.16 0.069 1.88E-4 0.05 -0.0769 -0.4543 3178790 Maybridge4_003511 CN(C)C(=O)NC(Nc1cc(C)on1)(C(F)(F)F)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 P14 compound treatment 0.072 0.00237 0.61 0.071 0.00219 0.61 0.8632 1.0 1634696 Maybridge4_003512 OCN1N=C(CCC1=O)c2cccs2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 P15 compound treatment 0.07 3.75E-4 0.1 0.07 0.00119 0.33 0.3021 0.8769 1538301 Maybridge4_003513 OC(=O)CCn1nc(Nc2ccccc2)n(c3ccccc3)c1=S 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 P16 compound treatment 0.07 3.75E-4 0.1 0.073 0.00419 1.17 0.8929 0.763 3065050 Maybridge4_003514 COCc1nc(S)nc(O)c1Cc2c(F)cccc2Cl 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 P17 compound treatment 0.073 0.00337 0.87 0.073 0.00419 1.17 1.4391 0.9895 1358448 Maybridge4_003515 COc1ccccc1C2CCN(CC2)C(=O)c3cccs3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 P18 compound treatment 0.069 -6.25E-4 -0.16 0.072 0.00319 0.89 0.5139 0.5696 3065051 Maybridge4_003516 CC(C)(C)NC(=S)NCC1CC1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 P19 compound treatment 0.145 0.0754 19.41 0.144 0.0752 20.94 28.529 0.9993 1357507 Maybridge4_003517 Clc1ccc(Nc2ccc(nn2)c3ccccc3)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 P20 compound treatment 0.131 0.0614 15.8 0.131 0.0622 17.32 23.4201 0.999 1680143 Maybridge4_003518 Cc1cc(Nc2ccc(F)cc2)nc(SCc3c(Cl)cccc3Cl)n1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 P21 compound treatment 0.068 -0.00162 -0.42 0.07 0.00119 0.33 -0.062 -0.1162 1714479 Maybridge4_003519 CCOC(=O)N1CCN(CC(O)Cn2c(=O)n(C)c3ncn(C)c3c2=O)CC1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 P22 compound treatment 0.083 0.0134 3.44 0.082 0.0132 3.67 5.032 0.9995 3178866 Maybridge4_003520 CCCC1=NN(C(=O)C1CC=C)S(=O)(=O)c2ccc(Cl)cc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 P23 mock treatment 0.069 -6.25E-4 -0.16 0.069 1.88E-4 0.05 -0.0769 -0.4543 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2058 P24 positive control 0.077 0.00737 1.9 0.078 0.00919 2.56 3.1519 0.9892 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 A01 compound treatment 0.097 0.0281 7.24 0.111 0.0382 10.65 12.6543 0.9823 1585984 Maybridge4_003521 CC1=NN(C(=O)C2CC2)C(=O)C1Cc3ccc(F)cc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 A02 compound treatment 0.223 0.154 39.68 0.224 0.151 42.12 57.8462 0.9996 1074928 Maybridge4_003522 S=c1cc(ss1)c2ccccc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 A03 compound treatment 0.079 0.0101 2.61 0.082 0.00925 2.58 3.6664 1.0 3178867 Maybridge4_003523 Fc1ccc(N(C(=O)c2ccco2)C3=NCCCC(=O)S3)c(F)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 A04 compound treatment 0.101 0.0321 8.27 0.107 0.0343 9.54 12.5948 0.9975 3065053 Maybridge4_003524 CN(C)C(=S)Nc1cc(cc(c1)C(F)(F)F)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 A05 compound treatment 0.121 0.0521 13.42 0.133 0.0602 16.78 21.356 0.9939 1513145 Maybridge4_003525 CCCc1nc(SCC(=O)c2ccc(Cl)cc2)nc(OC(=O)N(CC)CC)c1C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 A06 compound treatment 0.077 0.00813 2.09 0.081 0.00825 2.3 3.1054 0.9989 1235942 Maybridge4_003526 CC(C)(C)NC(=O)Nc1ccc2ccccc2c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 A07 compound treatment 0.119 0.0501 12.91 0.112 0.0393 10.93 16.8565 0.9966 1494176 Maybridge4_003527 Cc1cccc(NC(=S)Nc2ccccn2)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 A08 compound treatment 0.076 0.00713 1.84 0.08 0.00725 2.02 2.7264 0.9989 3065054 Maybridge4_003528 CNN1C(=O)c2cccc3cccc(C1=O)c23 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 A09 compound treatment 0.169 0.1 25.78 0.181 0.108 30.15 39.5473 0.997 1077258 Maybridge4_003529 COc1ccc(cc1)C(CC(=O)c2ccccc2)CC(=O)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 A10 compound treatment 0.082 0.0131 3.38 0.086 0.0133 3.69 5.0003 0.999 3065056 Maybridge4_003530 Brc1ccc(cc1)C(=O)CC(CC(=O)c2ccc(Br)cc2)c3cccnc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 A11 compound treatment 0.075 0.00613 1.58 0.077 0.00425 1.18 1.9536 0.9899 1076053 Maybridge4_003531 CN(C)CN1C(=O)c2ccccc2C1=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 A12 compound treatment 0.083 0.0141 3.64 0.08 0.00725 2.02 4.0008 0.9614 1711456 Maybridge4_003532 O=C1CSC(N1c2cccnc2)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 A13 compound treatment 0.082 0.0131 3.38 0.079 0.00625 1.74 3.6218 0.9523 3065058 Maybridge4_003533 Cc1c(C)c(NC(=O)/C=C/C(=O)O)c(C)c(C)c1NC(=O)/C=C/C(=O)O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 A14 compound treatment 0.073 0.00413 1.06 0.073 2.5E-4 0.07 0.8017 0.7518 3065084 Maybridge4_003534 CCc1ccc(cc1)n2nn[nH]c2=S 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 A15 compound treatment 0.148 0.0791 20.37 0.147 0.0742 20.68 29.0286 1.0 1012391 Maybridge4_003535 Clc1cccc(NC(=S)Nc2cccc(Cl)c2)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 A16 compound treatment 0.073 0.00413 1.06 0.078 0.00525 1.46 1.7864 0.9878 3065085 Maybridge4_003536 Cc1oc2ccccc2c1CNC(=O)N 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 A17 compound treatment 0.138 0.0691 17.8 0.128 0.0553 15.39 23.4664 0.9974 1164445 Maybridge4_003537 CCc1ccc(cc1)N2C(=O)CC(Sc3ccccc3N)C2=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 A18 compound treatment 0.126 0.0571 14.71 0.126 0.0532 14.83 20.8879 1.0 3065086 Maybridge4_003538 C/C(=N\CCc1ccc(Cl)cc1)/c2ccccc2O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 A19 compound treatment 0.072 0.00313 0.81 0.075 0.00225 0.63 1.0135 0.9922 1020973 Maybridge4_003539 CC1(NC(=O)NC1=O)C2CC2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 A20 compound treatment 0.084 0.0151 3.9 0.086 0.0133 3.69 5.3644 0.9996 3065087 Maybridge4_003540 Cc1ccc(NC(=C2C(=O)c3ccccc3C2=O)C#N)c(Cl)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 A21 compound treatment 0.077 0.00813 2.09 0.079 0.00625 1.74 2.7115 0.9958 3065088 Maybridge4_003541 CC(=O)Nc1nnc(o1)c2c(C)onc2c3c(Cl)cccc3Cl 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 A22 compound treatment 0.073 0.00413 1.06 0.078 0.00525 1.46 1.7864 0.9878 3065089 Maybridge4_003542 Cc1cc(SCc2ccc(F)cc2)c(C)cc1Cl 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 A23 mock treatment 0.074 0.00513 1.32 0.077 0.00425 1.18 1.7715 0.9985 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 A24 positive control 0.076 0.00713 1.84 0.079 0.00625 1.74 2.5295 0.9996 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 B01 compound treatment 0.075 0.00613 1.58 0.082 0.00925 2.58 2.9382 0.9724 1186435 Maybridge4_003543 CCc1ccc(O)c(c1)C2(O)C(=O)c3ccccc3C2=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 B02 compound treatment 0.1 0.0311 8.02 0.104 0.0313 8.7 11.822 0.9992 1389708 Maybridge4_003544 CCOc1ccc(NC23SCC(=O)C3CCc4ccccc42)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 B03 compound treatment 0.076 0.00713 1.84 0.081 0.00825 2.3 2.9233 0.9938 1565816 Maybridge4_003545 CC(C)(C)c1ccc(cc1)C(=O)Oc2ccccc2CCC(=O)O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 B04 compound treatment 0.327 0.258 66.46 0.311 0.238 66.35 93.9128 1.0 3178868 Maybridge4_003546 CCSC(=S)c1c(C)nn(c1O)c2ccccc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 B05 compound treatment 0.123 0.0541 13.94 0.13 0.0573 15.94 21.1294 0.9978 1315983 Maybridge4_003547 Clc1ccc(NC(C#N)c2ccccc2)c(Cl)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 B06 compound treatment 0.072 0.00313 0.81 0.077 0.00425 1.18 1.4074 0.9825 1049908 Maybridge4_003548 Fc1ccc(cc1)C(=O)c2ccccc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 B07 compound treatment 0.093 0.0241 6.21 0.089 0.0163 4.53 7.5937 0.9879 3178869 Maybridge4_003549 NC(=S)Nc1ccccc1OC(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 B08 compound treatment 0.074 0.00513 1.32 0.079 0.00625 1.74 2.1653 0.9908 3178870 Maybridge4_003550 COc1ccc(cc1)C(=O)NCc2c(C)onc2c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 B09 compound treatment 0.094 0.0251 6.47 0.1 0.0273 7.59 9.9419 0.9969 3065091 Maybridge4_003551 CC1CN(CC(C)O1)c2ccccc2OC(=O)Nc3ccc(OC(F)(F)F)cc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 B10 compound treatment 0.132 0.0631 16.25 0.146 0.0732 20.4 25.9187 0.9937 3178871 Maybridge4_003552 Clc1ccc2nc(NC(=O)C3CN(C3)C(c4ccccc4)c5ccccc5)sc2c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 B11 compound treatment 0.121 0.0521 13.42 0.127 0.0543 15.11 20.1745 0.9983 3178872 Maybridge4_003553 COc1ccc2cc(ccc2c1)C(C)C(=O)Nc3ccc(OC(F)(F)F)cc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 B12 compound treatment 0.073 0.00413 1.06 0.077 0.00425 1.18 1.5894 0.9986 3065092 Maybridge4_003554 CCc1ccnc(NC(=O)CC2(CC(=O)O)CCCCC2)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 B13 compound treatment 0.078 0.00913 2.35 0.078 0.00525 1.46 2.6967 0.9739 1734850 Maybridge4_003555 COc1cc2N3C(=O)c4ccccc4C3(O)OC(=O)c2cc1OC 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 B14 compound treatment 0.088 0.0191 4.93 0.088 0.0153 4.25 6.4865 0.9973 3065093 Maybridge4_003556 Cc1nn(nc1CNC(=O)c2cc(F)cc3COCOc23)c4ccccc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 B15 compound treatment 0.068 -8.67E-4 -0.22 0.073 2.5E-4 0.07 -0.1086 -0.4644 3178873 Maybridge4_003557 NNC(=S)NCc1ccc(F)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 B16 compound treatment 0.073 0.00413 1.06 0.076 0.00325 0.91 1.3925 0.9968 3178874 Maybridge4_003558 Cc1nn(C)c2sc(cc12)C(=O)N(Cc3ccccn3)Cc4ccccn4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 B17 compound treatment 0.076 0.00713 1.84 0.076 0.00325 0.91 1.9387 0.9468 3065094 Maybridge4_003559 CN/1N=C(CS\C1=N\c2ccccc2)C(C)(C)C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 B18 compound treatment 0.15 0.0811 20.89 0.161 0.0882 24.58 32.1496 0.9967 3178875 Maybridge4_003560 O=C(Nc1ccc(cc1)N2CCOCC2)c3cnc4ccccc4n3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 B19 compound treatment 0.074 0.00513 1.32 0.077 0.00425 1.18 1.7715 0.9985 1661129 Maybridge4_003561 Cc1ccc(CNC(=S)NCCO)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 B20 compound treatment 0.072 0.00313 0.81 0.076 0.00325 0.91 1.2105 0.9984 3178876 Maybridge4_003562 CN1CCN(CC1)c2ccc(CNC(=O)c3ccc4OCCOc4c3)cc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 B21 compound treatment 0.124 0.0551 14.2 0.116 0.0432 12.04 18.5545 0.9967 1246483 Maybridge4_003563 COc1ccc(cc1)C2C3CCc4ccccc4C3=NN2CCOC(=O)C5CC5 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 B22 compound treatment 0.07 0.00113 0.29 0.073 2.5E-4 0.07 0.2556 0.8519 1407515 Maybridge4_003564 CCOC(=O)C1CCN(CC1)C(=O)CN2C(=O)c3ccccc3C2=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 B23 mock treatment 0.071 0.00213 0.55 0.075 0.00225 0.63 0.8315 0.9978 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 B24 positive control 0.074 0.00513 1.32 0.078 0.00525 1.46 1.9684 0.9987 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 C01 compound treatment 0.103 0.0341 8.79 0.109 0.0362 10.1 13.3528 0.9976 3178877 Maybridge4_003565 CCCc1cc(O)nc(NC(=N)Nc2cccc(c2)C(F)(F)F)n1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 C02 compound treatment 0.088 0.0191 4.93 0.095 0.0222 6.2 7.865 0.9935 3065097 Maybridge4_003566 O=C1N(Nc2ccc(cc2)N3CCOCC3)C(=O)c4ccccc14 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 C03 compound treatment 0.109 0.0401 10.33 0.122 0.0493 13.72 17.0052 0.9903 3065098 Maybridge4_003567 CCCc1nc(SCC2CC2)nc(O)c1CC=C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 C04 compound treatment 0.205 0.136 35.05 0.214 0.141 39.34 52.5999 0.9983 3178878 Maybridge4_003568 Oc1c(Cl)cc(Cl)cc1/C=N/c2ccnn2c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 C05 compound treatment 0.128 0.0591 15.23 0.13 0.0573 15.94 22.0397 0.9997 3178879 Maybridge4_003569 FC(F)(F)c1ccc(NC(=S)NC(=O)/C=C/c2ccccc2)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 C06 compound treatment 0.111 0.0421 10.85 0.104 0.0313 8.7 13.8246 0.994 1525321 Maybridge4_003570 CCc1ccc(NC(=S)Nc2ccccc2C(C)C)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 C07 compound treatment 0.1 0.0311 8.02 0.103 0.0302 8.42 11.6251 0.9997 1218939 Maybridge4_003571 NNC(=S)NC1CCCCCCCCCCC1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 C08 compound treatment 0.255 0.186 47.92 0.233 0.16 44.63 65.4444 0.9994 3065100 Maybridge4_003572 C(N1C2CCCCCN2c3ccccc13)c4ccncc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 C09 compound treatment 0.189 0.12 30.93 0.174 0.101 28.2 41.81 0.9989 3178880 Maybridge4_003573 O=C(CC(CC(=O)c1ccccc1)c2cccc3ccccc23)c4ccccc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 C10 compound treatment 0.159 0.0901 23.21 0.177 0.104 29.03 36.939 0.9938 3178881 Maybridge4_003574 Cn1cccc1C(=S)NC(=O)Nc2ccccc2Cl 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 C11 compound treatment 0.068 -8.67E-4 -0.22 0.071 -0.00175 -0.49 -0.5024 -0.9373 3065101 Maybridge4_003575 CC1CC(CC(C)(C)C1)NC(=S)N(C)C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 C12 compound treatment 0.075 0.00613 1.58 0.077 0.00425 1.18 1.9536 0.9899 3065130 Maybridge4_003576 Clc1ccc(cc1)N2C(SCC2=O)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 C13 compound treatment 0.134 0.0651 16.77 0.132 0.0592 16.5 23.5259 1.0 1084590 Maybridge4_003577 FC(F)(F)c1cccc(c1)n2c(=O)c3ccccc3[nH]c2=S 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 C14 compound treatment 0.073 0.00413 1.06 0.08 0.00725 2.02 2.1802 0.9552 3065131 Maybridge4_003578 COc1ccc(Nc2cc(ccc2Cl)C(F)(F)F)c(c1)C(=O)O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 C15 compound treatment 0.07 0.00113 0.29 0.083 0.0103 2.85 2.2248 0.7753 1657408 Maybridge4_003579 CCOc1ccc(cc1)n2c(=O)c3cc4c(=O)n(c5ccc(OCC)cc5)c(=O)c4cc3c2=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 C16 compound treatment 0.145 0.0761 19.6 0.15 0.0772 21.51 29.0732 0.9989 3065132 Maybridge4_003580 C/C(=N\CCc1c[nH]c2ccccc12)/c3ccccc3O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 C17 compound treatment 0.072 0.00313 0.81 0.077 0.00425 1.18 1.4074 0.9825 3065134 Maybridge4_003581 CCc1ccc(NC2=NCCS2)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 C18 compound treatment 0.07 0.00113 0.29 0.072 -7.5E-4 -0.21 0.0586 0.1634 3065135 Maybridge4_003582 Clc1ccc(CCn2nn[nH]c2=S)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 C19 compound treatment 0.136 0.0671 17.28 0.143 0.0703 19.56 26.0562 0.9981 1919115 Maybridge4_003583 COc1ccc(CC/N=C/c2ccccc2O)cc1OC 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 C20 compound treatment 0.675 0.606 156.06 0.658 0.585 162.99 225.6021 0.9998 3065136 Maybridge4_003584 O=C1C(=C(Nc2cccnc2)C#N)C(=O)c3ccccc13 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 C21 compound treatment 0.118 0.0491 12.65 0.117 0.0442 12.32 17.6591 0.9999 1317332 Maybridge4_003585 CC(C)c1cccc(C(C)C)c1NC(=S)Nc2cccc(C)c2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 C22 compound treatment 0.082 0.0131 3.38 0.079 0.00625 1.74 3.6218 0.9523 3065137 Maybridge4_003586 Clc1ccc(s1)C(=O)CC2OC(=O)c3ccccc23 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 C23 mock treatment 0.069 1.33E-4 0.03 0.076 0.00325 0.91 0.6643 0.7334 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 C24 positive control 0.077 0.00813 2.09 0.086 0.0133 3.69 4.09 0.964 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 D01 compound treatment 0.178 0.109 28.1 0.171 0.0983 27.36 39.2165 0.9999 1200638 Maybridge4_003587 Cc1ccc(cc1)N2C(C(=O)c3ccc(C)cc3O)c4ccccc4C2=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 D02 compound treatment 0.072 0.00313 0.81 0.077 0.00425 1.18 1.4074 0.9825 1391574 Maybridge4_003588 COc1ccc(Cc2nnc(N)o2)cc1OC 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 D03 compound treatment 0.078 0.00913 2.35 0.086 0.0133 3.69 4.2721 0.9763 1057870 Maybridge4_003589 O=C1CC(=O)N(Cc2ccccc2)C(=O)N1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 D04 compound treatment 0.082 0.0131 3.38 0.093 0.0203 5.64 6.3788 0.9701 1006014 Maybridge4_003590 OC(=O)c1cc(O)nc(O)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 D05 compound treatment 0.072 0.00313 0.81 0.078 0.00525 1.46 1.6043 0.9607 3178961 Maybridge4_003591 Cc1ccc(F)cc1N2C(=O)COCC2=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 D06 compound treatment 0.072 0.00313 0.81 0.075 0.00225 0.63 1.0135 0.9922 3065138 Maybridge4_003592 N[C@@H](CC1CCCCC1)C(=O)O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 D07 compound treatment 0.077 0.00813 2.09 0.078 0.00525 1.46 2.5146 0.9846 3178962 Maybridge4_003593 OCC1(CO)CSC(=N1)Nc2ccc(F)cc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 D08 compound treatment 0.073 0.00413 1.06 0.074 0.00125 0.35 0.9987 0.8919 3065139 Maybridge4_003594 Cc1onc(c1CNC(=O)C2CCC2)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 D09 compound treatment 0.082 0.0131 3.38 0.084 0.0113 3.13 4.6064 0.9993 3178963 Maybridge4_003595 FC(F)(F)Oc1ccc(NC(=O)Oc2ccccc2N3CCOCC3)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 D10 compound treatment 0.096 0.0271 6.99 0.097 0.0243 6.75 9.7153 0.9999 3178964 Maybridge4_003596 O=C(NCc1cc2ccccc2s1)C3CN(C3)C(c4ccccc4)c5ccccc5 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 D11 compound treatment 0.069 1.33E-4 0.03 0.073 2.5E-4 0.07 0.0735 0.9469 1719612 Maybridge4_003597 O=C1CC2(CCCc3ccccc32)C(=O)N1CN4CCOCC4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 D12 compound treatment 0.1 0.0311 8.02 0.108 0.0352 9.82 12.6097 0.9949 3178965 Maybridge4_003598 Fc1cc(NC(=O)Nc2ccc(cc2)c3nc4ccccc4s3)c5OCOCc5c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 D13 compound treatment 0.169 0.1 25.78 0.162 0.0892 24.86 35.8057 0.9998 3065140 Maybridge4_003599 CCCC(/N=C/c1cc(Cl)ccc1O)/N=C/c2cc(Cl)ccc2O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 D14 compound treatment 0.08 0.0111 2.87 0.088 0.0153 4.25 5.03 0.9817 3178966 Maybridge4_003600 CC(C)c1ccc(NC(=O)c2cc(F)cc3COCOc23)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 D15 compound treatment 0.069 1.33E-4 0.03 0.071 -0.00175 -0.49 -0.3203 -0.6557 3065142 Maybridge4_003601 Fc1ccc(Cn2nn[nH]c2=S)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 D16 compound treatment 0.072 0.00313 0.81 0.076 0.00325 0.91 1.2105 0.9984 3178967 Maybridge4_003602 Cc1cc(CNC(=O)c2cc(C)n(C)n2)c(o1)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 D17 compound treatment 0.125 0.0561 14.45 0.122 0.0493 13.72 19.9181 0.9997 1581411 Maybridge4_003603 COc1ccc(NC(=S)N2CCCC(=N2)c3ccccc3)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 D18 compound treatment 0.091 0.0221 5.7 0.102 0.0293 8.15 9.7896 0.9847 3065143 Maybridge4_003604 COc1ccc(CC(=O)Nc2ccc(cc2)N3CCOCC3)cc1OC 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 D19 compound treatment 0.067 -0.00187 -0.48 0.07 -0.00275 -0.77 -0.8814 -0.9748 3178968 Maybridge4_003605 CN(C)C(=S)NCCC1=CCCCC1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 D20 compound treatment 0.069 1.33E-4 0.03 0.072 -7.5E-4 -0.21 -0.1234 -0.5831 3065144 Maybridge4_003606 CN1CCN(CC1)c2ccc(CNS(=O)(=O)c3ccc4OCCc4c3)cc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 D21 compound treatment 0.109 0.0401 10.33 0.11 0.0372 10.37 14.6421 1.0 3178969 Maybridge4_003607 CSc1ccc(cc1)C2C3CCCc4ccccc4C3=NN2CCO 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 D22 compound treatment 0.132 0.0631 16.25 0.151 0.0783 21.79 26.9033 0.9896 1607790 Maybridge4_003608 Fc1ccc(NC(=O)CN2C(=O)c3ccccc3C2=O)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 D23 mock treatment 0.068 -8.67E-4 -0.22 0.073 2.5E-4 0.07 -0.1086 -0.4644 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 D24 positive control 0.077 0.00813 2.09 0.08 0.00725 2.02 2.9084 0.9998 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 E01 compound treatment 0.071 0.00213 0.55 0.077 0.00425 1.18 1.2253 0.9391 1514931 Maybridge4_003609 CC(C)(C)C(=O)Nc1nc(NC(=O)C(C)(C)C)nc(n1)c2ccccc2Cl 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 E02 compound treatment 0.095 0.0261 6.73 0.102 0.0293 8.15 10.5179 0.9955 3178970 Maybridge4_003610 CC1CC(CC(C)(C)C1)NC(=S)Nc2cc(C)ccc2C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 E03 compound treatment 0.07 0.00113 0.29 0.075 0.00225 0.63 0.6494 0.9395 3065145 Maybridge4_003611 Cc1cccc(C)c1NC(=S)N2CCCC2=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 E04 compound treatment 0.075 0.00613 1.58 0.077 0.00425 1.18 1.9536 0.9899 3178971 Maybridge4_003612 Oc1ccccc1/C=N/c2ccccc2C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 E05 compound treatment 0.081 0.0121 3.12 0.088 0.0153 4.25 5.2121 0.9886 3178972 Maybridge4_003613 Oc1nc(S)nc(c1Cc2ccc(Cl)c(Cl)c2)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 E06 compound treatment 0.182 0.113 29.13 0.167 0.0943 26.25 39.1571 0.9987 3065146 Maybridge4_003614 CCOc1ccc(NC(=S)NC(c2ccccc2)c3ccccc3)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 E07 compound treatment 0.072 0.00313 0.81 0.075 0.00225 0.63 1.0135 0.9922 3178973 Maybridge4_003615 Cc1cccc(C)c1NC2=NCCS2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 E08 compound treatment 0.307 0.238 61.31 0.311 0.238 66.35 90.2716 0.9992 3065190 Maybridge4_003616 COc1cc(CN2C3CCCCCN3c4ccccc24)cc(OC)c1OC 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 E09 compound treatment 0.071 0.00213 0.55 0.073 2.5E-4 0.07 0.4376 0.7904 1023038 Maybridge4_003617 CN(C)C(=S)Nc1ccccc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 E10 compound treatment 0.068 -8.67E-4 -0.22 0.072 -7.5E-4 -0.21 -0.3055 -0.9995 3065191 Maybridge4_003618 S=c1[nH]nnn1C2CC3CC2C4C=CCC34 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 E11 compound treatment 0.068 -8.67E-4 -0.22 0.075 0.00225 0.63 0.2853 0.4289 3065192 Maybridge4_003619 C(=N/c1ccccc1)\c2ccccc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 E12 compound treatment 0.126 0.0571 14.71 0.141 0.0683 19.01 23.8417 0.992 3065193 Maybridge4_003620 CC(C)(C)c1ccc(/N=C/c2ccccc2O)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 E13 compound treatment 0.07 0.00113 0.29 0.071 -0.00175 -0.49 -0.1383 -0.2434 1597004 Maybridge4_003621 CN(C)C(=S)Nc1ccc(cc1)S(=O)(=O)N2CCCCC2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 E14 compound treatment 0.188 0.119 30.67 0.192 0.119 33.21 45.1725 0.9992 3065194 Maybridge4_003622 CCCNC(=O)OCN1C(=O)c2ccc(N)cc2C1=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 E15 compound treatment 0.068 -8.67E-4 -0.22 0.071 -0.00175 -0.49 -0.5024 -0.9373 3065195 Maybridge4_003623 Cc1cccc(NC2=NCCCS2)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 E16 compound treatment 0.081 0.0121 3.12 0.085 0.0123 3.41 4.6213 0.999 3178974 Maybridge4_003624 O=C1CSC(N1)c2cccs2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 E17 compound treatment 0.07 0.00113 0.29 0.075 0.00225 0.63 0.6494 0.9395 3065196 Maybridge4_003625 COc1cc(NC(=S)N(C)C)c(OC)cc1Cl 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 E18 compound treatment 0.07 0.00113 0.29 0.073 2.5E-4 0.07 0.2556 0.8519 1132507 Maybridge4_003626 NNC(=S)NCCc1ccc(Cl)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 E19 compound treatment 0.633 0.564 145.25 0.619 0.546 152.13 210.2756 0.9997 3178975 Maybridge4_003627 Oc1ccc2ccccc2c1/C=N/Cc3cccnc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 E20 compound treatment 0.071 0.00213 0.55 0.071 -0.00175 -0.49 0.0438 0.0596 1203485 Maybridge4_003628 CC(CC(=O)O)CC(=O)Nc1ccc(C)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 E21 compound treatment 0.068 -8.67E-4 -0.22 0.072 -7.5E-4 -0.21 -0.3055 -0.9995 3178976 Maybridge4_003629 CSc1cccc(NC(=S)NN(C)C)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 E22 compound treatment 0.068 -8.67E-4 -0.22 0.071 -0.00175 -0.49 -0.5024 -0.9373 1385701 Maybridge4_003630 CC(C)(CC(=O)O)CC(=O)Nc1ccc(Cl)cc1Cl 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 E23 mock treatment 0.068 -8.67E-4 -0.22 0.072 -7.5E-4 -0.21 -0.3055 -0.9995 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 E24 positive control 0.079 0.0101 2.61 0.08 0.00725 2.02 3.2726 0.992 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 F01 compound treatment 0.073 0.00413 1.06 0.077 0.00425 1.18 1.5894 0.9986 1225773 Maybridge4_003631 Cc1cc(C)c(O)c(c1)C2(O)C(=O)c3ccccc3C2=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 F02 compound treatment 0.07 0.00113 0.29 0.076 0.00325 0.91 0.8463 0.89 1310128 Maybridge4_003632 OCCn1nc(O)ccc1=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 F03 compound treatment 0.079 0.0101 2.61 0.088 0.0153 4.25 4.848 0.9726 1400202 Maybridge4_003633 O=c1n(Cc2cccnc2)c(=S)[nH]c3ccccc13 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 F04 compound treatment 0.069 1.33E-4 0.03 0.076 0.00325 0.91 0.6643 0.7334 1055139 Maybridge4_003634 C(CC1CCNCC1)CC2CCNCC2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 F05 compound treatment 0.083 0.0141 3.64 0.088 0.0153 4.25 5.5762 0.997 1205535 Maybridge4_003635 CN1N=C2C(CCc3ccccc23)C1c4ccc(F)cc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 F06 compound treatment 0.075 0.00613 1.58 0.08 0.00725 2.02 2.5443 0.9926 1475761 Maybridge4_003636 OC(=O)C1CCN(CC1)C(=O)OCC2c3ccccc3-c4ccccc24 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 F07 compound treatment 0.076 0.00713 1.84 0.08 0.00725 2.02 2.7264 0.9989 3065197 Maybridge4_003637 COc1ccccc1NC2=NC(CO)(CO)CS2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 F08 compound treatment 0.094 0.0251 6.47 0.096 0.0233 6.47 9.1542 1.0 3178977 Maybridge4_003638 Cc1onc(c1CNS(=O)(=O)c2cccc(Cl)c2)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 F09 compound treatment 0.071 0.00213 0.55 0.075 0.00225 0.63 0.8315 0.9978 1679129 Maybridge4_003639 OCCn1c(=O)[nH]c2ccsc2c1=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 F10 compound treatment 0.072 0.00313 0.81 0.075 0.00225 0.63 1.0135 0.9922 3178978 Maybridge4_003640 O=C(Nc1ccc(cc1)n2cncn2)c3ccccc3N4CCOCC4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 F11 compound treatment 0.069 1.33E-4 0.03 0.075 0.00225 0.63 0.4674 0.7447 1432542 Maybridge4_003641 OC1(NC(=O)Cc2ccccc2Cl)C(=O)c3ccccc3C1=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 F12 compound treatment 0.111 0.0421 10.85 0.116 0.0432 12.04 16.1877 0.9986 3178979 Maybridge4_003642 CSc1c(c(N)nn1C(=O)C2CCC2)c3ccccn3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 F13 compound treatment 0.095 0.0261 6.73 0.097 0.0243 6.75 9.5332 1.0 1512720 Maybridge4_003643 CN1OC(COC(=O)c2cc(Cl)cc(Cl)c2)CC31C4CC5CC(C4)CC3C5 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 F14 compound treatment 0.088 0.0191 4.93 0.095 0.0222 6.2 7.865 0.9935 3065199 Maybridge4_003644 NC(=O)c1ccc(NC(=O)c2cccc3OCCCOc23)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 F15 compound treatment 0.078 0.00913 2.35 0.084 0.0113 3.13 3.8782 0.99 3065200 Maybridge4_003645 Cc1ccc2nc(oc2c1)c3ccc(cc3)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 F16 compound treatment 0.073 0.00413 1.06 0.076 0.00325 0.91 1.3925 0.9968 3178980 Maybridge4_003646 Cc1cc(nn1C)C(=O)NCC2COc3ccccc3O2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 F17 compound treatment 0.118 0.0491 12.65 0.128 0.0553 15.39 19.8252 0.9953 3065201 Maybridge4_003647 Cc1ccc(NC(=S)N2CCCC(=N2)c3ccccc3)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 F18 compound treatment 0.095 0.0261 6.73 0.103 0.0302 8.42 10.7148 0.9938 3178981 Maybridge4_003648 COc1ccc(CC(=O)Nc2ccc(cc2)c3cnco3)cc1OC 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 F19 compound treatment 0.075 0.00613 1.58 0.075 0.00225 0.63 1.5597 0.9181 1597585 Maybridge4_003649 COc1ccc(CNC(=S)NCCO)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 F20 compound treatment 0.069 1.33E-4 0.03 0.073 2.5E-4 0.07 0.0735 0.9469 3065202 Maybridge4_003650 CN1CCN(CC1)c2ccc(CNS(=O)(=O)c3sc(C)nc3C)cc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 F21 compound treatment 0.088 0.0191 4.93 0.094 0.0213 5.92 7.668 0.9958 2107603 Maybridge4_003651 O=C1/C(=C/c2ccccc2)/CCCc3ccccc13 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 F22 compound treatment 0.068 -8.67E-4 -0.22 0.072 -7.5E-4 -0.21 -0.3055 -0.9995 3179070 Maybridge4_003652 O=C1NCCCCC1NS(=O)(=O)c2cccc3ccccc23 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 F23 mock treatment 0.068 -8.67E-4 -0.22 0.072 -7.5E-4 -0.21 -0.3055 -0.9995 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 F24 positive control 0.079 0.0101 2.61 0.08 0.00725 2.02 3.2726 0.992 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 G01 compound treatment 0.079 0.0101 2.61 0.086 0.0133 3.69 4.4541 0.9856 3065203 Maybridge4_003653 CC(C)(C)C(=O)Nc1nc(NC(=O)C(C)(C)C)nc(n1)c2ccccc2C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 G02 compound treatment 0.071 0.00213 0.55 0.074 0.00125 0.35 0.6345 0.9758 3179071 Maybridge4_003654 Fc1cccc(NC(=S)NCc2ccc3OCOc3c2)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 G03 compound treatment 0.07 0.00113 0.29 0.075 0.00225 0.63 0.6494 0.9395 1323302 Maybridge4_003655 CCCc1nc(nc(OC(=O)N(C)C)c1Cc2c(F)cccc2Cl)c3ccccn3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 G04 compound treatment 0.072 0.00313 0.81 0.075 0.00225 0.63 1.0135 0.9922 3065204 Maybridge4_003656 COC(=C(C#N)C#N)c1c(C)onc1c2ccccc2Cl 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 G05 compound treatment 0.087 0.0181 4.67 0.098 0.0253 7.03 8.2737 0.9802 3065205 Maybridge4_003657 CC(C)(C)C(=O)Cn1nnc(n1)c2cccc(c2)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 G06 compound treatment 0.078 0.00913 2.35 0.081 0.00825 2.3 3.2874 0.9999 3179072 Maybridge4_003658 COC(=O)c1cc(NC(=O)/C=C/C(=O)O)ccc1N2CCOCC2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 G07 compound treatment 0.084 0.0151 3.9 0.085 0.0123 3.41 5.1675 0.9978 3065206 Maybridge4_003659 Sc1nnc(Nc2ccccc2)s1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 G08 compound treatment 0.078 0.00913 2.35 0.082 0.00925 2.58 3.4844 0.999 3065300 Maybridge4_003660 CC1(C)NN(C(=O)N1)c2ccccc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 G09 compound treatment 0.133 0.0641 16.51 0.129 0.0563 15.67 22.7531 0.9997 1076488 Maybridge4_003661 CCOc1ccc(cc1)N2CSC(=S)N(C2)c3ccc(OCC)cc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 G10 compound treatment 0.11 0.0411 10.59 0.118 0.0452 12.6 16.3995 0.9963 3065240 Maybridge4_003662 CC(C)N(Cc1ccccc1)C(=S)Nc2ccc(cc2)C(C)C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 G11 compound treatment 0.071 0.00213 0.55 0.075 0.00225 0.63 0.8315 0.9978 3065241 Maybridge4_003663 OCCNC(=S)c1ccccc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 G12 compound treatment 0.098 0.0291 7.5 0.098 0.0253 7.03 10.2763 0.9995 3065242 Maybridge4_003664 CC(C)(C)C(=O)Nc1ccc(cc1)C(C)(C)C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 G13 compound treatment 0.077 0.00813 2.09 0.079 0.00625 1.74 2.7115 0.9958 3065243 Maybridge4_003665 Cc1ccc2[nH]c(=S)n(C3CC4CC3C=C4)c(=O)c2c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 G14 compound treatment 0.106 0.0371 9.56 0.117 0.0442 12.32 15.4744 0.9921 3065244 Maybridge4_003666 CC1(C)CC(=O)C=C(C1)NC(=O)Nc2ccccc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 G15 compound treatment 0.071 0.00213 0.55 0.072 -7.5E-4 -0.21 0.2407 0.4096 3482133 Maybridge4_003667 CC(C)C(NS(=O)(=O)c1ccccc1)C(=O)O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 G16 compound treatment 0.116 0.0471 12.14 0.118 0.0452 12.6 17.4919 0.9998 3065245 Maybridge4_003668 Cc1ccc(cc1Cl)N2C(=O)N(C(=N)C2=S)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 G17 compound treatment 0.078 0.00913 2.35 0.083 0.0103 2.85 3.6813 0.9954 3179073 Maybridge4_003669 Cc1c(C)c(C)c(CSc2cccc(NC(=O)/C=C/C(=O)O)c2)c(C)c1C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 G18 compound treatment 0.092 0.0231 5.96 0.098 0.0253 7.03 9.184 0.9966 3065246 Maybridge4_003670 CC1=CCC2C(C1)C(=O)N(C2=O)c3ccc(cc3)C4CCCCC4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 G19 compound treatment 0.075 0.00613 1.58 0.077 0.00425 1.18 1.9536 0.9899 3179074 Maybridge4_003671 CN(CC(=O)O)C(=S)c1ccccc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 G20 compound treatment 0.206 0.137 35.31 0.21 0.137 38.22 51.9942 0.9992 3179075 Maybridge4_003672 CSc1ccc(/C=N/n2c(=O)oc3ccccc3c2=O)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 G21 compound treatment 0.069 1.33E-4 0.03 0.072 -7.5E-4 -0.21 -0.1234 -0.5831 3065247 Maybridge4_003673 CN(C)NC(=S)Nc1ccc(C)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 G22 compound treatment 0.067 -0.00187 -0.48 0.071 -0.00175 -0.49 -0.6845 -1.0 1356260 Maybridge4_003674 N#Cc1ccc(cc1)C(N2CCSCC2)N3CCSCC3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 G23 mock treatment 0.068 -8.67E-4 -0.22 0.073 2.5E-4 0.07 -0.1086 -0.4644 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 G24 positive control 0.08 0.0111 2.87 0.081 0.00825 2.3 3.6515 0.994 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 H01 compound treatment 0.108 0.0391 10.08 0.12 0.0473 13.16 16.4293 0.9913 3065248 Maybridge4_003675 Clc1cccc(Cl)c1CSCc2cc3ccccc3o2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 H02 compound treatment 0.07 0.00113 0.29 0.077 0.00425 1.18 1.0433 0.8558 1495324 Maybridge4_003676 CSCC(O)Cn1nc(O)ccc1=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 H03 compound treatment 0.075 0.00613 1.58 0.079 0.00625 1.74 2.3474 0.9988 3065250 Maybridge4_003677 CN(C)/C=C/1\C(=O)N(C)N=C1c2ccccc2O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 H04 compound treatment 0.069 1.33E-4 0.03 0.073 2.5E-4 0.07 0.0735 0.9469 3179076 Maybridge4_003678 NC(=N)c1ccc(cc1)C(=O)N 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 H05 compound treatment 0.108 0.0391 10.08 0.118 0.0452 12.6 16.0354 0.9939 3065251 Maybridge4_003679 NC1=C(C#N)C(C#N)(C#N)C2CCCC(=C21)N3CCOCC3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 H06 compound treatment 0.071 0.00213 0.55 0.074 0.00125 0.35 0.6345 0.9758 3179077 Maybridge4_003680 CC(C)(C)OC(=O)N1CCCC[C@@H]1C(=O)O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 H07 compound treatment 0.113 0.0441 11.36 0.12 0.0473 13.16 17.3396 0.9973 3179078 Maybridge4_003681 FC(F)(F)c1ccc(cc1)C(=O)NCc2csc3ccc(Cl)cc23 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 H08 compound treatment 0.072 0.00313 0.81 0.075 0.00225 0.63 1.0135 0.9922 3065253 Maybridge4_003682 Cc1onc(c1CNC(=O)Nc2ccccc2)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 H09 compound treatment 0.072 0.00313 0.81 0.076 0.00325 0.91 1.2105 0.9984 3179079 Maybridge4_003683 Fc1cccc(Cl)c1/C=N/Cc2ccc(Cl)cc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 H10 compound treatment 0.068 -8.67E-4 -0.22 0.072 -7.5E-4 -0.21 -0.3055 -0.9995 3065255 Maybridge4_003684 OC(=O)CC1(CC(=O)NCc2ccccn2)CCCCC1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 H11 compound treatment 0.076 0.00713 1.84 0.082 0.00925 2.58 3.1202 0.9862 1354093 Maybridge4_003685 CC(=O)Nc1ccccc1OCCN(Cc2ccccc2)C(=O)c3ccc(Cl)cc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 H12 compound treatment 0.117 0.0481 12.39 0.107 0.0343 9.54 15.5078 0.9916 3179080 Maybridge4_003686 CC1(C)Cc2cccc(C(=O)N3CCC(CC3)c4c[nH]c5ccccc45)c2O1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 H13 compound treatment 0.109 0.0401 10.33 0.107 0.0343 9.54 14.0513 0.9992 1211536 Maybridge4_003687 COc1ccc(cc1)C(=O)CC(C(=O)c2ccccc2)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 H14 compound treatment 0.103 0.0341 8.79 0.104 0.0313 8.7 12.3682 1.0 3179081 Maybridge4_003688 FC(F)(SCc1c(Cl)cccc1Cl)C(=O)c2cnc3ccccn23 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 H15 compound treatment 0.096 0.0271 6.99 0.096 0.0233 6.47 9.5184 0.9993 3065256 Maybridge4_003689 O=C1/C(=C/C2CCCCC2)/CCCc3ccccc13 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 H16 compound treatment 0.069 1.33E-4 0.03 0.078 0.00525 1.46 1.0581 0.7235 3179082 Maybridge4_003690 Cc1cc(nn1C)C(=O)NCc2cc(F)cc3COCOc23 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 H17 compound treatment 0.106 0.0371 9.56 0.104 0.0313 8.7 12.9143 0.9989 3179083 Maybridge4_003691 CC1OCN(Cn2c1nc3ccc(Cl)cc23)c4ccc(OC(F)(F)F)cc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 H18 compound treatment 0.073 0.00413 1.06 0.075 0.00225 0.63 1.1956 0.9681 3065257 Maybridge4_003692 COc1ccc(CC(=O)N2CCN(CC2)c3ncccn3)cc1OC 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 H19 compound treatment 0.074 0.00513 1.32 0.077 0.00425 1.18 1.7715 0.9985 3065258 Maybridge4_003693 COc1ccc(CNC(=S)NN)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 H20 compound treatment 0.075 0.00613 1.58 0.076 0.00325 0.91 1.7566 0.9651 3179084 Maybridge4_003694 CN1CCN(CC1)c2ccc(CNS(=O)(=O)c3cccc4nonc34)cc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 H21 compound treatment 0.087 0.0181 4.67 0.091 0.0182 5.08 6.8952 0.9991 1247395 Maybridge4_003695 CN1N=C2C(CCCc3ccccc23)C1c4ccc5OCOc5c4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 H22 compound treatment 0.068 -8.67E-4 -0.22 0.071 -0.00175 -0.49 -0.5024 -0.9373 3065259 Maybridge4_003696 Cc1cc(c(C)s1)S(=O)(=O)NC2CCCCNC2=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 H23 mock treatment 0.067 -0.00187 -0.48 0.074 0.00125 0.35 -0.0937 -0.1579 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 H24 positive control 0.08 0.0111 2.87 0.08 0.00725 2.02 3.4546 0.9853 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 I01 compound treatment 0.073 0.00413 1.06 0.081 0.00825 2.3 2.3771 0.9388 1362748 Maybridge4_003697 CCc1cccc(C)c1NC(=S)NCCC(=O)O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 I02 compound treatment 0.089 0.0201 5.18 0.093 0.0203 5.64 7.6532 0.9991 3065301 Maybridge4_003698 Clc1ccc(NC(=S)NC2CCCC2)cc1Cl 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 I03 compound treatment 0.069 1.33E-4 0.03 0.076 0.00325 0.91 0.6643 0.7334 1186254 Maybridge4_003699 CCN(CC)C(=O)Oc1nc(nc(COC)c1CC2CC2)c3ccccn3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 I04 compound treatment 0.067 -0.00187 -0.48 0.071 -0.00175 -0.49 -0.6845 -1.0 3065303 Maybridge4_003700 C1CN=C(Nc2ccccc2c3ccccc3)S1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 I05 compound treatment 0.143 0.0741 19.09 0.142 0.0693 19.29 27.1337 1.0 1358941 Maybridge4_003701 Clc1ccc(cc1)c2csc(NC(=S)NC(=O)C3CC3)n2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 I06 compound treatment 0.072 0.00313 0.81 0.075 0.00225 0.63 1.0135 0.9922 3065304 Maybridge4_003702 CCOC(=O)c1ccc(Cl)c(NC(=S)N(C)C)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 I07 compound treatment 0.157 0.0881 22.69 0.153 0.0803 22.35 31.8487 1.0 1536146 Maybridge4_003703 S=C(NCc1ccccc1)NC(Cc2ccccc2)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 I08 compound treatment 0.089 0.0201 5.18 0.09 0.0173 4.8 7.0624 0.9993 3065305 Maybridge4_003704 FC(F)(F)c1cc(NC(=S)NC2CCCCC2)cc(c1)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 I09 compound treatment 0.115 0.0461 11.88 0.108 0.0352 9.82 15.3406 0.9955 3179085 Maybridge4_003705 S=C1SCN(Cc2ccccc2)CN1Cc3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 I10 compound treatment 0.128 0.0591 15.23 0.131 0.0583 16.22 22.2366 0.9995 3179086 Maybridge4_003706 CCCN(CCC)S(=O)(=O)c1ccc(cc1)C(=O)NC(=S)Nc2ccc(F)cc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 I11 compound treatment 0.119 0.0501 12.91 0.116 0.0432 12.04 17.6442 0.9994 3065306 Maybridge4_003707 COc1ccc(CCNC(=S)NC(=O)c2ccc(Cl)cc2Cl)cc1OC 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 I12 compound treatment 0.088 0.0191 4.93 0.091 0.0182 5.08 7.0773 0.9999 3179087 Maybridge4_003708 COc1ccc(/C=N/c2ccc(cc2)C(C)(C)C)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 I13 compound treatment 0.073 0.00413 1.06 0.075 0.00225 0.63 1.1956 0.9681 3065307 Maybridge4_003709 Clc1cccc(Cl)c1/N=C\2/NCCS2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 I14 compound treatment 0.067 -0.00187 -0.48 0.074 0.00125 0.35 -0.0937 -0.1579 1044972 Maybridge4_003710 NNC(=O)Cc1cccc2ccccc12 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 I15 compound treatment 0.13 0.0611 15.74 0.132 0.0592 16.5 22.7977 0.9997 3065308 Maybridge4_003711 Cc1ccc2[nH]c(nc2c1)c3cccc4ccccc34 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 I16 compound treatment 0.069 1.33E-4 0.03 0.075 0.00225 0.63 0.4674 0.7447 3179088 Maybridge4_003712 OC(=O)CC(CC(=O)Nc1cc(cc(c1)C(F)(F)F)C(F)(F)F)c2ccc(Cl)cc2Cl 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 I17 compound treatment 0.075 0.00613 1.58 0.079 0.00625 1.74 2.3474 0.9988 3179089 Maybridge4_003713 CC(C)c1ccc2c(CCC3C(C)(CNC(=O)/C=C/C(=O)O)CCCC32C)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 I18 compound treatment 0.163 0.0941 24.24 0.167 0.0943 26.25 35.698 0.9992 1216891 Maybridge4_003714 Ic1ccc(NC(=O)Cc2cccc3ccccc23)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 I19 compound treatment 0.071 0.00213 0.55 0.075 0.00225 0.63 0.8315 0.9978 3065310 Maybridge4_003715 Fc1ccc(NC2=NCCN2)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 I20 compound treatment 0.068 -8.67E-4 -0.22 0.071 -0.00175 -0.49 -0.5024 -0.9373 3179090 Maybridge4_003716 CC1CC(=O)N(C1=O)c2cc(cc(c2)C(F)(F)F)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 I21 compound treatment 0.085 0.0161 4.15 0.087 0.0143 3.97 5.7434 0.9997 3065312 Maybridge4_003717 COc1ccc(/N=C/c2ccc(cc2)N(C)CCC#N)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 I22 compound treatment 0.067 -0.00187 -0.48 0.072 -7.5E-4 -0.21 -0.4875 -0.9304 1341869 Maybridge4_003718 C1CN(CCO1)C(N2CCOCC2)c3ccncc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 I23 mock treatment 0.067 -0.00187 -0.48 0.07 -0.00275 -0.77 -0.8814 -0.9748 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 I24 positive control 0.079 0.0101 2.61 0.08 0.00725 2.02 3.2726 0.992 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 J01 compound treatment 0.075 0.00613 1.58 0.081 0.00825 2.3 2.7413 0.9833 1699626 Maybridge4_003719 CC(C)(C)c1ccc(NC(=O)N2CCOCC2)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 J02 compound treatment 0.14 0.0711 18.31 0.148 0.0752 20.96 27.769 0.9977 1369792 Maybridge4_003720 Fc1ccc(cc1)C2=NN(CCC2)C(=S)NCc3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 J03 compound treatment 0.177 0.108 27.84 0.18 0.107 29.87 40.8068 0.9994 3065313 Maybridge4_003721 Cc1onc(c1c2nc3ccc(I)cc3c(=O)o2)c4ccccc4Cl 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 J04 compound treatment 0.139 0.0701 18.06 0.14 0.0673 18.73 26.0116 0.9998 1076697 Maybridge4_003722 CC1=NN(C(=O)C1)c2cccc(Cl)c2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 J05 compound treatment 0.098 0.0291 7.5 0.1 0.0273 7.59 10.6702 1.0 3179091 Maybridge4_003723 Cn1c(=O)sn(c2ccccc2)c1=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 J06 compound treatment 0.099 0.0301 7.76 0.103 0.0302 8.42 11.443 0.9992 3179172 Maybridge4_003724 Clc1ccc(NC(=O)c2ccc3ncsc3c2)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 J07 compound treatment 0.186 0.117 30.16 0.196 0.123 34.32 45.5961 0.9979 3065315 Maybridge4_003725 Cc1ccc(cc1)C(=O)CC(C(=O)c2ccc(cc2)C(F)(F)F)c3cccs3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 J08 compound treatment 0.077 0.00813 2.09 0.081 0.00825 2.3 3.1054 0.9989 3179173 Maybridge4_003726 Cc1onc(c1CNC(=O)NC2CCN(CC2)C(=O)OCc3ccccc3)c4ccccc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 J09 compound treatment 0.107 0.0381 9.82 0.106 0.0333 9.26 13.4903 0.9996 1543567 Maybridge4_003727 CN1N=C2C(CCc3ccccc23)C1c4ccc(C#N)cc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 J10 compound treatment 0.071 0.00213 0.55 0.075 0.00225 0.63 0.8315 0.9978 3065317 Maybridge4_003728 Cc1noc(c1NC(=O)Nc2ccccc2)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 J11 compound treatment 0.132 0.0631 16.25 0.155 0.0823 22.91 27.691 0.9859 3179174 Maybridge4_003729 CCOC(=O)C1C(CC(=CC1=O)c2ccc3ccccc3c2)c4ccc(cc4)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 J12 compound treatment 0.134 0.0651 16.77 0.137 0.0643 17.89 24.5105 0.9995 3065318 Maybridge4_003730 CC1(C)Cc2cccc(C(=O)Nc3ccc(cc3)C(F)(F)F)c2O1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 J13 compound treatment 0.073 0.00413 1.06 0.078 0.00525 1.46 1.7864 0.9878 1351189 Maybridge4_003731 CC1=C(C(=O)OC(C)(C)C)C2(C(=O)Nc3ccccc32)C(=C(N)O1)C#N 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 J14 compound treatment 0.068 -8.67E-4 -0.22 0.074 0.00125 0.35 0.0884 0.2137 3065319 Maybridge4_003732 CC1(C)CCc2cc(ccc2O1)S(=O)(=O)N(Cc3ccccn3)Cc4ccccn4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 J15 compound treatment 0.068 -8.67E-4 -0.22 0.072 -7.5E-4 -0.21 -0.3055 -0.9995 3179175 Maybridge4_003733 COc1ccc(C/N=C/c2ccc(cc2)C(F)(F)F)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 J16 compound treatment 0.068 -8.67E-4 -0.22 0.076 0.00325 0.91 0.4822 0.5173 3065320 Maybridge4_003734 Cc1cc(nn1C)C(=O)NCc2cccn2C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 J17 compound treatment 0.185 0.116 29.9 0.19 0.117 32.65 44.2325 0.999 3179176 Maybridge4_003735 FC(F)(F)c1ccc(/C=C(\C#N)/c2csc3ccccc23)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 J18 compound treatment 0.073 0.00413 1.06 0.076 0.00325 0.91 1.3925 0.9968 3065361 Maybridge4_003736 COc1ccc(CC(=O)NCc2cc(C)oc2C(F)(F)F)cc1OC 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 J19 compound treatment 0.099 0.0301 7.76 0.103 0.0302 8.42 11.443 0.9992 3065362 Maybridge4_003737 CCOc1cccc(/C=N/c2nnc(SC)s2)c1O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 J20 compound treatment 0.076 0.00713 1.84 0.081 0.00825 2.3 2.9233 0.9938 3065363 Maybridge4_003738 COC(=O)c1cc(oc1C)S(=O)(=O)N2CCSC2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 J21 compound treatment 0.068 -8.67E-4 -0.22 0.074 0.00125 0.35 0.0884 0.2137 3065364 Maybridge4_003739 Cn1c2NCN(CC3CC3)Cc2c(=O)n(C)c1=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 J22 compound treatment 0.068 -8.67E-4 -0.22 0.072 -7.5E-4 -0.21 -0.3055 -0.9995 3065366 Maybridge4_003740 O=C(NC1CCCCNC1=O)c2csc3ccccc23 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 J23 mock treatment 0.072 0.00313 0.81 0.071 -0.00175 -0.49 0.2258 0.2396 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 J24 positive control 0.077 0.00813 2.09 0.081 0.00825 2.3 3.1054 0.9989 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 K01 compound treatment 0.137 0.0681 17.54 0.142 0.0693 19.29 26.0413 0.9989 1480507 Maybridge4_003741 Clc1ccc(Oc2ccccc2NS(=O)(=O)c3ccc(NC(=O)C4CC4)cc3)c(Cl)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 K02 compound treatment 0.103 0.0341 8.79 0.116 0.0432 12.04 14.7313 0.988 3065367 Maybridge4_003742 CN(C)c1ccc(/C=N/N)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 K03 compound treatment 0.07 0.00113 0.29 0.074 0.00125 0.35 0.4525 0.9961 1560480 Maybridge4_003743 Cc1c(Cc2ccc(F)cc2)c(=O)oc3cc(O)ccc13 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 K04 compound treatment 0.073 0.00413 1.06 0.079 0.00625 1.74 1.9833 0.9721 3179177 Maybridge4_003744 CC(C)(C)NC(=O)Nc1ccc(Cl)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 K05 compound treatment 0.159 0.0901 23.21 0.164 0.0912 25.41 34.3789 0.999 1436913 Maybridge4_003745 COc1ccccc1NC(=S)NC(c2ccccc2)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 K06 compound treatment 0.1 0.0311 8.02 0.101 0.0283 7.87 11.2312 1.0 1517059 Maybridge4_003746 CCOc1ccc(cc1)N2C(=O)c3ccccc3C2=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 K07 compound treatment 0.132 0.0631 16.25 0.147 0.0742 20.68 26.1156 0.9929 3179178 Maybridge4_003747 C1CCCCCC(CCCCC1)/N=C/c2ccco2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 K08 compound treatment 0.077 0.00813 2.09 0.078 0.00525 1.46 2.5146 0.9846 1293740 Maybridge4_003748 Cc1cc(C)cc(NC(=S)NC2CCCCC2)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 K09 compound treatment 0.28 0.211 54.36 0.256 0.183 51.03 74.5251 0.9995 1032487 Maybridge4_003749 CCN1CSC(=S)N(CC)C1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 K10 compound treatment 0.068 -8.67E-4 -0.22 0.073 2.5E-4 0.07 -0.1086 -0.4644 1046043 Maybridge4_003750 NC(=N)SCCN1C(=O)c2ccccc2C1=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 K11 compound treatment 0.066 -0.00287 -0.74 0.07 -0.00275 -0.77 -1.0634 -0.9998 1157754 Maybridge4_003751 COc1ccc(CCNC(=S)N(C)C)cc1OC 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 K12 compound treatment 0.078 0.00913 2.35 0.082 0.00925 2.58 3.4844 0.999 3179179 Maybridge4_003752 Cc1nc2ccccc2c(=O)n1/N=C/c3ccc(Cl)c(Cl)c3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 K13 compound treatment 0.071 0.00213 0.55 0.077 0.00425 1.18 1.2253 0.9391 1244335 Maybridge4_003753 S=C(NCc1cccnc1)c2ccccc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 K14 compound treatment 0.068 -8.67E-4 -0.22 0.074 0.00125 0.35 0.0884 0.2137 3179180 Maybridge4_003754 O=C(NCCCN1CCOCC1)NCc2cccc3ccccc23 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 K15 compound treatment 0.085 0.0161 4.15 0.086 0.0133 3.69 5.5465 0.9983 3065370 Maybridge4_003755 COc1cc(NC(=S)N)c(OC)cc1Cl 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 K16 compound treatment 0.074 0.00513 1.32 0.08 0.00725 2.02 2.3623 0.9789 3179181 Maybridge4_003756 FC(F)(F)c1cccc(NC(=O)N2CCOC32CCCCC3)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 K17 compound treatment 0.114 0.0451 11.62 0.13 0.0573 15.94 19.4909 0.9879 3065371 Maybridge4_003757 Cc1c(C)c(C)c(CNC(=S)NN)c(C)c1C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 K18 compound treatment 0.07 0.00113 0.29 0.074 0.00125 0.35 0.4525 0.9961 3179182 Maybridge4_003758 O=c1oc(nc2ccccc12)C3CC3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 K19 compound treatment 0.083 0.0141 3.64 0.087 0.0143 3.97 5.3793 0.9991 3179183 Maybridge4_003759 CC/C(=N\Cc1ccc(C#N)cc1)/c2ccccc2O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 K20 compound treatment 0.069 1.33E-4 0.03 0.07 -0.00275 -0.77 -0.5173 -0.6747 1593893 Maybridge4_003760 NC(=O)C1C(C2CC1C=C2)C(=O)O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 K21 compound treatment 0.067 -0.00187 -0.48 0.071 -0.00175 -0.49 -0.6845 -1.0 3179184 Maybridge4_003761 Fc1cccc(NC2=NCCS2)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 K22 compound treatment 0.12 0.0511 13.17 0.128 0.0553 15.39 20.1894 0.997 3065373 Maybridge4_003762 Clc1ccc(cc1)C(=O)OCCc2csc3ccccc23 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 K23 mock treatment 0.069 1.33E-4 0.03 0.07 -0.00275 -0.77 -0.5173 -0.6747 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 K24 positive control 0.077 0.00813 2.09 0.082 0.00925 2.58 3.3023 0.9947 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 L01 compound treatment 0.071 0.00213 0.55 0.081 0.00825 2.3 2.013 0.8521 3179185 Maybridge4_003763 CN(C)/C=C/1\SC(=O)N(C1=O)c2ccccc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 L02 compound treatment 0.143 0.0741 19.09 0.16 0.0872 24.3 30.6783 0.9929 1281043 Maybridge4_003764 CC(C)c1ccc(NC(=S)N2CCCC(=N2)c3ccc(F)cc3)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 L03 compound treatment 0.218 0.149 38.4 0.229 0.156 43.51 57.9205 0.9981 3065374 Maybridge4_003765 O=C/1N(C(=N\C1=C\c2ccccc2)c3ccccc3)c4ccccc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 L04 compound treatment 0.446 0.377 97.1 0.425 0.352 98.1 138.0272 1.0 3065375 Maybridge4_003766 OC(=O)c1cccnc1S 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 L05 compound treatment 0.136 0.0671 17.28 0.133 0.0602 16.78 24.0869 0.9999 3179186 Maybridge4_003767 FC(F)(F)c1ccc(C=C2C(=O)c3ccccc3C2=O)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 L06 compound treatment 0.1 0.0311 8.02 0.106 0.0333 9.26 12.2158 0.9974 1719441 Maybridge4_003768 Cc1ccc(NC(=O)c2ccc3ncsc3c2)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 L07 compound treatment 0.133 0.0641 16.51 0.127 0.0543 15.11 22.3592 0.999 3179187 Maybridge4_003769 FC(F)(F)Oc1ccc(NC(=O)OCCc2csc3ccccc23)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 L08 compound treatment 0.204 0.135 34.79 0.203 0.13 36.27 50.2517 0.9998 3179188 Maybridge4_003770 C1COc2cc(ccc2O1)c3nc(cs3)c4ccccc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 L09 compound treatment 0.074 0.00513 1.32 0.072 -7.5E-4 -0.21 0.7869 0.5881 3065376 Maybridge4_003771 Clc1ccc(cc1)c2nnc(c3ccccc3)c(=O)o2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 L10 compound treatment 0.12 0.0511 13.17 0.127 0.0543 15.11 19.9924 0.9976 3179189 Maybridge4_003772 Cc1noc(c1NC(=O)N2CCN(CC2)C(c3ccccc3)c4ccccc4)c5ccccc5 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 L11 compound treatment 0.149 0.0801 20.63 0.158 0.0853 23.74 31.3768 0.9976 3065377 Maybridge4_003773 CN1N=C(CC1c2ccc(F)cc2)c3ccc4ccccc4c3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 L12 compound treatment 0.115 0.0461 11.88 0.116 0.0432 12.04 16.916 1.0 3179190 Maybridge4_003774 CC1(C)Cc2cccc(C(=O)Nc3cccc4CCCCc34)c2O1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 L13 compound treatment 0.081 0.0121 3.12 0.083 0.0103 2.85 4.2275 0.999 3065378 Maybridge4_003775 Cc1ccc2n(CNc3ccc(OC(F)(F)F)cc3)nnc2c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 L14 compound treatment 0.072 0.00313 0.81 0.079 0.00625 1.74 1.8012 0.9389 3179191 Maybridge4_003776 O=S(=O)(N(Cc1ccccn1)Cc2ccccn2)c3ccc(s3)c4ccon4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 L15 compound treatment 0.151 0.0821 21.15 0.147 0.0742 20.68 29.5748 0.9999 3065424 Maybridge4_003777 CCOC(=O)C1(CCC#N)C(CC(=CC1=O)c2ccc(OC)cc2)c3ccc4ccccc4c3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 L16 compound treatment 0.072 0.00313 0.81 0.077 0.00425 1.18 1.4074 0.9825 3065425 Maybridge4_003778 Clc1ccc(cc1)C(=O)NCc2ccc(s2)S(=O)(=O)NCCN3CCCC3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 L17 compound treatment 0.871 0.802 206.53 0.842 0.769 214.23 297.5198 0.9998 3065426 Maybridge4_003779 CN(C)/C=C/C(=S)c1cccs1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 L18 compound treatment 0.074 0.00513 1.32 0.078 0.00525 1.46 1.9684 0.9987 3065427 Maybridge4_003780 CN1CCN(CC1)c2ccc(CNC(=O)c3cccnc3Oc4ccc(Cl)cc4)cc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 L19 compound treatment 0.214 0.145 37.37 0.209 0.136 37.94 53.2538 1.0 3065428 Maybridge4_003781 CSc1nnc(/N=C/c2c(O)ccc3ccccc23)s1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 L20 compound treatment 0.081 0.0121 3.12 0.085 0.0123 3.41 4.6213 0.999 3065429 Maybridge4_003782 OC(CSc1nc(c2ccccc2)n(n1)c3ccccc3)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 L21 compound treatment 0.07 0.00113 0.29 0.073 2.5E-4 0.07 0.2556 0.8519 3065430 Maybridge4_003783 Cc1ccc(Cl)cc1NC(=S)N(N)CCO 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 L22 compound treatment 0.068 -8.67E-4 -0.22 0.072 -7.5E-4 -0.21 -0.3055 -0.9995 3179192 Maybridge4_003784 FC(F)(F)c1c(cnn1c2ccccc2)C(=O)NC3CCCCNC3=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 L23 mock treatment 0.068 -8.67E-4 -0.22 0.072 -7.5E-4 -0.21 -0.3055 -0.9995 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 L24 positive control 0.075 0.00613 1.58 0.08 0.00725 2.02 2.5443 0.9926 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 M01 compound treatment 0.076 0.00713 1.84 0.083 0.0103 2.85 3.3172 0.9773 3065431 Maybridge4_003785 Clc1cccc(c1)n2c(SCC3CC3)nnc2C4CC4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 M02 compound treatment 0.124 0.0551 14.2 0.136 0.0633 17.61 22.493 0.9943 3179193 Maybridge4_003786 CN(C)C(=S)NC(Cc1ccccc1)c2ccccc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 M03 compound treatment 0.071 0.00213 0.55 0.076 0.00325 0.91 1.0284 0.9713 3179194 Maybridge4_003787 CCCc1nc(SCC(=O)c2ccccc2Cl)nc(O)c1C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 M04 compound treatment 0.082 0.0131 3.38 0.087 0.0143 3.97 5.1972 0.9968 3065433 Maybridge4_003788 CCc1ccc(NC(=O)NC(C)(C)C)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 M05 compound treatment 0.099 0.0301 7.76 0.098 0.0253 7.03 10.4584 0.9988 1572084 Maybridge4_003789 Cc1ccc(NC(=S)Nc2ccccc2C)c(C)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 M06 compound treatment 0.07 0.00113 0.29 0.074 0.00125 0.35 0.4525 0.9961 1569198 Maybridge4_003790 O=C1N(Cc2ccncc2)C(=O)c3ccccc13 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 M07 compound treatment 0.075 0.00613 1.58 0.081 0.00825 2.3 2.7413 0.9833 3179195 Maybridge4_003791 C(/N=C/c1ccco1)C2CCC(C/N=C/c3ccco3)CC2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 M08 compound treatment 0.081 0.0121 3.12 0.082 0.00925 2.58 4.0305 0.9954 1300916 Maybridge4_003792 CCOc1ccc(NC(=S)NC(C)(C)CC)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 M09 compound treatment 1.19 1.12 288.66 1.141 1.07 297.5 414.477 0.9999 1039987 Maybridge4_003793 CC(C)N1CSC(=S)N(C1)C(C)C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 M10 compound treatment 0.152 0.0831 21.4 0.159 0.0862 24.02 32.1199 0.9983 1339416 Maybridge4_003794 Cc1cc(ccc1Br)n2c(=O)c3ccccc3[nH]c2=S 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 M11 compound treatment 0.131 0.0621 16.0 0.131 0.0583 16.22 22.7828 1.0 3179196 Maybridge4_003795 COc1ccc(CCN2C(=O)/C(=C/c3ccccc3Cl)/SC2=S)cc1OC 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 M12 compound treatment 0.069 1.33E-4 0.03 0.075 0.00225 0.63 0.4674 0.7447 3065435 Maybridge4_003796 CC(C)(C)c1ccc(cc1)C2=NC(C)(C)CO2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 M13 compound treatment 0.073 0.00413 1.06 0.086 0.0133 3.69 3.3618 0.8754 3179281 Maybridge4_003797 S=C(NCCc1ccccc1)c2ccccc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 M14 compound treatment 0.09 0.0211 5.44 0.095 0.0222 6.2 8.2291 0.9979 3179282 Maybridge4_003798 Cc1onc(c1C(=O)OC2=CC(=O)CC(C)(C)C2)c3c(Cl)cccc3Cl 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 M15 compound treatment 0.104 0.0351 9.05 0.108 0.0352 9.82 13.3379 0.9992 3065437 Maybridge4_003799 CC(C)c1ccc(NC(=S)NCc2ccc(C#N)cc2)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 M16 compound treatment 0.099 0.0301 7.76 0.103 0.0302 8.42 11.443 0.9992 3179283 Maybridge4_003800 COc1ccc(cc1)C(=O)N/C(=N/c2c(C)cccc2C)/SC 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 M17 compound treatment 0.073 0.00413 1.06 0.077 0.00425 1.18 1.5894 0.9986 3065438 Maybridge4_003801 CSc1cccc(NC(=O)N)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 M18 compound treatment 0.259 0.19 48.95 0.236 0.163 45.46 66.7634 0.9993 3065439 Maybridge4_003802 N/C(=C(\N=C\c1ccc(C#N)cc1)/C#N)/C#N 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 M19 compound treatment 0.178 0.109 28.1 0.184 0.111 30.98 41.7766 0.9988 3179284 Maybridge4_003803 O=C1CSC(=S)N1/N=C/c2cccnc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 M20 compound treatment 0.069 1.33E-4 0.03 0.074 0.00125 0.35 0.2704 0.7731 3179285 Maybridge4_003804 CCC(C)(CC(=O)O)CC(=O)Nc1cc(cc(c1)C(F)(F)F)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 M21 compound treatment 0.074 0.00513 1.32 0.077 0.00425 1.18 1.7715 0.9985 3065440 Maybridge4_003805 Cc1ccc(cc1)C2=NN3C(C2)c4ccccc4C3=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 M22 compound treatment 0.068 -8.67E-4 -0.22 0.073 2.5E-4 0.07 -0.1086 -0.4644 1441619 Maybridge4_003806 COc1ccc(CCN2C(SC(C)C2=O)c3cccnc3)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 M23 mock treatment 0.071 0.00213 0.55 0.073 2.5E-4 0.07 0.4376 0.7904 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 M24 positive control 0.077 0.00813 2.09 0.082 0.00925 2.58 3.3023 0.9947 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 N01 compound treatment 0.072 0.00313 0.81 0.084 0.0113 3.13 2.7859 0.8611 3065441 Maybridge4_003807 S=C(N1CCSCC1)c2ccccc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 N02 compound treatment 0.105 0.0361 9.3 0.106 0.0333 9.26 13.1261 1.0 1195820 Maybridge4_003808 CC(C)c1ccc(cc1)C2C3CCc4ccccc4C3=NN2CCO 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 N03 compound treatment 0.081 0.0121 3.12 0.089 0.0163 4.53 5.409 0.9836 3065442 Maybridge4_003809 FC(F)(F)c1cc(NC(C#N)c2ccccc2)cc(c1)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 N04 compound treatment 0.07 0.00113 0.29 0.074 0.00125 0.35 0.4525 0.9961 1398220 Maybridge4_003810 OC(=O)C(C(=O)OCc1ccccc1)c2ccccc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 N05 compound treatment 0.074 0.00513 1.32 0.079 0.00625 1.74 2.1653 0.9908 3065443 Maybridge4_003811 CC1CC(=O)N(C1=O)c2ccc(OC(F)(F)F)cc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 N06 compound treatment 0.109 0.0401 10.33 0.116 0.0432 12.04 15.8236 0.9971 1541655 Maybridge4_003812 COc1ccc(NC(=O)c2ccc3ncsc3c2)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 N07 compound treatment 0.075 0.00613 1.58 0.079 0.00625 1.74 2.3474 0.9988 3065444 Maybridge4_003813 Oc1ccccc1/C=N/c2ccc(OC(F)(F)F)cc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 N08 compound treatment 0.129 0.0601 15.48 0.145 0.0722 20.12 25.1756 0.9916 3179286 Maybridge4_003814 CCOC(=O)c1ccc(cc1)n2c(=S)[nH]c3ccccc23 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 N09 compound treatment 0.07 0.00113 0.29 0.072 -7.5E-4 -0.21 0.0586 0.1634 3065445 Maybridge4_003815 CC(C)c1ccc2[n+](C)cccc2c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 N10 compound treatment 0.069 1.33E-4 0.03 0.073 2.5E-4 0.07 0.0735 0.9469 3064681 Maybridge4_003816 Cc1noc(c1NC(=O)N2CCOCC2)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 N11 compound treatment 0.127 0.0581 14.97 0.144 0.0712 19.84 24.6146 0.9903 1587431 Maybridge4_003817 COc1ccc(cc1)C2CC(=NN2C)c3ccc4ccccc4c3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 N12 compound treatment 0.091 0.0221 5.7 0.109 0.0362 10.1 11.1681 0.9634 3064636 Maybridge4_003818 Fc1cc(C(=O)NCc2nc3ccccc3s2)c4OCOCc4c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 N13 compound treatment 0.066 -0.00287 -0.74 0.076 0.00325 0.91 0.1181 0.1011 3064637 Maybridge4_003819 OC(=O)/C=C/C(=O)Nc1ccccc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 N14 compound treatment 0.072 0.00313 0.81 0.08 0.00725 2.02 1.9982 0.919 3064638 Maybridge4_003820 O=C(N(Cc1ccccn1)Cc2ccccn2)c3ccc4nsnc4c3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 N15 compound treatment 0.096 0.0271 6.99 0.109 0.0362 10.1 12.0784 0.9838 1376553 Maybridge4_003821 CN1N=C2C(CCCc3ccccc23)C1c4cccs4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 N16 compound treatment 0.107 0.0381 9.82 0.114 0.0413 11.49 15.0657 0.9969 3064639 Maybridge4_003822 Cc1cc(CNC(=O)c2cnc3ccccc3n2)c(o1)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 N17 compound treatment 0.069 1.33E-4 0.03 0.073 2.5E-4 0.07 0.0735 0.9469 3064640 Maybridge4_003823 COc1ccccc1CNC(=S)N(C)C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 N18 compound treatment 0.074 0.00513 1.32 0.082 0.00925 2.58 2.7561 0.9519 3179287 Maybridge4_003824 CN1CCN(CC1)c2ccc(CNC(=O)c3cnn(c3C)c4ccc(Cl)cc4)cc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 N19 compound treatment 0.141 0.0721 18.57 0.146 0.0732 20.4 27.5572 0.9989 1418353 Maybridge4_003825 CC1=NN(C(=O)C1=C2SCCCS2)c3ccc(C)cc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 N20 compound treatment 0.158 0.0891 22.95 0.166 0.0933 25.97 34.5907 0.9981 3064641 Maybridge4_003826 OC(CSc1nccc(n1)c2ccc3OCCOc3c2)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 N21 compound treatment 0.107 0.0381 9.82 0.103 0.0302 8.42 12.8995 0.9971 3179288 Maybridge4_003827 COc1ccc(/N=C\2/SCC(=NN2CCO)c3ccc(C)cc3)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 N22 compound treatment 0.067 -0.00187 -0.48 0.072 -7.5E-4 -0.21 -0.4875 -0.9304 3179289 Maybridge4_003828 CC(C)(Oc1ccc(Cl)cc1)C(=O)NC2CCCCNC2=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 N23 mock treatment 0.068 -8.67E-4 -0.22 0.072 -7.5E-4 -0.21 -0.3055 -0.9995 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 N24 positive control 0.076 0.00713 1.84 0.08 0.00725 2.02 2.7264 0.9989 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 O01 compound treatment 0.087 0.0181 4.67 0.103 0.0302 8.42 9.2583 0.9612 3064642 Maybridge4_003829 Fc1ccc(NC2=NCCCC(=O)S2)cc1Cl 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 O02 compound treatment 0.341 0.272 70.07 0.331 0.258 71.92 100.4001 0.9999 3179290 Maybridge4_003830 Cc1cc(/N=C/c2cc(Cl)cc(Cl)c2O)no1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 O03 compound treatment 0.07 0.00113 0.29 0.075 0.00225 0.63 0.6494 0.9395 1155572 Maybridge4_003831 CC(C)(C)C(=O)COC(=O)Cn1nnc(n1)N2CCCC2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 O04 compound treatment 0.084 0.0151 3.9 0.089 0.0163 4.53 5.9552 0.9972 3179291 Maybridge4_003832 CC(C)(C)NC(=O)Nc1cc(cc(c1)C(F)(F)F)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 O05 compound treatment 0.114 0.0451 11.62 0.118 0.0452 12.6 17.1278 0.9992 1006391 Maybridge4_003833 Cc1ccc(NC(=S)Nc2ccc(C)cc2)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 O06 compound treatment 0.189 0.12 30.93 0.198 0.125 34.88 46.5362 0.9982 3179292 Maybridge4_003834 COc1cccc(/C=N\c2ccccc2N3C(=O)c4ccccc4C3=O)c1O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 O07 compound treatment 0.104 0.0351 9.05 0.113 0.0403 11.21 14.3226 0.9943 1631575 Maybridge4_003835 CCOc1ccc(NC(=S)NC(Cc2ccccc2)c3ccccc3)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 O08 compound treatment 0.154 0.0851 21.92 0.144 0.0712 19.84 29.5302 0.9988 3179293 Maybridge4_003836 CCOC(=O)c1ccc(NC(=S)NC(C)c2ccc3OCCOc3c2)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 O09 compound treatment 0.075 0.00613 1.58 0.08 0.00725 2.02 2.5443 0.9926 1028763 Maybridge4_003837 OC(=O)CSC(=S)c1ccccc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 O10 compound treatment 0.072 0.00313 0.81 0.074 0.00125 0.35 0.8166 0.9294 3179294 Maybridge4_003838 N/C(=N\O)/c1c(cc([nH]c1=O)c2ccc(F)cc2)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 O11 compound treatment 0.227 0.158 40.71 0.216 0.143 39.89 56.999 0.9999 1080231 Maybridge4_003839 COc1ccc(cc1)C(CC(=O)c2ccccc2)Sc3ccccc3N 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 O12 compound treatment 0.089 0.0201 5.18 0.096 0.0233 6.47 8.244 0.9939 1192868 Maybridge4_003840 CC(C)c1ccc(cc1)N2C(=O)SC(C2=O)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 O13 compound treatment 0.067 -0.00187 -0.48 0.076 0.00325 0.91 0.3002 0.2929 3179295 Maybridge4_003841 CN(C)C(=O)Nc1ccccc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 O14 compound treatment 0.115 0.0461 11.88 0.132 0.0592 16.5 20.0668 0.987 3179296 Maybridge4_003842 CC(C)(C)c1ccc(cc1)C(=O)OC2=CC(=O)CC(C)(C)C2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 O15 compound treatment 0.09 0.0211 5.44 0.096 0.0233 6.47 8.426 0.9963 3064643 Maybridge4_003843 C/C(=N\Cc1ccc(Cl)c(Cl)c1)/c2ccccc2O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 O16 compound treatment 0.069 1.33E-4 0.03 0.076 0.00325 0.91 0.6643 0.7334 3179297 Maybridge4_003844 CC(C)(C)NC(=S)N1CCSCC1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 O17 compound treatment 0.16 0.0911 23.46 0.163 0.0902 25.13 34.3641 0.9994 3064645 Maybridge4_003845 CSc1cccc(NC(=S)Nc2cccc(SC)c2)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 O18 compound treatment 0.072 0.00313 0.81 0.078 0.00525 1.46 1.6043 0.9607 3179298 Maybridge4_003846 CN(C)/C=C/1\N=C(NC1=O)SCc2c(Cl)cccc2Cl 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 O19 compound treatment 0.309 0.24 61.83 0.296 0.223 62.17 87.6818 1.0 3179299 Maybridge4_003847 CCO/C=C/1\SC(=S)N(/N=C/c2cccc(Cl)c2)C1=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 O20 compound treatment 0.215 0.146 37.62 0.203 0.13 36.27 52.2543 0.9998 3064646 Maybridge4_003848 Cc1ccc(cc1)C(=O)CC(Sc2ccccc2N)c3ccsc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 O21 compound treatment 0.073 0.00413 1.06 0.076 0.00325 0.91 1.3925 0.9968 3179300 Maybridge4_003849 Clc1ccc(Cl)c(c1)C2=NN3C(C2)c4ccccc4C3=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 O22 compound treatment 0.115 0.0461 11.88 0.123 0.0503 13.99 18.2944 0.9967 3064648 Maybridge4_003850 Cc1oc2ccccc2c1CCOC(=O)c3ccc(Cl)cc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 O23 mock treatment 0.069 1.33E-4 0.03 0.07 -0.00275 -0.77 -0.5173 -0.6747 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 O24 positive control 0.076 0.00713 1.84 0.08 0.00725 2.02 2.7264 0.9989 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 P01 compound treatment 0.144 0.0751 19.34 0.146 0.0732 20.4 28.1034 0.9996 3179301 Maybridge4_003851 CC/1=NN(C(=O)\C1=N\O)c2cccc(Cl)c2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 P02 compound treatment 0.124 0.0551 14.2 0.131 0.0583 16.22 21.5084 0.9978 1673238 Maybridge4_003852 Fc1ccc2C3Sc4ccccc4C(=O)C3=C(c2c1)c5ccccc5 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 P03 compound treatment 0.073 0.00413 1.06 0.088 0.0153 4.25 3.7556 0.8578 3179302 Maybridge4_003853 Cn1nc(sc1=S)c2ccccn2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 P04 compound treatment 0.086 0.0171 4.41 0.092 0.0193 5.36 6.9101 0.9953 3179303 Maybridge4_003854 Sc1nc(c(o1)c2ccccc2)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 P05 compound treatment 0.079 0.0101 2.61 0.082 0.00925 2.58 3.6664 1.0 3064649 Maybridge4_003855 CC1=CC(=O)N(C1=O)c2ccc(OC(F)(F)F)cc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 P06 compound treatment 0.077 0.00813 2.09 0.086 0.0133 3.69 4.09 0.964 3179304 Maybridge4_003856 FC(F)(F)C1=NCCN(C=C1)C(=O)Nc2ccc3OCCOc3c2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 P07 compound treatment 0.283 0.214 55.13 0.298 0.225 62.73 83.3422 0.9979 3064650 Maybridge4_003857 FC(F)(F)Oc1ccc(Nc2n[nH]c(=S)s2)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 P08 compound treatment 0.147 0.0781 20.12 0.162 0.0892 24.86 31.8004 0.9945 3179305 Maybridge4_003858 Clc1ccc(NC(=S)N/2CCN\C2=N/c3ccc(Cl)cc3)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 P09 compound treatment 0.126 0.0571 14.71 0.13 0.0573 15.94 21.6756 0.9992 1422913 Maybridge4_003859 COc1ccc2cc(ccc2c1)C(C)C(=O)Nc3cc(Cl)cc(Cl)c3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 P10 compound treatment 0.072 0.00313 0.81 0.073 2.5E-4 0.07 0.6197 0.7653 3064682 Maybridge4_003860 OC(=O)CC1(CC(=O)Nc2cc3ccccc3cn2)CCCCC1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 P11 compound treatment 0.133 0.0641 16.51 0.139 0.0663 18.45 24.7223 0.9985 1218065 Maybridge4_003861 Cc1ccc(cc1)n2c(SCC(=O)C(C)(C)C)nc3ccccc3c2=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 P12 compound treatment 0.108 0.0391 10.08 0.12 0.0473 13.16 16.4293 0.9913 3064683 Maybridge4_003862 Fc1cc(C(=O)NCc2csc(n2)c3cccs3)c4OCOCc4c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 P13 compound treatment 0.07 0.00113 0.29 0.078 0.00525 1.46 1.2402 0.8318 3064684 Maybridge4_003863 Fc1ccc(CNC2=NCCS2)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 P14 compound treatment 0.071 0.00213 0.55 0.077 0.00425 1.18 1.2253 0.9391 3064685 Maybridge4_003864 O=C(N(Cc1ccccn1)Cc2ccccn2)c3ncoc3c4ccccc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 P15 compound treatment 0.08 0.0111 2.87 0.083 0.0103 2.85 4.0454 1.0 3064686 Maybridge4_003865 CC(C)(C)c1ccc(cc1)c2nc(O)nn2c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 P16 compound treatment 0.085 0.0161 4.15 0.097 0.0243 6.75 7.7126 0.9728 3179306 Maybridge4_003866 Fc1cc(CNC(=O)c2cnc3ccccc3n2)c4OCOCc4c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 P17 compound treatment 0.074 0.00513 1.32 0.077 0.00425 1.18 1.7715 0.9985 3064687 Maybridge4_003867 COc1ccccc1Cn2nn[nH]c2=S 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 P18 compound treatment 0.079 0.0101 2.61 0.086 0.0133 3.69 4.4541 0.9856 3179307 Maybridge4_003868 CN1CCN(CC1)c2ccc(CNC(=O)c3ccc4nsnc4c3)cc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 P19 compound treatment 0.092 0.0231 5.96 0.099 0.0262 7.31 9.3809 0.9948 1399162 Maybridge4_003869 OCCN1N=C2C(CCc3ccccc23)C1c4ccccc4Cl 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 P20 compound treatment 0.093 0.0241 6.21 0.091 0.0182 5.08 7.9876 0.995 3179308 Maybridge4_003870 Cc1csc2c(SCC(O)C(F)(F)F)ncnc12 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 P21 compound treatment 0.07 0.00113 0.29 0.075 0.00225 0.63 0.6494 0.9395 3064689 Maybridge4_003871 NN(CCO)C(=S)NCc1ccc(Cl)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 P22 compound treatment 0.073 0.00413 1.06 0.076 0.00325 0.91 1.3925 0.9968 3179398 Maybridge4_003872 O=C(Cc1cccc2ccccc12)NC3CCCCNC3=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 P23 mock treatment 0.07 0.00113 0.29 0.074 0.00125 0.35 0.4525 0.9961 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2059 P24 positive control 0.079 0.0101 2.61 0.082 0.00925 2.58 3.6664 1.0 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 A01 compound treatment 0.084 0.017 4.38 0.082 0.0137 3.81 5.7904 0.9976 3179399 Maybridge4_003873 Cn1nc(cc1C(=O)NC2CCCCNC2=O)C(C)(C)C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 A02 compound treatment 0.187 0.12 30.9 0.207 0.139 38.62 49.1581 0.9939 1395167 Maybridge4_003874 CCCC1N(CCc2sccc12)C(=S)Nc3ccc(Cl)cc3Cl 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 A03 compound treatment 0.084 0.017 4.38 0.083 0.0147 4.09 5.9873 0.9994 3179400 Maybridge4_003875 COc1cc2CCN(Cc2cc1OC)S(=O)(=O)c3ccc4OCCCOc4c3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 A04 compound treatment 0.08 0.013 3.35 0.079 0.0107 2.98 4.4714 0.9983 1342707 Maybridge4_003876 CC(C)(C)C1=NN(C(=O)C1)c2nc3ccc(Cl)cc3s2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 A05 compound treatment 0.079 0.012 3.09 0.081 0.0127 3.53 4.6832 0.9978 3179401 Maybridge4_003877 O=C(NCc1csc(n1)c2cccs2)c3ccno3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 A06 compound treatment 0.077 0.01 2.57 0.077 0.00869 2.42 3.5314 0.9995 1644100 Maybridge4_003878 COc1ccc(OC(=O)c2cnc3SCCn3c2=O)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 A07 compound treatment 0.075 0.008 2.06 0.074 0.00569 1.58 2.5765 0.9916 3179402 Maybridge4_003879 O=C(NC1CCCCNC1=O)c2ccc(nc2)N3CCOCC3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 A08 compound treatment 0.079 0.012 3.09 0.077 0.00869 2.42 3.8955 0.9927 3179403 Maybridge4_003880 CC(C)(C)S(=O)(=O)/C(=C/c1sccc1C2OCCO2)/C#N 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 A09 compound treatment 0.111 0.044 11.33 0.109 0.0407 11.33 16.023 1.0 3064691 Maybridge4_003881 O=S(=O)(NCc1ccc(cc1)c2cccs2)c3cccs3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 A10 compound treatment 0.095 0.028 7.21 0.096 0.0277 7.71 10.55 0.9994 3179404 Maybridge4_003882 Clc1ccc(cc1)C(=O)n2cc3CSc4ccc(Cl)cc4-c3n2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 A11 compound treatment 0.101 0.034 8.75 0.11 0.0417 11.61 14.3993 0.9903 3064692 Maybridge4_003883 Cc1nn(nc1CNC(=O)CC(C)(C)C)c2ccccc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 A12 compound treatment 0.076 0.009 2.32 0.076 0.00769 2.14 3.1524 0.9992 3179405 Maybridge4_003884 CCOC(=O)Cn1c2CCCC(=O)c2c(cc1=O)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 A13 compound treatment 0.073 0.006 1.54 0.074 0.00569 1.58 2.2124 0.9999 3064694 Maybridge4_003885 Cc1noc(C)c1NC(=O)NC2CCCCNC2=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 A14 compound treatment 0.083 0.016 4.12 0.083 0.0147 4.09 5.8053 1.0 3179406 Maybridge4_003886 CN(C)/C(=N/C(=S)c1ccc(Cl)cc1)/C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 A15 compound treatment 0.072 0.005 1.29 0.076 0.00769 2.14 2.4242 0.9704 3064695 Maybridge4_003887 Cc1cc(SCc2ncon2)c(Cl)cc1Cl 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 A16 compound treatment 0.067 0.0 0.0 0.073 0.00469 1.31 0.9231 0.7071 3179407 Maybridge4_003888 COC(=O)c1c(C)nc(C)c(C(=O)OC)c1c2csc(c2)S(=O)(=O)/N=C/N(C)C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 A17 compound treatment 0.07 0.003 0.77 0.072 0.00369 1.03 1.2723 0.9901 3064696 Maybridge4_003889 CSc1nc(/N=C/N(C)C)n(n1)c2ccccc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 A18 compound treatment 0.129 0.062 15.96 0.133 0.0647 18.02 24.0262 0.9982 3179408 Maybridge4_003890 Cc1c2C(=O)/C(=C/c3ccccc3)/Cn2c4ccccc14 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 A19 compound treatment 0.164 0.097 24.97 0.162 0.0937 26.09 36.1091 0.9998 3179409 Maybridge4_003891 FC(F)(F)c1ccccc1NC(=S)Nc2ccc(cc2)c3csnn3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 A20 compound treatment 0.096 0.029 7.47 0.097 0.0287 7.99 10.929 0.9994 3064697 Maybridge4_003892 FC(F)(F)C1N(CCc2c1[nH]c3ccccc23)C(=O)Nc4ccccc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 A21 compound treatment 0.07 0.003 0.77 0.077 0.00869 2.42 2.257 0.8887 1223239 Maybridge4_003893 Clc1ccc(cc1)C2N(CCc3sccc23)C(=O)c4ccc(Cl)cc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 A22 compound treatment 0.073 0.006 1.54 0.074 0.00569 1.58 2.2124 0.9999 1594618 Maybridge4_003894 Cc1oc2c(F)c(F)c(F)c(F)c2c1c3noc(n3)C(C)(C)C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 A23 mock treatment 0.074 0.007 1.8 0.074 0.00569 1.58 2.3944 0.9979 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 A24 positive control 0.076 0.009 2.32 0.078 0.00969 2.7 3.5462 0.9971 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 B01 compound treatment 0.265 0.198 50.98 0.271 0.203 56.45 75.9618 0.9987 3179410 Maybridge4_003895 O=C(/C=C/c1ccc(s1)c2cccs2)N3CCSCC3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 B02 compound treatment 0.113 0.046 11.84 0.112 0.0437 12.17 16.9779 0.9999 3064698 Maybridge4_003896 FC(F)(F)c1oc(cc1C(=O)NCc2ccco2)c3ccc(Cl)cc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 B03 compound treatment 0.142 0.075 19.31 0.158 0.0897 24.98 31.3161 0.9919 1349711 Maybridge4_003897 CSc1c([nH]c2ccccc12)c3ccc(Cl)cc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 B04 compound treatment 0.099 0.032 8.24 0.098 0.0297 8.27 11.6721 1.0 3179411 Maybridge4_003898 Cc1nc(sc1c2ccnn2C(=O)C(C)(C)C)c3ccc(s3)c4cccs4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 B05 compound treatment 0.125 0.058 14.93 0.125 0.0567 15.79 21.7226 0.9996 3064699 Maybridge4_003899 CCOC(=O)c1c(CS(=O)c2ccc(Cl)cc2)oc3c(F)c(F)c(F)c(F)c13 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 B06 compound treatment 0.112 0.045 11.59 0.119 0.0507 14.12 18.1743 0.9952 3179412 Maybridge4_003900 C/C(=N\O)/C(=O)c1ccc(cc1)c2ccccc2F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 B07 compound treatment 0.073 0.006 1.54 0.072 0.00369 1.03 1.8185 0.9803 3179413 Maybridge4_003901 CC1(C)COC(=N1)c2sccc2C(=O)N(C3CCCCC3)C(=O)NC4CCCCC4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 B08 compound treatment 0.074 0.007 1.8 0.075 0.00669 1.86 2.5913 0.9999 3064701 Maybridge4_003902 Nc1ccccc1SCc2cccc(Cl)c2F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 B09 compound treatment 0.168 0.101 26.0 0.165 0.0967 26.93 37.4281 0.9998 1459519 Maybridge4_003903 NC(=S)c1cnc(nc1N)c2ccncc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 B10 compound treatment 0.075 0.008 2.06 0.079 0.0107 2.98 3.5611 0.9838 1481845 Maybridge4_003904 CCCNC(=S)N1CCC(CC1)C(=O)c2ccc(C)cc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 B11 compound treatment 0.237 0.17 43.77 0.232 0.164 45.59 63.1841 0.9998 3064731 Maybridge4_003905 NC(=S)c1ncc(cc1N2CCCC2)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 B12 compound treatment 0.085 0.018 4.63 0.093 0.0247 6.88 8.1386 0.9816 3064732 Maybridge4_003906 Cc1noc(C)c1c2nc(no2)c3cccc(c3)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 B13 compound treatment 0.072 0.005 1.29 0.071 0.00269 0.75 1.4395 0.9667 3064733 Maybridge4_003907 COc1cc(NC(=O)C(C)(C)C)ccc1Br 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 B14 compound treatment 0.088 0.021 5.41 0.098 0.0297 8.27 9.6694 0.9788 3064734 Maybridge4_003908 FC(F)(F)c1ccc(nc1)N2CCN(CC2)c3ccc(NC(=O)c4ccco4)cn3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 B15 compound treatment 0.066 -0.001 -0.26 0.07 0.00169 0.47 0.1503 0.2804 3064735 Maybridge4_003909 CN(N1C(=O)c2ccccc2C1=O)c3cc(ccn3)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 B16 compound treatment 0.065 -0.002 -0.51 0.073 0.00469 1.31 0.559 0.3983 1391890 Maybridge4_003910 CC(C)(C)c1cc(n(n1)c2ccc(NC(=O)COCC(=O)O)cc2)C(C)(C)C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 B17 compound treatment 0.068 0.001 0.26 0.075 0.00669 1.86 1.499 0.7973 3179414 Maybridge4_003911 Cc1cc(C)n(n1)c2ccc(cc2)n3cccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 B18 compound treatment 0.105 0.038 9.78 0.119 0.0507 14.12 16.8999 0.984 1368065 Maybridge4_003912 CC(C)Cc1ccc(cc1)C(C)c2nc(no2)c3ccc(C)cc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 B19 compound treatment 0.153 0.086 22.14 0.166 0.0977 27.21 34.8941 0.9948 1510531 Maybridge4_003913 COc1cc(cc(OC)c1OC)C(=O)NCC(c2c[nH]c3ccccc23)c4ccccc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 B20 compound treatment 0.079 0.012 3.09 0.084 0.0157 4.37 5.274 0.9856 1512133 Maybridge4_003914 COc1ccc(cc1)C2N(CCc3sccc23)C(=O)NC(C)(C)C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 B21 compound treatment 0.068 0.001 0.26 0.076 0.00769 2.14 1.6959 0.7865 3064736 Maybridge4_003915 Cc1snnc1C(=O)Oc2ccccc2c3nnco3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 B22 compound treatment 0.109 0.042 10.81 0.079 0.0107 2.98 9.7511 0.8694 3179415 Maybridge4_003916 CC(C)(C)c1cc(n(n1)c2ccc(/N=C\c3ccccc3O)cc2)C(C)(C)C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 B23 mock treatment 0.069 0.002 0.51 0.07 0.00169 0.47 0.6964 0.999 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 B24 positive control 0.076 0.009 2.32 0.078 0.00969 2.7 3.5462 0.9971 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 C01 compound treatment 0.079 0.012 3.09 0.079 0.0107 2.98 4.2893 0.9998 3064737 Maybridge4_003917 Clc1ccc(Oc2ncccc2C(=O)NC3CCCCNC3=O)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 C02 compound treatment 0.153 0.086 22.14 0.151 0.0827 23.03 31.9403 0.9998 1245123 Maybridge4_003918 O=C(NCc1ccco1)NC(=O)c2ccc(cc2)c3csnn3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 C03 compound treatment 0.072 0.005 1.29 0.07 0.00169 0.47 1.2426 0.9067 3064739 Maybridge4_003919 COc1cc2CCN(Cc2cc1OC)S(=O)(=O)c3c(C)nn(C)c3C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 C04 compound treatment 0.143 0.076 19.57 0.143 0.0747 20.8 28.5443 0.9995 3179416 Maybridge4_003920 CC(C)(C)c1csc(Cc2ccc(cc2)c3csnn3)n1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 C05 compound treatment 0.099 0.032 8.24 0.109 0.0407 11.33 13.8383 0.9877 3179417 Maybridge4_003921 Cc1oc(cc1C(=O)NCc2csc(n2)c3cccs3)C(C)(C)C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 C06 compound treatment 0.068 0.001 0.26 0.071 0.00269 0.75 0.7113 0.8987 1605864 Maybridge4_003922 OC(=O)CCCc1nc(no1)c2cnc3SCCn3c2=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 C07 compound treatment 0.073 0.006 1.54 0.074 0.00569 1.58 2.2124 0.9999 3179418 Maybridge4_003923 O=C(NCC1CN(Cc2ccccc2)CCO1)c3ccc(nc3)N4CCOCC4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 C08 compound treatment 0.155 0.088 22.66 0.164 0.0957 26.65 34.8644 0.9967 3064740 Maybridge4_003924 COC(=O)c1cc2CSc3ccc(Cl)cc3-c2s1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 C09 compound treatment 0.116 0.049 12.62 0.117 0.0487 13.56 18.5087 0.9994 3179419 Maybridge4_003925 O=C(NCc1ccc(cc1)c2cccs2)C3=Cc4ccccc4OC3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 C10 compound treatment 0.184 0.117 30.12 0.179 0.111 30.83 43.098 0.9999 3064741 Maybridge4_003926 CC(C)(C)C(=O)n1cc2CSc3ccc(Cl)cc3-c2n1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 C11 compound treatment 0.066 -0.001 -0.26 0.07 0.00169 0.47 0.1503 0.2804 3179420 Maybridge4_003927 COCC(=O)NCc1nn(nc1C)c2ccccc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 C12 compound treatment 0.141 0.074 19.05 0.151 0.0827 23.03 29.7556 0.9956 3064742 Maybridge4_003928 COC(=O)c1sccc1c2ccc(o2)c3ccn(n3)C(=O)c4ccc(Cl)cc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 C13 compound treatment 0.083 0.016 4.12 0.086 0.0177 4.93 6.396 0.9961 3179421 Maybridge4_003929 Cc1cc(CNC(=O)Nc2c(C)noc2C)c(o1)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 C14 compound treatment 0.16 0.093 23.94 0.155 0.0867 24.14 34.0024 1.0 3064743 Maybridge4_003930 Clc1ccc(NC(=O)/C(=C\c2cccs2)/c3ccsc3)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 C15 compound treatment 0.064 -0.003 -0.77 0.07 0.00169 0.47 -0.2139 -0.2365 3179422 Maybridge4_003931 CN(C)C(=O)Oc1cccc(N)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 C16 compound treatment 0.065 -0.002 -0.51 0.072 0.00369 1.03 0.362 0.3151 3179423 Maybridge4_003932 FC(F)(F)Oc1ccccc1/C=N/c2ccc(Cl)cc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 C17 compound treatment 0.067 0.0 0.0 0.074 0.00569 1.58 1.12 0.7071 1299325 Maybridge4_003933 CC(C)N(C(C)C)C(=O)NC(=O)c1csnn1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 C18 compound treatment 0.064 -0.003 -0.77 0.071 0.00269 0.75 -0.0169 -0.0158 3179518 Maybridge4_003934 FC(F)(F)C1NCCc2c1[nH]c3ccccc23 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 C19 compound treatment 0.069 0.002 0.51 0.069 6.88E-4 0.19 0.4995 0.9092 1154654 Maybridge4_003935 Cc1noc(C)c1c2nc(CSc3ccccc3)no2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 C20 compound treatment 0.12 0.053 13.65 0.123 0.0547 15.23 20.4184 0.9985 3179519 Maybridge4_003936 O=C(NCc1ccc(s1)c2cccs2)NC(=O)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 C21 compound treatment 0.131 0.064 16.48 0.12 0.0517 14.39 21.8303 0.9977 1179307 Maybridge4_003937 CC(C)NC(=O)N1CCc2sccc2C1c3ccc(Cl)cc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 C22 compound treatment 0.077 0.01 2.57 0.077 0.00869 2.42 3.5314 0.9995 3064744 Maybridge4_003938 CC(C)(C)c1nc(no1)c2ccc(s2)c3ccon3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 C23 mock treatment 0.067 0.0 0.0 0.068 -3.12E-4 -0.09 -0.0615 -0.7071 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 C24 positive control 0.076 0.009 2.32 0.076 0.00769 2.14 3.1524 0.9992 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 D01 compound treatment 0.313 0.246 63.34 0.329 0.261 72.6 96.1223 0.9977 3179520 Maybridge4_003939 CC(C)(C)c1ccc(NC(=O)/C=C/c2ccc(s2)c3cccs3)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 D02 compound treatment 0.152 0.085 21.88 0.152 0.0837 23.31 31.9551 0.9995 3064745 Maybridge4_003940 COc1cccc(/C=N/c2c(c(nn2C)C(F)(F)F)c3ccccc3)c1OC 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 D03 compound treatment 0.073 0.006 1.54 0.072 0.00369 1.03 1.8185 0.9803 1138512 Maybridge4_003941 COc1ccc(cc1)S(=O)(=O)CC(C)(O)CS(=O)(=O)c2ccc(OC)cc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 D04 compound treatment 0.072 0.005 1.29 0.071 0.00269 0.75 1.4395 0.9667 3064746 Maybridge4_003942 FC(F)(F)c1ccc(/C=N/c2cc(Cl)cc(Cl)c2)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 D05 compound treatment 0.145 0.078 20.08 0.17 0.102 28.32 34.2254 0.9858 3179521 Maybridge4_003943 Cc1noc(C)c1c2nc(COc3ccc(/C=C(/C#N)\S(=O)(=O)C)cc3)no2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 D06 compound treatment 0.095 0.028 7.21 0.103 0.0347 9.66 11.9285 0.9896 3064747 Maybridge4_003944 CCc1sc(nc1C(=O)OC)c2ccc(Cl)cc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 D07 compound treatment 0.157 0.09 23.17 0.154 0.0857 23.86 33.2593 0.9999 3064748 Maybridge4_003945 Cc1ccsc1C(=S)N 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 D08 compound treatment 0.098 0.031 7.98 0.1 0.0317 8.82 11.8839 0.9987 3179522 Maybridge4_003946 FC(F)(F)c1cc(Oc2ccc(cc2)n3cccc3)cc(c1)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 D09 compound treatment 0.114 0.047 12.1 0.125 0.0567 15.79 19.7199 0.9914 3064749 Maybridge4_003947 CSc1ccc(s1)C(=O)NC(=O)Nc2cc(C)on2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 D10 compound treatment 0.068 0.001 0.26 0.069 6.88E-4 0.19 0.3174 0.9894 3179523 Maybridge4_003948 CS/C(=N\C#N)/N1CCC(CC1)C(=O)c2ccccc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 D11 compound treatment 0.073 0.006 1.54 0.071 0.00269 0.75 1.6216 0.9447 1573241 Maybridge4_003949 Cc1noc(C)c1C(=O)Oc2ccc(cc2)c3nn[nH]c3C#N 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 D12 compound treatment 0.076 0.009 2.32 0.077 0.00869 2.42 3.3493 0.9998 3064792 Maybridge4_003950 CC(C)(C)NC(=O)N1CCN(CC1)c2ncccc2C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 D13 compound treatment 0.159 0.092 23.69 0.157 0.0887 24.7 34.2142 0.9998 3064793 Maybridge4_003951 CCOC(=O)c1cc(CSc2ccc(Cl)cc2)c3OCOCc3c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 D14 compound treatment 0.072 0.005 1.29 0.073 0.00469 1.31 1.8334 1.0 3064794 Maybridge4_003952 COc1ccccc1N2CCN(CC2)C(=S)c3ccccc3OC(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 D15 compound treatment 0.066 -0.001 -0.26 0.068 -3.12E-4 -0.09 -0.2436 -0.8963 3064795 Maybridge4_003953 CN(N1C(=O)CSCC1=O)c2cc(ccn2)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 D16 compound treatment 0.067 0.0 0.0 0.074 0.00569 1.58 1.12 0.7071 3064796 Maybridge4_003954 N/C(=N\O)/c1ccc(nc1)N2CCN(CC2)c3ncccc3C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 D17 compound treatment 0.075 0.008 2.06 0.084 0.0157 4.37 4.5457 0.9411 3064797 Maybridge4_003955 Cc1nn(c(C)c1C(=O)Oc2ccccc2)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 D18 compound treatment 0.07 0.003 0.77 0.076 0.00769 2.14 2.06 0.9051 3064798 Maybridge4_003956 FC(F)(F)c1cc(cc(c1)C(F)(F)F)C(=O)Oc2cccc3cccnc23 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 D19 compound treatment 0.139 0.072 18.54 0.152 0.0837 23.31 29.5884 0.9936 3064800 Maybridge4_003957 FC(F)(F)c1ccc(cc1)C(=O)NCC(c2c[nH]c3ccccc23)c4ccccc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 D20 compound treatment 0.154 0.087 22.4 0.168 0.0997 27.76 35.4701 0.9943 3179524 Maybridge4_003958 FC(F)(F)c1cccnc1N2CCN(CC2)c3ccc(NC(=O)Nc4ccc(Cl)cc4)cn3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 D21 compound treatment 0.07 0.003 0.77 0.071 0.00269 0.75 1.0754 0.9999 3064801 Maybridge4_003959 CN(C)/C=C(\C#N)/c1nnc(c2ccccn2)n1C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 D22 compound treatment 0.067 0.0 0.0 0.068 -3.12E-4 -0.09 -0.0615 -0.7071 3179525 Maybridge4_003960 Fc1ccc(CS(=O)(=O)CCNC(=O)c2c(F)cccc2Cl)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 D23 mock treatment 0.068 0.001 0.26 0.069 6.88E-4 0.19 0.3174 0.9894 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 D24 positive control 0.076 0.009 2.32 0.076 0.00769 2.14 3.1524 0.9992 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 E01 compound treatment 0.079 0.012 3.09 0.076 0.00769 2.14 3.6986 0.9839 3179526 Maybridge4_003961 O=C(NC1CCCCNC1=O)c2cn(c3ccccc23)S(=O)(=O)c4ccccc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 E02 compound treatment 0.072 0.005 1.29 0.071 0.00269 0.75 1.4395 0.9667 3064802 Maybridge4_003962 FC(F)(F)c1ccc(cc1)C2=NCCc3sccc23 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 E03 compound treatment 0.109 0.042 10.81 0.105 0.0367 10.22 14.8711 0.9996 3179527 Maybridge4_003963 COc1cc2CCN(Cc2cc1OC)S(=O)(=O)c3ccc4OC(C)(C)CCc4c3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 E04 compound treatment 0.115 0.048 12.36 0.118 0.0497 13.84 18.5235 0.9984 3064804 Maybridge4_003964 O=C(Nc1ccccc1)Nc2cccc(c2)c3nnco3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 E05 compound treatment 0.069 0.002 0.51 0.071 0.00269 0.75 0.8934 0.9833 3064805 Maybridge4_003965 CC(C)(C)OC(=O)N1CCC(CNC(=O)c2ccno2)CC1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 E06 compound treatment 0.107 0.04 10.3 0.123 0.0547 15.23 18.0517 0.9818 1736114 Maybridge4_003966 COc1ccc(cc1)C2N(CCc3sccc23)C(=S)NCC=C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 E07 compound treatment 0.068 0.001 0.26 0.071 0.00269 0.75 0.7113 0.8987 3179528 Maybridge4_003967 Cc1nn(C)c(C)c1CNC(=O)c2ccc(nc2)N3CCOCC3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 E08 compound treatment 0.071 0.004 1.03 0.071 0.00269 0.75 1.2575 0.9877 3064806 Maybridge4_003968 O=C(NC(=O)c1nnc(o1)c2ccccc2)N3CCOCC3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 E09 compound treatment 0.125 0.058 14.93 0.138 0.0697 19.41 24.2826 0.9916 3179529 Maybridge4_003969 COc1ccc(cc1)n2ncc(C(=O)NCc3ccc(cc3)c4cccs4)c2C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 E10 compound treatment 0.076 0.009 2.32 0.082 0.0137 3.81 4.3339 0.9715 3064807 Maybridge4_003970 CC(C)c1ncc2CSc3ccc(Cl)cc3-c2n1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 E11 compound treatment 0.175 0.108 27.81 0.132 0.0637 17.74 32.204 0.9764 3179530 Maybridge4_003971 COc1ccc(cc1)c2ocnc2C(=O)NCc3nn(nc3C)c4ccccc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 E12 compound treatment 0.121 0.054 13.9 0.126 0.0577 16.07 21.1913 0.9974 3064809 Maybridge4_003972 COC(=O)c1sccc1c2ccc(o2)c3ccn(n3)S(=O)(=O)c4ccc(Cl)cc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 E13 compound treatment 0.11 0.043 11.07 0.128 0.0597 16.62 19.5825 0.9805 3179531 Maybridge4_003973 Cc1c(C)c(C)c2[nH]c(nc2c1C)c3ccc4OCOc4c3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 E14 compound treatment 0.147 0.08 20.6 0.149 0.0807 22.47 30.4541 0.9991 3179532 Maybridge4_003974 FC(F)(F)c1cccc(NC(=O)/C(=C\c2cccs2)/c3ccsc3)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 E15 compound treatment 0.067 0.0 0.0 0.069 6.88E-4 0.19 0.1354 0.7071 3064810 Maybridge4_003975 FC(F)(F)c1ccccc1N/C(=N/C#N)/N2CCCC2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 E16 compound treatment 0.076 0.009 2.32 0.08 0.0117 3.25 3.9401 0.9861 3179533 Maybridge4_003976 FC(F)(F)c1cccc(NC(=O)CS(=O)(=O)Nc2cccc(c2)C(F)(F)F)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 E17 compound treatment 0.107 0.04 10.3 0.115 0.0467 13.0 16.4763 0.9933 3064811 Maybridge4_003977 Cc1cc(NC(=O)NC(=O)c2csnn2)no1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 E18 compound treatment 0.112 0.045 11.59 0.118 0.0497 13.84 17.9773 0.9961 3179534 Maybridge4_003978 FC(F)(F)C1N(CCc2c1[nH]c3ccccc23)C(=O)c4ccc(Cl)cc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 E19 compound treatment 0.091 0.024 6.18 0.095 0.0267 7.43 9.6248 0.9958 3064812 Maybridge4_003979 Cc1noc(C)c1c2nc(CS(=O)(=O)Cc3ccc(Cl)cc3)no2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 E20 compound treatment 0.068 0.001 0.26 0.067 -0.00131 -0.37 -0.0764 -0.1709 3064813 Maybridge4_003980 Cc1cc(cc(C)c1I)C(C)(C)C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 E21 compound treatment 0.121 0.054 13.9 0.123 0.0547 15.23 20.6005 0.999 1590769 Maybridge4_003981 CNC(=S)N1CCc2sccc2C1c3ccc(Cl)cc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 E22 compound treatment 0.177 0.11 28.32 0.169 0.101 28.04 39.8543 1.0 3064814 Maybridge4_003982 CN(C)/C=N/C(=O)c1ccc(s1)c2cccs2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 E23 mock treatment 0.072 0.005 1.29 0.068 -3.12E-4 -0.09 0.8488 0.6578 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 E24 positive control 0.076 0.009 2.32 0.076 0.00769 2.14 3.1524 0.9992 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 F01 compound treatment 0.29 0.223 57.42 0.296 0.228 63.41 85.4364 0.9988 3179535 Maybridge4_003983 Clc1ccc(OC(=O)/C=C/c2ccc(s2)c3cccs3)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 F02 compound treatment 0.139 0.072 18.54 0.138 0.0697 19.41 26.8314 0.9997 3064815 Maybridge4_003984 Cc1ccc(C)n1c2ccc(cc2)n3cccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 F03 compound treatment 0.075 0.008 2.06 0.073 0.00469 1.31 2.3796 0.9758 1608279 Maybridge4_003985 CC(O)(CNCc1ccc(Cl)cc1)CSc2ccccc2Cl 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 F04 compound treatment 0.094 0.027 6.95 0.096 0.0277 7.71 10.3679 0.9987 3179536 Maybridge4_003986 COC(=O)c1cc(=O)c2cc(NC(=O)c3ccc(OC(F)(F)F)cc3)ccc2[nH]1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 F05 compound treatment 0.07 0.003 0.77 0.07 0.00169 0.47 0.8785 0.9716 3064655 Maybridge4_003987 CC1(C)COC(=N1)c2sccc2C(=O)O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 F06 compound treatment 0.069 0.002 0.51 0.072 0.00369 1.03 1.0903 0.949 1318553 Maybridge4_003988 NNC(=O)c1ccc(cc1)c2ccccc2F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 F07 compound treatment 0.071 0.004 1.03 0.072 0.00369 1.03 1.4544 1.0 3179537 Maybridge4_003989 OC1CS(=O)(=O)CC1S(=O)(=O)c2ccc(Cl)cc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 F08 compound treatment 0.095 0.028 7.21 0.096 0.0277 7.71 10.55 0.9994 3064656 Maybridge4_003990 COc1cc(cc(c1C(=O)NCc2cccs2)C(F)(F)F)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 F09 compound treatment 0.119 0.052 13.39 0.127 0.0587 16.34 21.0241 0.9951 3179538 Maybridge4_003991 CSc1ccc(s1)C(=O)NC(=O)NCc2cccc(Cl)c2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 F10 compound treatment 0.08 0.013 3.35 0.08 0.0117 3.25 4.6683 0.9999 1598180 Maybridge4_003992 CN(C)c1cnn(c2cnc3ccccc3n2)c(=O)c1Cl 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 F11 compound treatment 0.066 -0.001 -0.26 0.07 0.00169 0.47 0.1503 0.2804 3179539 Maybridge4_003993 Cc1nnsc1C(=O)Oc2ccc(cc2)c3nn[nH]c3C#N 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 F12 compound treatment 0.099 0.032 8.24 0.115 0.0467 13.0 15.0198 0.9758 3179540 Maybridge4_003994 CC(C)(C)c1cc(n(n1)c2ccc(cc2)n3cccc3)C(C)(C)C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 F13 compound treatment 0.116 0.049 12.62 0.107 0.0387 10.77 16.5394 0.9969 3064661 Maybridge4_003995 CCOC(=O)c1cc(CSc2ccc(cn2)C(F)(F)F)c3OCOCc3c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 F14 compound treatment 0.068 0.001 0.26 0.07 0.00169 0.47 0.5144 0.9599 1225795 Maybridge4_003996 CNC(=S)N1CCN(CC1)c2ccccc2OC 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 F15 compound treatment 0.079 0.012 3.09 0.084 0.0157 4.37 5.274 0.9856 3179541 Maybridge4_003997 Clc1cc(Cl)cc(c1)C(=O)OCCSc2cnc3ccccc3n2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 F16 compound treatment 0.091 0.024 6.18 0.097 0.0287 7.99 10.0187 0.9919 3064703 Maybridge4_003998 CS(=O)(=O)Nc1ccc(nc1)N2CCN(CC2)c3ccc(cn3)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 F17 compound treatment 0.064 -0.003 -0.77 0.072 0.00369 1.03 0.18 0.1401 3179628 Maybridge4_003999 FC(F)(F)c1cccc(NC(=S)N2CCCC2)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 F18 compound treatment 0.067 0.0 0.0 0.072 0.00369 1.03 0.7262 0.7071 1219010 Maybridge4_004000 COc1cccc(Oc2ccc(OC)cc2C(=O)NN)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 F19 compound treatment 0.066 -0.001 -0.26 0.069 6.88E-4 0.19 -0.0467 -0.1455 1054347 Maybridge4_004001 Cc1ccc(cc1)S(=O)(=O)NC(=O)N2CCCC2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 F20 compound treatment 0.086 0.019 4.89 0.091 0.0227 6.32 7.9268 0.992 1252794 Maybridge4_004002 CC(C)Cc1ccc(cc1)C(C)c2nc(no2)c3cccs3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 F21 compound treatment 0.132 0.065 16.74 0.137 0.0687 19.13 25.3601 0.9978 3179629 Maybridge4_004003 Cc1nc(sc1C(=O)Nc2ccc(Cl)cc2)C(=O)Nc3ccc(Cl)cc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 F22 compound treatment 0.089 0.022 5.66 0.091 0.0227 6.32 8.473 0.9985 3179630 Maybridge4_004004 CC(C)(C)c1n[nH]c(c1Cc2c(F)cccc2Cl)C(C)(C)C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 F23 mock treatment 0.068 0.001 0.26 0.067 -0.00131 -0.37 -0.0764 -0.1709 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 F24 positive control 0.074 0.007 1.8 0.074 0.00569 1.58 2.3944 0.9979 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 G01 compound treatment 0.076 0.009 2.32 0.075 0.00669 1.86 2.9555 0.9941 3064707 Maybridge4_004005 O=C(NC1CCCCNC1=O)c2ccc3nsnc3c2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 G02 compound treatment 0.102 0.035 9.01 0.104 0.0357 9.94 13.3998 0.9988 3179631 Maybridge4_004006 Cc1noc(C)c1C(=O)N2CCc3sccc3C2c4ccc(cc4)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 G03 compound treatment 0.066 -0.001 -0.26 0.069 6.88E-4 0.19 -0.0467 -0.1455 1266306 Maybridge4_004007 NS(=O)(=O)c1ccc(CNS(=O)(=O)c2ccccc2)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 G04 compound treatment 0.067 0.0 0.0 0.068 -3.12E-4 -0.09 -0.0615 -0.7071 3179632 Maybridge4_004008 CCOC(=O)c1ncoc1c2ccc(Cl)cc2Cl 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 G05 compound treatment 0.085 0.018 4.63 0.09 0.0217 6.04 7.5479 0.9914 3064708 Maybridge4_004009 Clc1cccc(NC(=O)NCc2csc(n2)c3cccs3)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 G06 compound treatment 0.148 0.081 20.86 0.168 0.0997 27.76 34.3777 0.9901 1361028 Maybridge4_004010 COc1ccc(cc1)C2N(CCc3sccc23)S(=O)(=O)c4ccc(Cl)cc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 G07 compound treatment 0.076 0.009 2.32 0.077 0.00869 2.42 3.3493 0.9998 3179633 Maybridge4_004011 O=C(N1CCC2(CC1)NC(=O)c3ccccc3O2)c4ncoc4c5ccccc5 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 G08 compound treatment 0.153 0.086 22.14 0.151 0.0827 23.03 31.9403 0.9998 3064709 Maybridge4_004012 NC(=S)c1sccc1CS(=O)c2ccc(Cl)cc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 G09 compound treatment 0.166 0.099 25.49 0.19 0.122 33.89 41.9871 0.9901 3179634 Maybridge4_004013 COc1ccccc1CC(=O)NCc2ccc(cc2)c3cccs3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 G10 compound treatment 0.068 0.001 0.26 0.068 -3.12E-4 -0.09 0.1205 0.4434 3064710 Maybridge4_004014 FC(F)(F)c1cc(=O)[nH]c2CCCC(=O)c12 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 G11 compound treatment 0.093 0.026 6.69 0.116 0.0477 13.28 14.1244 0.9497 3179635 Maybridge4_004015 Cc1nn(nc1CNC(=O)C2CC2)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 G12 compound treatment 0.078 0.011 2.83 0.088 0.0197 5.48 5.8796 0.9528 3064711 Maybridge4_004016 FC(F)(F)c1cccc(OCc2ccc(cc2)c3ncns3)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 G13 compound treatment 0.062 -0.005 -1.29 0.069 6.88E-4 0.19 -0.7749 -0.5954 3179636 Maybridge4_004017 Fc1cc(C(=O)NCc2ccco2)c3OCOCc3c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 G14 compound treatment 0.121 0.054 13.9 0.137 0.0687 19.13 23.3574 0.9877 3064712 Maybridge4_004018 Fc1ccc(OC(=O)/C(=C\c2cccs2)/c3ccsc3)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 G15 compound treatment 0.068 0.001 0.26 0.069 6.88E-4 0.19 0.3174 0.9894 3179637 Maybridge4_004019 COC(=O)C1=NN(C(=O)C1)c2c(C)cccc2Cl 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 G16 compound treatment 0.07 0.003 0.77 0.071 0.00269 0.75 1.0754 0.9999 1285053 Maybridge4_004020 Fc1ccc(NC(=O)CS(=O)(=O)Nc2ccc(F)cc2Cl)c(Cl)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 G17 compound treatment 0.128 0.061 15.71 0.143 0.0747 20.8 25.8134 0.9904 3179638 Maybridge4_004021 Clc1ccc(CSCc2ccc(cc2)c3csnn3)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 G18 compound treatment 0.066 -0.001 -0.26 0.073 0.00469 1.31 0.741 0.5569 1173952 Maybridge4_004022 COc1cc(NS(=O)(=O)c2c(C)oc3c(F)c(F)c(F)c(F)c23)cc(OC)c1OC 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 G19 compound treatment 0.139 0.072 18.54 0.152 0.0837 23.31 29.5884 0.9936 1587917 Maybridge4_004023 Clc1cc(Cl)cc(c1)C(=O)NCc2ccc(cc2)c3csnn3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 G20 compound treatment 0.085 0.018 4.63 0.091 0.0227 6.32 7.7448 0.9884 3179639 Maybridge4_004024 Clc1ccc(/C=N/Cc2ccc(s2)c3cccs3)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 G21 compound treatment 0.067 0.0 0.0 0.069 6.88E-4 0.19 0.1354 0.7071 3064752 Maybridge4_004025 Cc1cc(C(=O)O)c(C)n1c2cc(cc(c2)C(F)(F)F)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 G22 compound treatment 0.163 0.096 24.72 0.168 0.0997 27.76 37.1086 0.9983 1446641 Maybridge4_004026 COc1ccc2ncc3COc4ccc(Cl)cc4-c3c2c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 G23 mock treatment 0.068 0.001 0.26 0.068 -3.12E-4 -0.09 0.1205 0.4434 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 G24 positive control 0.074 0.007 1.8 0.076 0.00769 2.14 2.7883 0.9963 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 H01 compound treatment 0.077 0.01 2.57 0.078 0.00969 2.7 3.7283 0.9997 3064753 Maybridge4_004027 CC(=O)Nc1ccccc1OCC(O)CS(=O)(=O)c2ccc(cn2)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 H02 compound treatment 0.163 0.096 24.72 0.181 0.113 31.38 39.6686 0.993 3064754 Maybridge4_004028 CC(C)c1ccc(C)c2c(C#N)cc(C)c2c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 H03 compound treatment 0.078 0.011 2.83 0.086 0.0177 4.93 5.4858 0.9655 3064755 Maybridge4_004029 Cc1noc(c1c2nnc(o2)c3cccc(c3)C(F)(F)F)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 H04 compound treatment 0.063 -0.004 -1.03 0.07 0.00169 0.47 -0.3959 -0.3497 3064756 Maybridge4_004030 COc1ccc(C/N=C/c2ccc(OC)c(OC)c2)cc1OC 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 H05 compound treatment 0.067 0.0 0.0 0.072 0.00369 1.03 0.7262 0.7071 3064758 Maybridge4_004031 Clc1ccc(cc1)c2cc[nH]n2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 H06 compound treatment 0.068 0.001 0.26 0.07 0.00169 0.47 0.5144 0.9599 3179640 Maybridge4_004032 COC(=O)Cc1nc(sc1C)c2ccc(F)cc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 H07 compound treatment 0.072 0.005 1.29 0.074 0.00569 1.58 2.0303 0.9947 1266051 Maybridge4_004033 COc1ccc(cc1)S(=O)(=O)C2CS(=O)(=O)CC2O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 H08 compound treatment 0.103 0.036 9.27 0.105 0.0367 10.22 13.7788 0.9988 3179641 Maybridge4_004034 COc1cc(cc(c1C(=O)N2CCC(CC2)C(=O)c3ccc(Cl)cc3)C(F)(F)F)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 H09 compound treatment 0.081 0.014 3.6 0.082 0.0137 3.81 5.2442 0.9996 1103147 Maybridge4_004035 N#Cc1c(nc2SCCn12)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 H10 compound treatment 0.068 0.001 0.26 0.069 6.88E-4 0.19 0.3174 0.9894 3179642 Maybridge4_004036 Brc1cc(Br)cc(c1)C(=O)NC(=O)N2CCOCC2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 H11 compound treatment 0.276 0.209 53.81 0.3 0.232 64.52 83.6753 0.9959 3064759 Maybridge4_004037 O=S(=O)(/C(=C/c1ccc(s1)C2=CCOc3ccccc23)/C#N)c4ccccc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 H12 compound treatment 0.142 0.075 19.31 0.162 0.0937 26.09 32.1038 0.989 1625813 Maybridge4_004038 CCN(CC)c1ccc(NC(=O)c2ccc(Cl)cc2)c(n1)N(CC)CC 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 H13 compound treatment 0.116 0.049 12.62 0.133 0.0647 18.02 21.6595 0.9848 3179643 Maybridge4_004039 CCOC(=O)c1cc(CSc2cccc(c2)C(F)(F)F)c3OCOCc3c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 H14 compound treatment 0.094 0.027 6.95 0.13 0.0617 17.18 17.0634 0.9207 3064760 Maybridge4_004040 Cc1ccc(SCCC(=O)N2CCN(CC2)c3ncc(cc3Cl)C(F)(F)F)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 H15 compound treatment 0.076 0.009 2.32 0.079 0.0107 2.98 3.7432 0.9923 1714044 Maybridge4_004041 O=C1CC(Sc2ccccc2N1)c3ccco3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 H16 compound treatment 0.082 0.015 3.86 0.085 0.0167 4.65 6.0171 0.9958 3179644 Maybridge4_004042 CNC(=S)Nc1ccc(nc1)N2CCN(CC2)c3ccc(cn3)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 H17 compound treatment 0.066 -0.001 -0.26 0.072 0.00369 1.03 0.5441 0.5139 3064761 Maybridge4_004043 FC(F)(F)c1ccccc1NC(=S)N2CCCC2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 H18 compound treatment 0.105 0.038 9.78 0.111 0.0427 11.89 15.3245 0.9953 3179645 Maybridge4_004044 Cc1ccc(SCc2cccc(c2)C(=O)N3CCN(CC3)c4ncccc4C(F)(F)F)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 H19 compound treatment 0.068 0.001 0.26 0.072 0.00369 1.03 0.9082 0.8578 3064762 Maybridge4_004045 FC(F)(F)C(CNC(=O)Nc1ccccc1)c2ccc[nH]2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 H20 compound treatment 0.125 0.058 14.93 0.138 0.0697 19.41 24.2826 0.9916 3179646 Maybridge4_004046 FC(F)(F)Oc1ccc(cc1)C2N(CCc3sccc23)C(=O)c4ccco4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 H21 compound treatment 0.088 0.021 5.41 0.088 0.0197 5.48 7.7002 1.0 1471144 Maybridge4_004047 Cc1nc(sc1C(=O)Oc2ccc(Cl)cc2)C(=O)Oc3ccc(Cl)cc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 H22 compound treatment 0.071 0.004 1.03 0.068 -3.12E-4 -0.09 0.6667 0.6451 3179647 Maybridge4_004048 CC(C)(C)C(=O)C(Cc1c(F)cccc1Cl)C(=O)C(C)(C)C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 H23 mock treatment 0.067 0.0 0.0 0.068 -3.12E-4 -0.09 -0.0615 -0.7071 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 H24 positive control 0.074 0.007 1.8 0.076 0.00769 2.14 2.7883 0.9963 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 I01 compound treatment 0.081 0.014 3.6 0.077 0.00869 2.42 4.2596 0.9812 3064764 Maybridge4_004049 Cc1nn(C)c2sc(cc12)C(=O)NC3CCCCNC3=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 I02 compound treatment 0.147 0.08 20.6 0.144 0.0757 21.08 29.4694 0.9999 3179648 Maybridge4_004050 FC(F)(F)c1ccc(cc1)C2N(CCc3sccc23)C(=O)Nc4ccccc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 I03 compound treatment 0.096 0.029 7.47 0.107 0.0387 10.77 12.8982 0.984 3179649 Maybridge4_004051 CC1(C)CCc2cc(ccc2O1)S(=O)(=O)NCc3ccc(cc3)S(=O)(=O)N 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 I04 compound treatment 0.068 0.001 0.26 0.073 0.00469 1.31 1.1051 0.8306 3064766 Maybridge4_004052 NNC(=O)c1ncoc1c2ccc(Cl)cc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 I05 compound treatment 0.095 0.028 7.21 0.108 0.0397 11.05 12.9131 0.9786 3064767 Maybridge4_004053 Cc1cc(C)cc(NC(=O)NCc2csc(n2)c3cccs3)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 I06 compound treatment 0.126 0.059 15.19 0.129 0.0607 16.9 22.6923 0.9986 1598083 Maybridge4_004054 NNC(=O)CS(=O)(=O)Cc1ccc(cc1)c2csnn2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 I07 compound treatment 0.073 0.006 1.54 0.075 0.00669 1.86 2.4093 0.9957 3179650 Maybridge4_004055 O=C(NCc1ccc2OCCc2c1)c3ccc4nsnc4c3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 I08 compound treatment 0.154 0.087 22.4 0.158 0.0897 24.98 33.5008 0.9985 1651781 Maybridge4_004056 CC(C)(C)c1csc(n1)c2sccc2COc3ccc(Cl)cc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 I09 compound treatment 0.091 0.024 6.18 0.091 0.0227 6.32 8.8371 0.9999 3179651 Maybridge4_004057 Cn1nc(cc1C(=O)NCc2ccc(cc2)c3cccs3)C(C)(C)C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 I10 compound treatment 0.124 0.057 14.68 0.153 0.0847 23.58 27.0544 0.9739 1154669 Maybridge4_004058 Cc1nn(cc1c2nsc(Nc3ccccc3)n2)C(=O)c4ccccc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 I11 compound treatment 0.065 -0.002 -0.51 0.07 0.00169 0.47 -0.0318 -0.0456 3179736 Maybridge4_004059 CN1CCOc2cc(ccc12)S(=O)(=O)NCc3nn(nc3C)c4ccccc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 I12 compound treatment 0.104 0.037 9.53 0.121 0.0527 14.67 17.1117 0.9781 3064768 Maybridge4_004060 Fc1ccc(NC(=O)NC(=O)c2csc(n2)c3ccc(cc3Cl)C(F)(F)F)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 I13 compound treatment 0.073 0.006 1.54 0.078 0.00969 2.7 3.0001 0.965 3179737 Maybridge4_004061 Fc1cc(C(=O)NCc2ccc(cc2)N3CCOCC3)c4OCOCc4c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 I14 compound treatment 0.074 0.007 1.8 0.084 0.0157 4.37 4.3637 0.9233 3179738 Maybridge4_004062 Cc1cc(NC(=O)/C(=C/c2cccs2)/c3ccsc3)no1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 I15 compound treatment 0.214 0.147 37.85 0.211 0.143 39.74 54.8613 0.9997 3064816 Maybridge4_004063 COC(=O)C/1=NN(C(=O)\C1=N/O)c2c(C)cccc2Cl 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 I16 compound treatment 0.073 0.006 1.54 0.074 0.00569 1.58 2.2124 0.9999 3064817 Maybridge4_004064 COC(=O)C/1=NN(C(=O)\C1=C/N(C)C)c2ccccc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 I17 compound treatment 0.085 0.018 4.63 0.092 0.0237 6.6 7.9417 0.9851 3064818 Maybridge4_004065 FC(F)(F)c1cc(/C=C(\C#N)/S(=O)(=O)c2ccccc2)cc(c1)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 I18 compound treatment 0.064 -0.003 -0.77 0.072 0.00369 1.03 0.18 0.1401 3064819 Maybridge4_004066 OC(=O)c1coc2CCC/C(=N\N3CCCCC3)/c12 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 I19 compound treatment 0.064 -0.003 -0.77 0.07 0.00169 0.47 -0.2139 -0.2365 1604639 Maybridge4_004067 CNC(=S)NCc1ccc(cc1)c2csnn2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 I20 compound treatment 0.098 0.031 7.98 0.108 0.0397 11.05 13.4593 0.9872 3064820 Maybridge4_004068 FC(F)(F)c1cccc(/C=N/Cc2ccc(s2)c3cccs3)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 I21 compound treatment 0.092 0.025 6.44 0.091 0.0227 6.32 9.0192 1.0 3064821 Maybridge4_004069 FC(F)(F)c1cc(cc(c1)C(F)(F)F)C(=O)Oc2ccc(cc2)c3csnn3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 I22 compound treatment 0.095 0.028 7.21 0.088 0.0197 5.48 8.9746 0.9909 3064822 Maybridge4_004070 COc1cc(/C=C\2/N=C(C)OC2=O)cc(OC)c1OC 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 I23 mock treatment 0.063 -0.004 -1.03 0.067 -0.00131 -0.37 -0.9867 -0.9029 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 I24 positive control 0.073 0.006 1.54 0.075 0.00669 1.86 2.4093 0.9957 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 J01 compound treatment 0.077 0.01 2.57 0.077 0.00869 2.42 3.5314 0.9995 3064823 Maybridge4_004071 CSc1cc(n[nH]1)c2nccs2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 J02 compound treatment 0.188 0.121 31.15 0.198 0.13 36.12 47.5678 0.9973 3179739 Maybridge4_004072 CC(C)c1ccc(C)c2c(/C=C(/C#N)\S(=O)(=O)C)cc(C)c2c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 J03 compound treatment 0.114 0.047 12.1 0.127 0.0587 16.34 20.1138 0.9891 3064824 Maybridge4_004073 Nc1nc2c(c(sc2s1)C(F)(F)F)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 J04 compound treatment 0.112 0.045 11.59 0.114 0.0457 12.72 17.1896 0.9989 3179740 Maybridge4_004074 NC(=S)Nc1ccc(cc1Cl)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 J05 compound treatment 0.072 0.005 1.29 0.075 0.00669 1.86 2.2272 0.9837 3179741 Maybridge4_004075 COC(=O)c1sc(c(c1S(=O)(=O)N2CCOCC2)c3ccccc3)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 J06 compound treatment 0.07 0.003 0.77 0.072 0.00369 1.03 1.2723 0.9901 3064825 Maybridge4_004076 CC(C)N(C(C)C)C(=O)c1ccc(cc1)c2ccccc2F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 J07 compound treatment 0.073 0.006 1.54 0.073 0.00469 1.31 2.0154 0.9965 1125107 Maybridge4_004077 Clc1snnc1CN2CCOCC2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 J08 compound treatment 0.07 0.003 0.77 0.073 0.00469 1.31 1.4693 0.9686 3179742 Maybridge4_004078 Clc1ccc(Sc2ccc(C#N)cn2)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 J09 compound treatment 0.099 0.032 8.24 0.115 0.0467 13.0 15.0198 0.9758 3179743 Maybridge4_004079 COc1cc(cc(OC)c1OC)C(=O)OC(Cc2ccccc2)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 J10 compound treatment 0.071 0.004 1.03 0.076 0.00769 2.14 2.2421 0.9437 1420510 Maybridge4_004080 NC(=S)c1nc(oc1N)c2ccccc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 J11 compound treatment 0.066 -0.001 -0.26 0.072 0.00369 1.03 0.5441 0.5139 3064826 Maybridge4_004081 CCOC(=O)Cc1csc(n1)c2ncc(cc2Cl)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 J12 compound treatment 0.092 0.025 6.44 0.102 0.0337 9.38 11.1854 0.9831 1571322 Maybridge4_004082 CCN(CC)c1ccc(NC(=O)C2CCCCC2)c(n1)N(CC)CC 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 J13 compound treatment 0.085 0.018 4.63 0.094 0.0257 7.15 8.3356 0.9779 3064827 Maybridge4_004083 CC(C)(C)Cc1nc(no1)C2(CC2)c3ccc(Cl)cc3Cl 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 J14 compound treatment 0.29 0.223 57.42 0.301 0.233 64.8 86.421 0.9982 3179744 Maybridge4_004084 CN(C)c1ccc(/C=C(\C#N)/S(=O)(=O)c2ccccc2)cc1C#N 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 J15 compound treatment 0.216 0.149 38.36 0.216 0.148 41.13 56.2101 0.9994 1672501 Maybridge4_004085 O=C(NC(=O)N1CCCC1)C2CCN(CC2)c3cnc4ccccc4n3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 J16 compound treatment 0.116 0.049 12.62 0.128 0.0597 16.62 20.6748 0.9907 3064828 Maybridge4_004086 CC(C)Cc1ccc(cc1)C(C)C(=O)Nc2ccc(Cl)cc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 J17 compound treatment 0.067 0.0 0.0 0.071 0.00269 0.75 0.5292 0.7071 1716306 Maybridge4_004087 O=C(C1CCN(CC1)C(=O)c2ccco2)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 J18 compound treatment 0.064 -0.003 -0.77 0.071 0.00269 0.75 -0.0169 -0.0158 1727489 Maybridge4_004088 Cc1ccc(F)cc1N2CC(CC2=O)C(=O)O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 J19 compound treatment 0.093 0.026 6.69 0.102 0.0337 9.38 11.3674 0.9863 3179745 Maybridge4_004089 Clc1ccc(/C=C/2\COC/C(=C\c3ccc(Cl)cc3)/C2=O)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 J20 compound treatment 0.13 0.063 16.22 0.145 0.0767 21.36 26.5714 0.9908 1700558 Maybridge4_004090 CC(C)(C)c1ccc(cc1)C(=O)N2CCC(CC2)c3nc(no3)c4ccc(Cl)cc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 J21 compound treatment 0.079 0.012 3.09 0.084 0.0157 4.37 5.274 0.9856 3064829 Maybridge4_004091 Fc1ccc(NC(=O)Cc2cc(F)cc(F)c2)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 J22 compound treatment 0.07 0.003 0.77 0.07 0.00169 0.47 0.8785 0.9716 3064830 Maybridge4_004092 CC(C)(C)c1nnc(o1)c2cccc(NS(=O)(=O)c3ccc(s3)c4ccon4)c2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 J23 mock treatment 0.067 0.0 0.0 0.068 -3.12E-4 -0.09 -0.0615 -0.7071 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 J24 positive control 0.076 0.009 2.32 0.076 0.00769 2.14 3.1524 0.9992 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 K01 compound treatment 0.077 0.01 2.57 0.077 0.00869 2.42 3.5314 0.9995 3179746 Maybridge4_004093 Clc1ccc(cc1)S(=O)(=O)NC2CCCCNC2=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 K02 compound treatment 0.11 0.043 11.07 0.114 0.0457 12.72 16.8255 0.9976 3179747 Maybridge4_004094 FC(F)(F)c1ccc(cc1)C(=O)Nc2cccc(c2)c3nnco3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 K03 compound treatment 0.09 0.023 5.92 0.085 0.0167 4.65 7.4735 0.9928 3064831 Maybridge4_004095 O=S(=O)(NCC1COc2ccccc2O1)c3ccc(nc3)N4CCOCC4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 K04 compound treatment 0.091 0.024 6.18 0.1 0.0317 8.82 10.6095 0.9848 1348923 Maybridge4_004096 Cc1cc(NC(=O)CCOc2ccc(F)cc2)no1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 K05 compound treatment 0.069 0.002 0.51 0.073 0.00469 1.31 1.2872 0.9172 3179748 Maybridge4_004097 Cc1cc(c(C)o1)S(=O)(=O)NCC2CCN(CC2)C(=O)OC(C)(C)C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 K06 compound treatment 0.067 0.0 0.0 0.07 0.00169 0.47 0.3323 0.7071 1281685 Maybridge4_004098 NC(=O)c1cnc2SCCn2c1=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 K07 compound treatment 0.075 0.008 2.06 0.075 0.00669 1.86 2.7734 0.9987 3064832 Maybridge4_004099 COc1ccc(cc1)C(=O)NCc2ccc3OCCc3c2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 K08 compound treatment 0.105 0.038 9.78 0.118 0.0497 13.84 16.7029 0.9856 3179749 Maybridge4_004100 CC(C)(C)c1csc(n1)c2sccc2CS(=O)(=O)c3ccc(Cl)cc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 K09 compound treatment 0.132 0.065 16.74 0.151 0.0827 23.03 28.117 0.9877 3179750 Maybridge4_004101 COc1ccccc1CC(=O)NCc2nn(nc2C)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 K10 compound treatment 0.08 0.013 3.35 0.09 0.0217 6.04 6.6376 0.9612 3064834 Maybridge4_004102 FC(F)(F)c1ccc(SCCS(=O)(=O)CCSc2ccc(cn2)C(F)(F)F)nc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 K11 compound treatment 0.061 -0.006 -1.54 0.068 -3.12E-4 -0.09 -1.1539 -0.7458 3179751 Maybridge4_004103 Cc1noc(C)c1S(=O)(=O)NCc2nn(nc2C)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 K12 compound treatment 0.067 0.0 0.0 0.072 0.00369 1.03 0.7262 0.7071 3064714 Maybridge4_004104 OC(=O)c1ncoc1c2cccc(Cl)c2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 K13 compound treatment 0.064 -0.003 -0.77 0.071 0.00269 0.75 -0.0169 -0.0158 1121050 Maybridge4_004105 CCOC(=O)c1c(NC(=O)C)nc(SC)n1Cc2ccco2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 K14 compound treatment 0.151 0.084 21.63 0.178 0.11 30.55 36.8931 0.9857 3179752 Maybridge4_004106 FC(F)(F)c1ccc(SC(=O)/C(=C\c2cccs2)/c3ccsc3)nc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 K15 compound treatment 0.119 0.052 13.39 0.122 0.0537 14.95 20.0395 0.9985 3064716 Maybridge4_004107 CCOC(=O)c1n[nH]c(=S)[nH]c1=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 K16 compound treatment 0.093 0.026 6.69 0.106 0.0377 10.5 12.1551 0.9764 3179753 Maybridge4_004108 COC(=O)c1nn(c2ccccc2)c3oc(=O)cc(C)c13 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 K17 compound treatment 0.072 0.005 1.29 0.076 0.00769 2.14 2.4242 0.9704 3064717 Maybridge4_004109 CC(C)(C)S(=O)(=O)/C(=C/c1cc(cc(c1)C(F)(F)F)C(F)(F)F)/C#N 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 K18 compound treatment 0.11 0.043 11.07 0.122 0.0537 14.95 18.4009 0.9891 3179754 Maybridge4_004110 FC(F)(F)C1N(CCc2c1[nH]c3ccccc23)C(=O)c4cccc(c4)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 K19 compound treatment 0.137 0.07 18.02 0.135 0.0667 18.57 25.8765 0.9999 3064769 Maybridge4_004111 CC1=NN(C(=O)C1)c2ccc(cc2)c3csnn3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 K20 compound treatment 0.118 0.051 13.13 0.123 0.0547 15.23 20.0543 0.9973 1351476 Maybridge4_004112 Fc1ccccc1NC(=O)NCc2sccc2COc3ccc(Cl)cc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 K21 compound treatment 0.086 0.019 4.89 0.089 0.0207 5.76 7.533 0.9967 3064771 Maybridge4_004113 CCCC1N(CCc2sccc12)C(=O)c3ccc(Cl)cc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 K22 compound treatment 0.069 0.002 0.51 0.072 0.00369 1.03 1.0903 0.949 3179755 Maybridge4_004114 COc1cc(/C=C(\NC(=O)C)/C(=O)O)cc(OC)c1OC 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 K23 mock treatment 0.067 0.0 0.0 0.069 6.88E-4 0.19 0.1354 0.7071 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 K24 positive control 0.078 0.011 2.83 0.079 0.0107 2.98 4.1073 0.9997 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 L01 compound treatment 0.125 0.058 14.93 0.134 0.0657 18.29 23.4949 0.9949 3064772 Maybridge4_004115 FC(F)(F)c1sc(cc1c2ccccc2)C(=O)Oc3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 L02 compound treatment 0.221 0.154 39.65 0.218 0.15 41.69 57.5142 0.9997 3179756 Maybridge4_004116 NC(=S)c1ccc(s1)c2cccs2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 L03 compound treatment 0.106 0.039 10.04 0.122 0.0537 14.95 17.6727 0.9812 3179757 Maybridge4_004117 COc1ccc(SCc2nsc(Sc3ccc(OC)cc3)n2)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 L04 compound treatment 0.082 0.015 3.86 0.08 0.0117 3.25 5.0324 0.9964 3064773 Maybridge4_004118 OC(=O)c1c-2c(CSc3ccc(Cl)cc32)nc4ccccc14 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 L05 compound treatment 0.074 0.007 1.8 0.075 0.00669 1.86 2.5913 0.9999 3179758 Maybridge4_004119 CSC(=N)Nc1csc(c1c2ccccc2)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 L06 compound treatment 0.213 0.146 37.59 0.261 0.193 53.66 64.5255 0.9848 3179759 Maybridge4_004120 O=C/1Nc2ccccc2\C1=C/c3ccccc3N4CCN(Cc5ccccc5)CC4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 L07 compound treatment 0.08 0.013 3.35 0.086 0.0177 4.93 5.8499 0.9823 3064774 Maybridge4_004121 NC(=S)c1cc(c(s1)C(F)(F)F)c2ccccc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 L08 compound treatment 0.071 0.004 1.03 0.077 0.00869 2.42 2.439 0.9276 3064775 Maybridge4_004122 CCOC(=O)Cc1c(C#N)c(N)sc1C(=O)OCC 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 L09 compound treatment 0.064 -0.003 -0.77 0.067 -0.00131 -0.37 -0.8046 -0.9416 3179760 Maybridge4_004123 FC(F)(F)C(Cc1ccccc1)OC(=O)c2ccc(Cl)cc2Cl 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 L10 compound treatment 0.115 0.048 12.36 0.123 0.0547 15.23 19.5081 0.9946 3064776 Maybridge4_004124 CC(C)(C)c1ccc(s1)C(=O)Nc2ccc(cc2)C(C)(C)C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 L11 compound treatment 0.125 0.058 14.93 0.144 0.0757 21.08 25.4642 0.9858 3178169 Maybridge4_004125 FC(F)(F)C1N(CCc2c1[nH]c3ccccc23)C(=O)CSc4ccc(Cl)cc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 L12 compound treatment 0.122 0.055 14.16 0.129 0.0607 16.9 21.9641 0.9961 3178170 Maybridge4_004126 FC(F)(F)c1ccc(nc1)N2CCN(CC2)c3ccc(NC(=O)c4cccs4)cn3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 L13 compound treatment 0.079 0.012 3.09 0.085 0.0167 4.65 5.4709 0.9803 3064777 Maybridge4_004127 FC(F)(F)c1ccnc(c1)c2ccc(s2)S(=O)(=O)N3CCCC3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 L14 compound treatment 0.239 0.172 44.28 0.277 0.209 58.12 72.4098 0.991 3064778 Maybridge4_004128 CC1(C)OC(=O)C(=Cc2cccn2c3ccc(cc3)C(F)(F)F)C(=O)O1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 L15 compound treatment 0.077 0.01 2.57 0.08 0.0117 3.25 4.1221 0.9933 3178171 Maybridge4_004129 Cc1onc(c1NC(=O)OCCOc2cc(ccn2)C(F)(F)F)c3c(Cl)cccc3Cl 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 L16 compound treatment 0.098 0.031 7.98 0.099 0.0307 8.55 11.687 0.9994 3178172 Maybridge4_004130 CC(C)Cc1ccc(cc1)C(C)C(=O)N2CCN(CC2)c3ccc(cn3)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 L17 compound treatment 0.094 0.027 6.95 0.107 0.0387 10.77 12.5341 0.9775 1466123 Maybridge4_004131 Clc1ccc(cc1)S(=O)(=O)N2CCC(CC2)C(=O)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 L18 compound treatment 0.253 0.186 47.89 0.316 0.248 68.98 82.6387 0.9841 3178173 Maybridge4_004132 CS(=O)(=O)/C(=C/c1cccn1c2ccc(OC(F)(F)F)cc2)/C#N 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 L19 compound treatment 0.065 -0.002 -0.51 0.072 0.00369 1.03 0.362 0.3151 3064779 Maybridge4_004133 Clc1ccc(C(=O)n2cc3COCCc3n2)c(Cl)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 L20 compound treatment 0.115 0.048 12.36 0.115 0.0467 13.0 17.9327 0.9997 3178174 Maybridge4_004134 CC(C)(C)c1cc(n(n1)c2ccc(cc2)C(=O)NN)C(C)(C)C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 L21 compound treatment 0.067 0.0 0.0 0.067 -0.00131 -0.37 -0.2585 -0.7071 3064780 Maybridge4_004135 OC(=O)CCc1ccc(Cl)cc1Cl 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 L22 compound treatment 0.13 0.063 16.22 0.128 0.0597 16.62 23.2236 0.9999 1339700 Maybridge4_004136 Cc1onc(c1c2nc(CSc3nc4ccccc4[nH]3)no2)c5ccccc5 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 L23 mock treatment 0.067 0.0 0.0 0.067 -0.00131 -0.37 -0.2585 -0.7071 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 L24 positive control 0.076 0.009 2.32 0.077 0.00869 2.42 3.3493 0.9998 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 M01 compound treatment 0.077 0.01 2.57 0.078 0.00969 2.7 3.7283 0.9997 3178175 Maybridge4_004137 CCc1ccc(cc1)S(=O)(=O)NC2CCCCNC2=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 M02 compound treatment 0.565 0.498 128.22 0.537 0.469 130.53 182.9614 1.0 3064835 Maybridge4_004138 CC/1Sc2ccc(Cl)cc2C(=O)\C1=C\N(C)C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 M03 compound treatment 0.072 0.005 1.29 0.071 0.00269 0.75 1.4395 0.9667 3178176 Maybridge4_004139 O=S(=O)(N(Cc1ccccn1)Cc2ccccn2)c3ccc(nc3)N4CCOCC4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 M04 compound treatment 0.068 0.001 0.26 0.069 6.88E-4 0.19 0.3174 0.9894 3064836 Maybridge4_004140 Cn1cnnc1SCc2ccc(cc2)c3csnn3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 M05 compound treatment 0.073 0.006 1.54 0.076 0.00769 2.14 2.6062 0.9872 3178177 Maybridge4_004141 O=C(N1CCCCCC1)c2ccc(nc2)N3CCOCC3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 M06 compound treatment 0.067 0.0 0.0 0.072 0.00369 1.03 0.7262 0.7071 3064837 Maybridge4_004142 COC(=O)c1cc(C)cc(=O)o1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 M07 compound treatment 0.068 0.001 0.26 0.07 0.00169 0.47 0.5144 0.9599 3064839 Maybridge4_004143 Fc1ccc(cc1F)S(=O)(=O)NCc2ccc3OCCc3c2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 M08 compound treatment 0.073 0.006 1.54 0.076 0.00769 2.14 2.6062 0.9872 1167482 Maybridge4_004144 Cc1nc(C)c(o1)c2ccnc(n2)C3(CC4CC5CC(C4)C3)C5 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 M09 compound treatment 0.086 0.019 4.89 0.099 0.0307 8.55 9.5022 0.965 3178178 Maybridge4_004145 CN(C)c1ccc(cc1)C(=O)NCc2nn(nc2C)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 M10 compound treatment 0.078 0.011 2.83 0.081 0.0127 3.53 4.5011 0.994 1335790 Maybridge4_004146 CN(C)c1c(F)cc(cc1F)C(=O)NC(=O)NCc2cccnc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 M11 compound treatment 0.07 0.003 0.77 0.07 0.00169 0.47 0.8785 0.9716 3178179 Maybridge4_004147 COc1ccc(OC)c(c1)S(=O)(=O)NCc2nn(nc2C)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 M12 compound treatment 0.57 0.503 129.51 0.567 0.499 138.88 189.7795 0.9994 3064841 Maybridge4_004148 CN(C)c1c(/C=C(/C#N)\S(=O)(=O)C)cc(/C=C(/C#N)\S(=O)(=O)C)c(N(C)C)c1C#N 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 M13 compound treatment 0.065 -0.002 -0.51 0.073 0.00469 1.31 0.559 0.3983 3178180 Maybridge4_004149 CSc1nsc(SC)c1C(=O)NC(=O)N2CCSCC2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 M14 compound treatment 0.061 -0.006 -1.54 0.069 6.88E-4 0.19 -0.957 -0.6148 1166894 Maybridge4_004150 COC(=O)c1c(C)nc(C)c(C(=O)OC)c1c2csc(c2)S(=O)(=O)N3CCSCC3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 M15 compound treatment 0.159 0.092 23.69 0.168 0.0997 27.76 36.3803 0.9969 3064844 Maybridge4_004151 COC(=O)c1sc(cc1CS(=O)(=O)c2cc(C)c(Cl)cc2C)C(C)(C)C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 M16 compound treatment 0.315 0.248 63.85 0.306 0.238 66.19 91.9571 0.9998 3178181 Maybridge4_004152 Sc1nccc(n1)c2ccc(s2)c3cccs3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 M17 compound treatment 0.097 0.03 7.72 0.101 0.0327 9.1 11.8987 0.9967 1462127 Maybridge4_004153 Fc1ccc(C(=O)Nc2ccc(cc2)c3cnco3)c(F)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 M18 compound treatment 0.112 0.045 11.59 0.123 0.0547 15.23 18.962 0.9909 3178182 Maybridge4_004154 Cc1ccccc1C(=O)N2CCc3c([nH]c4ccccc34)C2C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 M19 compound treatment 0.068 0.001 0.26 0.069 6.88E-4 0.19 0.3174 0.9894 1245747 Maybridge4_004155 Clc1ccc(cc1)C2=NCCc3sccc23 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 M20 compound treatment 0.086 0.019 4.89 0.09 0.0217 6.04 7.7299 0.9945 3178183 Maybridge4_004156 Clc1ccc(OCc2ccsc2Cn3cccc3)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 M21 compound treatment 0.068 0.001 0.26 0.069 6.88E-4 0.19 0.3174 0.9894 1431141 Maybridge4_004157 CCCC1N(CCc2sccc12)C(=O)c3cc(OC)cc(OC)c3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 M22 compound treatment 0.114 0.047 12.1 0.125 0.0567 15.79 19.7199 0.9914 3178184 Maybridge4_004158 Clc1ccc(SC(=O)c2ccc(s2)c3cccs3)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 M23 mock treatment 0.067 0.0 0.0 0.068 -3.12E-4 -0.09 -0.0615 -0.7071 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 M24 positive control 0.077 0.01 2.57 0.078 0.00969 2.7 3.7283 0.9997 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 N01 compound treatment 0.079 0.012 3.09 0.078 0.00969 2.7 4.0924 0.9977 3064890 Maybridge4_004159 C/C(=N\O)/c1cc(c(s1)C(F)(F)F)c2ccccc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 N02 compound treatment 0.406 0.339 87.28 0.389 0.321 89.31 124.8692 0.9999 3178185 Maybridge4_004160 CC(C)(C)c1csc(n1)c2ccc(s2)c3cccs3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 N03 compound treatment 0.116 0.049 12.62 0.113 0.0447 12.45 17.721 1.0 3064891 Maybridge4_004161 FC(F)(F)c1sc(COC(=O)Nc2ccccc2)cc1c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 N04 compound treatment 0.099 0.032 8.24 0.103 0.0347 9.66 12.6567 0.9969 3178186 Maybridge4_004162 FC(F)(F)c1ccc(Cl)c(c1)c2ccc(o2)C(C3C(=O)CCCC3=O)C4C(=O)CCCC4=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 N05 compound treatment 0.075 0.008 2.06 0.079 0.0107 2.98 3.5611 0.9838 3064893 Maybridge4_004163 COc1ccc(SCc2cc3c(F)c(F)c(F)c(F)c3o2)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 N06 compound treatment 0.133 0.066 16.99 0.132 0.0637 17.74 24.5575 0.9998 3178187 Maybridge4_004164 Cc1noc(C)c1C(=O)n2cc3CSc4ccc(F)cc4-c3n2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 N07 compound treatment 0.089 0.022 5.66 0.1 0.0317 8.82 10.2453 0.977 3064894 Maybridge4_004165 FC(F)(F)/C(=C(\C#N)/c1ccccc1)/Oc2ccc(C#N)cc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 N08 compound treatment 0.099 0.032 8.24 0.102 0.0337 9.38 12.4598 0.9979 3178188 Maybridge4_004166 Cc1oc(N)c(c1C)S(=O)(=O)/C(=C/c2cc(Cl)cc(Cl)c2)/C#N 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 N09 compound treatment 0.15 0.083 21.37 0.161 0.0927 25.81 33.3633 0.9956 3178189 Maybridge4_004167 CCOC(=O)c1ccc2C(=O)/C(=C/c3ccc(Cl)cc3Cl)/CCc2c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 N10 compound treatment 0.067 0.0 0.0 0.069 6.88E-4 0.19 0.1354 0.7071 1967416 Maybridge4_004168 OC(=O)CCC(=O)N1CCN(CC1)c2ncccc2C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 N11 compound treatment 0.076 0.009 2.32 0.074 0.00569 1.58 2.7585 0.9828 3064896 Maybridge4_004169 Clc1ccc(SCc2csc(n2)c3ccsc3)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 N12 compound treatment 0.075 0.008 2.06 0.076 0.00769 2.14 2.9703 0.9998 3178190 Maybridge4_004170 FC(F)(F)c1ccc(nc1)N2CCN(CC2)c3ccc(NC(=O)/C=C/c4ccccc4)cn3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 N13 compound treatment 0.074 0.007 1.8 0.072 0.00369 1.03 2.0006 0.9644 3064897 Maybridge4_004171 CN(C)/C=N/C(=S)N1CCOCC1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 N14 compound treatment 0.067 0.0 0.0 0.069 6.88E-4 0.19 0.1354 0.7071 3178191 Maybridge4_004172 OC(=O)C1C(C2CC1C=C2)C(=O)N3CCc4c([nH]c5ccccc45)C3C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 N15 compound treatment 0.074 0.007 1.8 0.074 0.00569 1.58 2.3944 0.9979 1192815 Maybridge4_004173 O=C(NC(=S)Nc1ccncc1)c2ccccc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 N16 compound treatment 0.072 0.005 1.29 0.07 0.00169 0.47 1.2426 0.9067 3064898 Maybridge4_004174 CS(=O)(=O)N1CCN(CC1)c2ncccc2C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 N17 compound treatment 0.085 0.018 4.63 0.085 0.0167 4.65 6.5632 1.0 1131475 Maybridge4_004175 Clc1ccc(NC(=O)N2CCC(CC2)C(=O)c3ccccc3)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 N18 compound treatment 0.067 0.0 0.0 0.072 0.00369 1.03 0.7262 0.7071 1346023 Maybridge4_004176 Cc1ccc(cc1)S(=O)(=O)NC(=O)Oc2ccc(cc2)c3csnn3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 N19 compound treatment 0.072 0.005 1.29 0.073 0.00469 1.31 1.8334 1.0 3178192 Maybridge4_004177 S=C(SCc1ncon1)N2CCSCC2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 N20 compound treatment 0.093 0.026 6.69 0.093 0.0247 6.88 9.5951 0.9999 3178193 Maybridge4_004178 Cc1ccc(C)n1CCSCc2c(C)cc(C)cc2C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 N21 compound treatment 0.068 0.001 0.26 0.069 6.88E-4 0.19 0.3174 0.9894 1202142 Maybridge4_004179 CCOC(=O)c1c(C)nn(c1C)c2ncccc2NC(=O)CCC(=O)O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 N22 compound treatment 0.072 0.005 1.29 0.073 0.00469 1.31 1.8334 1.0 1591050 Maybridge4_004180 CCOC(=O)c1[nH]c2ccc(cc2c1CCC(=O)O)C(=O)OCC 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 N23 mock treatment 0.062 -0.005 -1.29 0.066 -0.00231 -0.64 -1.3657 -0.9488 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 N24 positive control 0.075 0.008 2.06 0.077 0.00869 2.42 3.1673 0.9968 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 O01 compound treatment 0.078 0.011 2.83 0.079 0.0107 2.98 4.1073 0.9997 3178270 Maybridge4_004181 COc1cc2CCN(Cc2cc1OC)C(=O)c3sc(nc3C)c4cnccn4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 O02 compound treatment 0.063 -0.004 -1.03 0.073 0.00469 1.31 0.1949 0.1172 1317839 Maybridge4_004182 CC(C)(C)c1ccc(s1)C(=O)NN 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 O03 compound treatment 0.11 0.043 11.07 0.125 0.0567 15.79 18.9917 0.9849 3064900 Maybridge4_004183 COc1ccc(cc1)n2ncc(C(=O)Nc3ccc4nccnc4c3)c2C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 O04 compound treatment 0.064 -0.003 -0.77 0.074 0.00569 1.58 0.5738 0.3256 3178271 Maybridge4_004184 N/C(=N/O)/c1cnc2SCCn2c1=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 O05 compound treatment 0.065 -0.002 -0.51 0.072 0.00369 1.03 0.362 0.3151 3178272 Maybridge4_004185 O=C(N1CCSCC1)c2ccc(nc2)N3CCOCC3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 O06 compound treatment 0.101 0.034 8.75 0.104 0.0357 9.94 13.2178 0.998 3064901 Maybridge4_004186 NC(=S)c1ccc(cc1Cl)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 O07 compound treatment 0.117 0.05 12.87 0.123 0.0547 15.23 19.8723 0.9965 3178273 Maybridge4_004187 O=S(=O)(NCc1ccc(cc1)c2cccs2)c3ccc(nc3)N4CCOCC4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 O08 compound treatment 0.778 0.711 183.06 0.832 0.764 212.68 279.8328 0.9972 3064932 Maybridge4_004188 CN(C)c1ccc(/C=C(\C#N)/S(=O)(=O)C)c(F)c1C#N 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 O09 compound treatment 0.065 -0.002 -0.51 0.071 0.00269 0.75 0.1651 0.1818 3178274 Maybridge4_004189 Cc1nn(nc1CNC(=O)c2cccs2)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 O10 compound treatment 0.081 0.014 3.6 0.09 0.0217 6.04 6.8196 0.9696 3178275 Maybridge4_004190 CN(C)c1c(F)cc(cc1F)C(=O)NC(=O)NC2=NCCS2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 O11 compound treatment 0.068 0.001 0.26 0.069 6.88E-4 0.19 0.3174 0.9894 3064933 Maybridge4_004191 Cc1noc(C)c1NC(=O)NCc2ccc3OCOc3c2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 O12 compound treatment 0.07 0.003 0.77 0.071 0.00269 0.75 1.0754 0.9999 3064934 Maybridge4_004192 NNC(=O)c1cc2sccc2s1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 O13 compound treatment 0.155 0.088 22.66 0.165 0.0967 26.93 35.0613 0.9963 3178276 Maybridge4_004193 CSc1nsc(SC)c1C(=O)NC(=O)Nc2ccc(Cl)cc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 O14 compound treatment 0.071 0.004 1.03 0.071 0.00269 0.75 1.2575 0.9877 1408005 Maybridge4_004194 COC(=O)c1c(C)nc(C)c(C(=O)OC)c1c2csc(c2)S(=O)(=O)Nc3ccc(OC)cc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 O15 compound treatment 0.068 0.001 0.26 0.068 -3.12E-4 -0.09 0.1205 0.4434 3064936 Maybridge4_004195 COC(=O)c1sc(cc1CS(=O)(=O)c2ccccn2)C(C)(C)C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 O16 compound treatment 0.221 0.154 39.65 0.258 0.19 52.83 65.3912 0.99 3178277 Maybridge4_004196 COc1ccc(cc1OC)S(=O)(=O)n2nccc2c3ccc(s3)c4cccs4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 O17 compound treatment 0.147 0.08 20.6 0.142 0.0737 20.52 29.0756 1.0 3064939 Maybridge4_004197 Clc1ccc(NC(=S)Nc2ccc(cc2)c3csnn3)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 O18 compound treatment 0.157 0.09 23.17 0.168 0.0997 27.76 36.0162 0.996 3178278 Maybridge4_004198 Clc1cccc(Cl)c1C(=O)NCc2ccc(s2)c3cccs3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 O19 compound treatment 0.066 -0.001 -0.26 0.067 -0.00131 -0.37 -0.4405 -0.9853 3064941 Maybridge4_004199 CNC(=S)N1CCc2sccc2C1C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 O20 compound treatment 0.136 0.069 17.77 0.148 0.0797 22.19 28.2545 0.9939 3178279 Maybridge4_004200 CS/C(=N\C#N)/NCc1sccc1COc2ccc(Cl)cc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 O21 compound treatment 0.072 0.005 1.29 0.081 0.0127 3.53 3.4088 0.9064 1659450 Maybridge4_004201 O=C(NC(=O)c1ccc(cc1)c2csnn2)N3CCCCC3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 O22 compound treatment 0.26 0.193 49.69 0.261 0.193 53.66 73.0823 0.9993 3178280 Maybridge4_004202 CN(C)/C=N\C(=S)c1sccc1CSc2ccc(Cl)cc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 O23 mock treatment 0.065 -0.002 -0.51 0.067 -0.00131 -0.37 -0.6226 -0.9859 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 O24 positive control 0.076 0.009 2.32 0.078 0.00969 2.7 3.5462 0.9971 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 P01 compound treatment 0.172 0.105 27.03 0.171 0.103 28.6 39.3379 0.9996 1411380 Maybridge4_004203 COC(=O)c1cc(=O)n2ccccc2c1C#N 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 P02 compound treatment 0.248 0.181 46.6 0.256 0.188 52.27 69.913 0.9984 3178281 Maybridge4_004204 CN(C)/C=N/C(=S)c1ccc(s1)c2cccs2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 P03 compound treatment 0.098 0.031 7.98 0.113 0.0447 12.45 14.4439 0.9769 3178282 Maybridge4_004205 CCOC(=O)c1c(CS(=O)(=O)Cc2ccc(Cl)cc2)oc3c(F)c(F)c(F)c(F)c13 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 P04 compound treatment 0.068 0.001 0.26 0.076 0.00769 2.14 1.6959 0.7865 1195874 Maybridge4_004206 COc1ccc(CN(Cc2cc(OC)c(OC)c(OC)c2)C(=O)C(C)(C)C)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 P05 compound treatment 0.094 0.027 6.95 0.105 0.0367 10.22 12.1403 0.9824 3178283 Maybridge4_004207 COC(=O)c1sc(c(c1S(=O)(=O)NC(C)(C)C)c2ccccc2)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 P06 compound treatment 0.112 0.045 11.59 0.116 0.0477 13.28 17.5835 0.9977 3064943 Maybridge4_004208 OC1=C(C(=O)c2ccccc12)c3cc(Cl)cc(Cl)c3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 P07 compound treatment 0.824 0.757 194.9 0.835 0.767 213.52 288.7982 0.999 3064944 Maybridge4_004209 CSc1ccc(/C=C\2/C(=NN(C)C2=O)C)s1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 P08 compound treatment 0.068 0.001 0.26 0.073 0.00469 1.31 1.1051 0.8306 1179765 Maybridge4_004210 Cc1noc(C)c1NC(=O)N 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 P09 compound treatment 0.069 0.002 0.51 0.072 0.00369 1.03 1.0903 0.949 3064945 Maybridge4_004211 FC(F)(F)Oc1ccc(NC(=O)C=C)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 P10 compound treatment 0.085 0.018 4.63 0.088 0.0197 5.48 7.154 0.9965 3178284 Maybridge4_004212 CC(C)(C)SCc1cccc(c1)C(=O)N2CCN(CC2)c3ncccc3C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 P11 compound treatment 0.07 0.003 0.77 0.072 0.00369 1.03 1.2723 0.9901 3178285 Maybridge4_004213 OC(=O)c1cccnc1C(=O)N2CCc3c([nH]c4ccccc34)C2C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 P12 compound treatment 0.073 0.006 1.54 0.074 0.00569 1.58 2.2124 0.9999 3178286 Maybridge4_004214 O/N=C/c1ccc(Cl)s1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 P13 compound treatment 0.071 0.004 1.03 0.074 0.00569 1.58 1.8482 0.9783 3178287 Maybridge4_004215 CC(C)(C)NC(=O)N1CCN(CC1)c2cc(ccn2)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 P14 compound treatment 0.072 0.005 1.29 0.071 0.00269 0.75 1.4395 0.9667 3064989 Maybridge4_004216 FC(F)(F)C1N(CCc2c1[nH]c3ccccc23)C(=S)NCC=C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 P15 compound treatment 0.076 0.009 2.32 0.077 0.00869 2.42 3.3493 0.9998 3178288 Maybridge4_004217 CN(C(=S)NC(=O)c1ccccc1)c2ccc(OC(F)(F)F)cc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 P16 compound treatment 0.074 0.007 1.8 0.073 0.00469 1.31 2.1975 0.9875 3064991 Maybridge4_004218 FC(F)(F)c1ccc(nc1)N2CCN(CC2)C(=O)c3ccco3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 P17 compound treatment 0.115 0.048 12.36 0.128 0.0597 16.62 20.4928 0.9893 3178289 Maybridge4_004219 Cc1cc(C)n(n1)c2ccc(cc2)n3cccc3/C=C(/C#N)\S(=O)(=O)c4ccccc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 P18 compound treatment 0.074 0.007 1.8 0.073 0.00469 1.31 2.1975 0.9875 3178290 Maybridge4_004220 OC(=O)CCCC(=O)Nc1ccccc1SCc2noc(n2)c3cccs3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 P19 compound treatment 0.145 0.078 20.08 0.144 0.0757 21.08 29.1053 0.9997 1467411 Maybridge4_004221 Fc1ccc(CSC(=S)N2CCN(CC2)C(=S)SCc3ccc(F)cc3)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 P20 compound treatment 0.075 0.008 2.06 0.102 0.0337 9.38 8.0904 0.8423 3064993 Maybridge4_004222 CC(C)n1nc(cc1C(C)(C)C)C(C)(C)C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 P21 compound treatment 0.074 0.007 1.8 0.073 0.00469 1.31 2.1975 0.9875 3178291 Maybridge4_004223 Cn1nc(c(c1N2C(=O)C3C4CC(C=C4)C3C2=O)c5ccccc5)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 P22 compound treatment 0.107 0.04 10.3 0.112 0.0437 12.17 15.8855 0.9966 3178292 Maybridge4_004224 COC(=O)c1cc(/C=C/C(=O)N(C2CCCCC2)C(=O)NC3CCCCC3)cn1C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 P23 mock treatment 0.068 0.001 0.26 0.069 6.88E-4 0.19 0.3174 0.9894 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2060 P24 positive control 0.079 0.012 3.09 0.079 0.0107 2.98 4.2893 0.9998 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 A01 compound treatment 0.102 0.0326 8.39 0.119 0.0449 12.5 14.7705 0.9813 1382867 Maybridge4_004225 C1Oc2ccc(cc2O1)C3Nc4ccccc4S3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 A02 compound treatment 0.083 0.0136 3.5 0.089 0.0149 4.14 5.4036 0.9965 3064994 Maybridge4_004226 CN(C)C(=O)Oc1nnc(SCc2ccc(C)cc2)n1c3cccc(Cl)c3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 A03 compound treatment 0.141 0.0716 18.43 0.153 0.0789 21.96 28.5662 0.9962 1421127 Maybridge4_004227 Cc1c(cc(c2ccccc2)n1c3ccccc3)C(=O)Nc4ccccc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 A04 compound treatment 0.076 0.0066 1.7 0.081 0.00687 1.91 2.5538 0.9983 3178293 Maybridge4_004228 CC(C)Sc1nnc(OC(=O)N(C)C)n1c2cccc(c2)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 A05 compound treatment 0.121 0.0516 13.29 0.12 0.0459 12.77 18.4265 0.9998 1234864 Maybridge4_004229 N#Cc1ccc(cc1)c2csc(n2)c3ccc(cc3)C4SCCS4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 A06 compound treatment 0.077 0.0076 1.96 0.081 0.00687 1.91 2.7359 0.9999 3178294 Maybridge4_004230 CSc1nnc(O)c2cc(C)nn12 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 A07 compound treatment 0.079 0.0096 2.47 0.082 0.00787 2.19 3.2969 0.9982 3064995 Maybridge4_004231 Cc1ccc(cc1)c2csc(COC(=O)C(C)(C)C)n2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 A08 compound treatment 0.077 0.0076 1.96 0.079 0.00487 1.36 2.342 0.9839 3178295 Maybridge4_004232 Fc1ccc(Cn2ccnc2c3ccc(cc3)C(F)(F)F)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 A09 compound treatment 0.083 0.0136 3.5 0.088 0.0139 3.86 5.2067 0.9988 3064997 Maybridge4_004233 CCn1nc(C)c(Br)c1c2nc(no2)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 A10 compound treatment 0.072 0.0026 0.67 0.074 -1.33E-4 -0.04 0.4471 0.6669 3178296 Maybridge4_004234 Cc1nc(C)c(s1)c2nnc(S)n2c3ccccc3C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 A11 compound treatment 0.087 0.0176 4.53 0.092 0.0179 4.98 6.7226 0.9989 1124397 Maybridge4_004235 Cc1oc(cc1c2cc(N)n(n2)c3ccc(cc3)S(=O)(=O)N)C(C)(C)C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 A12 compound treatment 0.077 0.0076 1.96 0.083 0.00887 2.47 3.1297 0.9934 3064998 Maybridge4_004236 Cn1c(SCc2ccc(cc2)C(F)(F)F)nnc1C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 A13 compound treatment 0.094 0.0246 6.33 0.093 0.0189 5.25 8.194 0.9957 3178384 Maybridge4_004237 Cc1n(CCSCc2c(F)cccc2Cl)c(c3ccccc3)c4cn[nH]c(=O)c14 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 A14 compound treatment 0.072 0.0026 0.67 0.078 0.00387 1.08 1.2348 0.9738 1628717 Maybridge4_004238 NNC(=O)c1csc(Cc2c(Cl)cccc2Cl)n1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 A15 compound treatment 0.083 0.0136 3.5 0.085 0.0109 3.03 4.6159 0.9974 3064999 Maybridge4_004239 CCN(CC)c1cnn(c2ccc(cc2)C(F)(F)F)c(=O)c1Cl 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 A16 compound treatment 0.082 0.0126 3.24 0.084 0.00987 2.75 4.2369 0.9966 1426168 Maybridge4_004240 NNC(=O)c1csc(COc2cc(Cl)cc(Cl)c2)n1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 A17 compound treatment 0.073 0.0036 0.93 0.076 0.00187 0.52 1.023 0.9626 1381395 Maybridge4_004241 COC(=O)c1ccc(o1)S(=O)(=O)NCc2ccco2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 A18 compound treatment 0.07 6.0E-4 0.15 0.073 -0.00113 -0.32 -0.1139 -0.3243 3065000 Maybridge4_004242 CC(C)n1c(S)nc2ccccc12 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 A19 compound treatment 0.103 0.0336 8.65 0.1 0.0259 7.2 11.211 0.9959 3065124 Maybridge4_004243 CC(C)(C)c1nnc(S)[nH]1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 A20 compound treatment 0.183 0.114 29.25 0.171 0.0969 26.98 39.7573 0.9992 1241496 Maybridge4_004244 CC(C)(C)c1ccc(cc1)c2noc(CCn3c(=O)oc4ccccc34)n2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 A21 compound treatment 0.072 0.0026 0.67 0.076 0.00187 0.52 0.8409 0.9922 3178385 Maybridge4_004245 CC(Oc1ccc(Cl)cc1Cl)/C(=N/O)/N 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 A22 compound treatment 0.078 0.0086 2.21 0.082 0.00787 2.19 3.1148 1.0 3178386 Maybridge4_004246 Cc1cc(no1)c2nnc(o2)c3ccc(Cl)cc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 A23 mock treatment 0.075 0.0056 1.44 0.078 0.00387 1.08 1.781 0.9897 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 A24 positive control 0.077 0.0076 1.96 0.08 0.00587 1.63 2.5389 0.996 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 B01 compound treatment 0.122 0.0526 13.54 0.123 0.0489 13.61 19.1993 1.0 3065125 Maybridge4_004247 Cc1nc(sc1C(=O)Sc2ccc(C)cc2)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 B02 compound treatment 0.231 0.162 41.61 0.231 0.157 43.69 60.3116 0.9997 3178387 Maybridge4_004248 CCOC(=O)c1cc2c(NCc3ccc(Cl)cc3Cl)nccc2nc1C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 B03 compound treatment 0.075 0.0056 1.44 0.08 0.00587 1.63 2.1748 0.9981 3065126 Maybridge4_004249 NNC(=O)c1ccc(Oc2cc(Cl)cc(Cl)c2)o1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 B04 compound treatment 0.112 0.0426 10.97 0.115 0.0409 11.38 15.8034 0.9998 3178388 Maybridge4_004250 CCOC(=O)c1cc(on1)c2ccnn2S(=O)(=O)c3cccc(c3)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 B05 compound treatment 0.087 0.0176 4.53 0.092 0.0179 4.98 6.7226 0.9989 1700962 Maybridge4_004251 COC(=O)c1c(C)nn(C(=O)c2ccc(C)cc2)c1c3cc(C)on3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 B06 compound treatment 0.512 0.443 113.96 0.495 0.421 117.21 163.4583 0.9999 3178389 Maybridge4_004252 Cc1nc2ccccn2c1c3ccnc(S)n3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 B07 compound treatment 0.073 0.0036 0.93 0.076 0.00187 0.52 1.023 0.9626 3065128 Maybridge4_004253 Cc1nc(cs1)c2c(C)onc2C(=O)NN 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 B08 compound treatment 0.074 0.0046 1.18 0.079 0.00487 1.36 1.7958 0.9977 3178390 Maybridge4_004254 CC(O)c1cc(no1)c2ccc(Cl)cc2Cl 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 B09 compound treatment 0.079 0.0096 2.47 0.086 0.0119 3.3 4.0846 0.9898 3065129 Maybridge4_004255 CN(C)/C=C/C(=O)c1csc(C)n1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 B10 compound treatment 0.158 0.0886 22.81 0.165 0.0909 25.31 34.0243 0.9987 3065175 Maybridge4_004256 Cc1onc(c1c2ccnn2C(=O)c3ccc(Cl)cc3)c4ccccc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 B11 compound treatment 0.116 0.0466 12.0 0.115 0.0409 11.38 16.5316 0.9997 3178391 Maybridge4_004257 Cc1ccc(cc1)C(=O)Sc2ncc(cc2Cl)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 B12 compound treatment 0.079 0.0096 2.47 0.083 0.00887 2.47 3.4938 1.0 3065177 Maybridge4_004258 COC(OC)c1nc(SCC#N)c(C#N)cc1C(=O)OC 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 B13 compound treatment 0.074 0.0046 1.18 0.076 0.00187 0.52 1.2051 0.9317 3178392 Maybridge4_004259 Cc1nn(C(=O)c2ccc(Cl)cc2)c(C)c1Sc3nnc(n3C)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 B14 compound treatment 0.096 0.0266 6.85 0.101 0.0269 7.48 10.1335 0.999 3065178 Maybridge4_004260 Cc1nccc(n1)c2cc(no2)c3cccc(c3)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 B15 compound treatment 0.103 0.0336 8.65 0.104 0.0299 8.32 11.9987 0.9998 3178393 Maybridge4_004261 FC(F)(F)c1ccc(cc1)n2ccc(=O)c(n2)C(=O)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 B16 compound treatment 0.113 0.0436 11.23 0.106 0.0319 8.87 14.2131 0.9932 3065180 Maybridge4_004262 Cc1noc2ncnc(SCC(=O)Nc3cc(Cl)cc(Cl)c3)c12 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 B17 compound treatment 0.073 0.0036 0.93 0.077 0.00287 0.8 1.2199 0.9972 3178394 Maybridge4_004263 Cn1c(SCC(=O)c2ccccc2)nnc1C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 B18 compound treatment 0.135 0.0656 16.89 0.129 0.0549 15.28 22.7477 0.9988 1443847 Maybridge4_004264 COc1ccc(cc1)c2csc(n2)c3c(C)noc3N(C(=O)C)C(=O)C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 B19 compound treatment 0.074 0.0046 1.18 0.077 0.00287 0.8 1.402 0.9816 3065181 Maybridge4_004265 COCc1nc(SCC(=O)OC)c(C#N)cc1C(=O)OC 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 B20 compound treatment 0.099 0.0296 7.62 0.102 0.0279 7.76 10.8766 1.0 3178395 Maybridge4_004266 Cn1c(SCC(=O)c2ccc(Cl)cc2)nnc1c3ncc(cc3Cl)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 B21 compound treatment 0.071 0.0016 0.41 0.076 0.00187 0.52 0.6589 0.9934 3065182 Maybridge4_004267 Cc1ccc(CSc2cnc(C)nc2C)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 B22 compound treatment 0.166 0.0966 24.87 0.181 0.107 29.76 38.6316 0.996 1614331 Maybridge4_004268 CSc1nc(COc2ccc(cc2)C(C)(C)C)nc(c1C#N)n3cccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 B23 mock treatment 0.071 0.0016 0.41 0.075 8.67E-4 0.24 0.462 0.9676 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 B24 positive control 0.075 0.0056 1.44 0.079 0.00487 1.36 1.9779 0.9995 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 C01 compound treatment 0.193 0.124 31.82 0.206 0.132 36.72 48.4703 0.9975 3065184 Maybridge4_004269 COc1cc(/C=C(\C#N)/c2ccc(C)cc2)cc(OC)c1OC 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 C02 compound treatment 0.107 0.0376 9.68 0.11 0.0359 9.99 13.9084 0.9999 1173149 Maybridge4_004270 CN(C)C(=O)n1c(SCc2ccccc2)nnc1c3ccc(cc3)C(C)(C)C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 C03 compound treatment 0.073 0.0036 0.93 0.08 0.00587 1.63 1.8107 0.9639 3065185 Maybridge4_004271 Cc1c(cc(c2ccccc2)n1CCSc3cc(nc4ccccc34)C(F)(F)F)C(=O)O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 C04 compound treatment 0.074 0.0046 1.18 0.077 0.00287 0.8 1.402 0.9816 3178396 Maybridge4_004272 CN/C(=C(\C(=O)OC)/C(=O)c1ccc(Cl)cc1Cl)/C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 C05 compound treatment 0.078 0.0086 2.21 0.085 0.0109 3.03 3.7056 0.9882 1218418 Maybridge4_004273 CCOC(=O)c1cc(n(c1C)c2ccc(cc2)N3CCOCC3)C(C)(C)C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 C06 compound treatment 0.077 0.0076 1.96 0.086 0.0119 3.3 3.7205 0.9687 3065186 Maybridge4_004274 CCOC(=O)c1cc(C)nn1C(=O)c2c(F)cccc2Cl 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 C07 compound treatment 0.103 0.0336 8.65 0.107 0.0329 9.15 12.5894 0.9996 3178397 Maybridge4_004275 CCOC(=O)Cc1csc(n1)c2ccc(Oc3ccc(cn3)C(F)(F)F)cc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 C08 compound treatment 0.075 0.0056 1.44 0.081 0.00687 1.91 2.3717 0.9903 3065189 Maybridge4_004276 C/N=c/1\scc(C)n1NC(=O)Nc2ccc(Cl)cc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 C09 compound treatment 0.074 0.0046 1.18 0.094 0.0199 5.53 4.7497 0.8395 1159039 Maybridge4_004277 CSCCn1c(C)c(cc1c2ccccc2)C(=O)N3CCCC3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 C10 compound treatment 0.174 0.105 26.93 0.201 0.127 35.33 44.0265 0.991 3178398 Maybridge4_004278 CN(C)/C=N/c1sc(C)c(C)c1C(=O)c2ccc(Cl)cc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 C11 compound treatment 0.144 0.0746 19.21 0.151 0.0769 21.41 28.7185 0.9985 1508854 Maybridge4_004279 Cc1oc(cc1c2cc(N)n(n2)c3ccc(I)cc3)C(C)(C)C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 C12 compound treatment 0.104 0.0346 8.91 0.101 0.0269 7.48 11.5899 0.9962 3178399 Maybridge4_004280 FC(F)(F)c1ccc(CS(=O)(=O)c2ccc(Cl)cc2)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 C13 compound treatment 0.17 0.101 25.9 0.181 0.107 29.76 39.3598 0.9976 3065228 Maybridge4_004281 CCOC(=O)c1c(C)n(c(C)c1S(=O)(=O)Nc2ccc(Cl)cc2)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 C14 compound treatment 0.069 -4.0E-4 -0.1 0.078 0.00387 1.08 0.6886 0.6366 1718696 Maybridge4_004282 NNC(=O)c1csc(CS(=O)(=O)c2ccc(Cl)cc2)n1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 C15 compound treatment 0.073 0.0036 0.93 0.077 0.00287 0.8 1.2199 0.9972 3065230 Maybridge4_004283 Clc1ccc(OCc2nc(CSc3cccs3)no2)c(Cl)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 C16 compound treatment 0.072 0.0026 0.67 0.079 0.00487 1.36 1.4317 0.9471 3178400 Maybridge4_004284 CCOC(=O)c1csc(n1)c2cccs2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 C17 compound treatment 0.076 0.0066 1.7 0.08 0.00587 1.63 2.3569 0.9998 3178401 Maybridge4_004285 OC1(CC(=NN1)/C=C/c2ccc3OCOc3c2)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 C18 compound treatment 0.074 0.0046 1.18 0.077 0.00287 0.8 1.402 0.9816 3065232 Maybridge4_004286 CCn1nc(C)cc1C(=O)Sc2ccccc2Cl 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 C19 compound treatment 0.067 -0.0024 -0.62 0.07 -0.00413 -1.15 -1.2509 -0.9575 3065234 Maybridge4_004287 CC(C)(C)c1nnc(SCC=C)[nH]1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 C20 compound treatment 0.165 0.0956 24.61 0.163 0.0889 24.75 34.9049 1.0 1140041 Maybridge4_004288 CCOC(=O)c1sc(nc1OCc2c(Cl)cccc2Cl)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 C21 compound treatment 0.082 0.0126 3.24 0.082 0.00787 2.19 3.8431 0.9817 3065235 Maybridge4_004289 FC(F)(F)c1cc(cc(c1)C(F)(F)F)c2nc(S)n[nH]2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 C22 compound treatment 0.103 0.0336 8.65 0.11 0.0359 9.99 13.1802 0.9974 3178402 Maybridge4_004290 Oc1nnc(SCc2nnc(o2)c3ccc(Cl)cc3)n1C4CCCCC4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 C23 mock treatment 0.069 -4.0E-4 -0.1 0.073 -0.00113 -0.32 -0.296 -0.8916 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 C24 positive control 0.078 0.0086 2.21 0.079 0.00487 1.36 2.5241 0.9723 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 D01 compound treatment 0.086 0.0166 4.27 0.089 0.0149 4.14 5.9498 0.9999 3178403 Maybridge4_004291 Cc1nc(sc1C(=O)Sc2ccc(Cl)cc2)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 D02 compound treatment 0.077 0.0076 1.96 0.078 0.00387 1.08 2.1451 0.9604 3065236 Maybridge4_004292 ON/C=N\c1nonc1c2cccnc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 D03 compound treatment 0.122 0.0526 13.54 0.118 0.0439 12.22 18.2147 0.9987 3178404 Maybridge4_004293 CC(C)(C)c1nnc(o1)c2ccc(Oc3cc(Cl)cc(Cl)c3)o2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 D04 compound treatment 0.124 0.0546 14.06 0.136 0.0619 17.23 22.1235 0.9949 1440627 Maybridge4_004294 CCOC(=O)c1c(C)noc1c2csc(Nc3c(C)cc(C)cc3C)n2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 D05 compound treatment 0.115 0.0456 11.74 0.122 0.0479 13.33 17.728 0.998 3178405 Maybridge4_004295 FC(F)(F)Oc1ccc(cc1)c2noc(NC(=O)Nc3cccc(Cl)c3)n2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 D06 compound treatment 0.075 0.0056 1.44 0.081 0.00687 1.91 2.3717 0.9903 3065237 Maybridge4_004296 CCOC(=O)c1cc(on1)c2ccnn2S(=O)(=O)c3ccc(C)cc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 D07 compound treatment 0.109 0.0396 10.2 0.115 0.0409 11.38 15.2572 0.9985 3178406 Maybridge4_004297 CC(C)(C)C(=O)CSc1nnc(o1)c2cc(OCC(F)(F)F)ccc2OCC(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 D08 compound treatment 0.175 0.106 27.19 0.168 0.0939 26.14 37.7101 0.9998 1286523 Maybridge4_004298 Clc1cc(Cl)cc(OCc2nc(cs2)c3cc(no3)c4ccccc4)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 D09 compound treatment 0.135 0.0656 16.89 0.156 0.0819 22.8 28.0646 0.9891 3178492 Maybridge4_004299 Cc1cc(no1)c2onc(C)c2C(=O)NC(=O)Nc3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 D10 compound treatment 0.174 0.105 26.93 0.171 0.0969 26.98 38.1188 1.0 3065285 Maybridge4_004300 Cc1onc(c1c2ccnn2S(=O)(=O)c3ccc(Cl)cc3)c4ccccc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 D11 compound treatment 0.073 0.0036 0.93 0.08 0.00587 1.63 1.8107 0.9639 3178493 Maybridge4_004301 Cc1ccc(CSc2ncc(cc2Cl)C(F)(F)F)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 D12 compound treatment 0.616 0.547 140.73 0.592 0.518 144.22 201.4941 0.9999 3065286 Maybridge4_004302 Cc1onc(c1c2ccnc(S)n2)c3ccc(Cl)cc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 D13 compound treatment 0.078 0.0086 2.21 0.094 0.0199 5.53 5.4779 0.9192 3178494 Maybridge4_004303 Cc1cc(no1)C(=O)NN2C3CSC2CS3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 D14 compound treatment 0.068 -0.0014 -0.36 0.087 0.0129 3.58 2.2789 0.6328 3178495 Maybridge4_004304 CC(=O)Nc1nccc(n1)c2cc(no2)c3cccc(c3)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 D15 compound treatment 0.123 0.0536 13.8 0.114 0.0399 11.1 17.6091 0.9942 3065290 Maybridge4_004305 CN(C)C(=O)Oc1nc(nc(C)c1Oc2cccc(c2)C(F)(F)F)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 D16 compound treatment 0.094 0.0246 6.33 0.112 0.0379 10.55 11.9355 0.9703 3178496 Maybridge4_004306 Cc1noc2ncnc(SCc3ccc(Cl)cc3)c12 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 D17 compound treatment 0.076 0.0066 1.7 0.081 0.00687 1.91 2.5538 0.9983 3065291 Maybridge4_004307 Cn1ccnc1SCC(=O)c2ccccc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 D18 compound treatment 0.08 0.0106 2.73 0.08 0.00587 1.63 3.0851 0.9699 1501067 Maybridge4_004308 CCOC(=O)c1cnc(COc2ccc(cc2)C(C)(C)C)nc1O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 D19 compound treatment 0.07 6.0E-4 0.15 0.073 -0.00113 -0.32 -0.1139 -0.3243 3065292 Maybridge4_004309 Cc1c(Sc2ccc(Cl)cc2)cnn1C(=O)Nc3cccc(c3)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 D20 compound treatment 0.07 6.0E-4 0.15 0.075 8.67E-4 0.24 0.2799 0.9768 3178497 Maybridge4_004310 FC(F)(F)c1cnc(c2nnc(SCC#N)n2c3ccc(Cl)cc3)c(Cl)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 D21 compound treatment 0.145 0.0756 19.46 0.15 0.0759 21.13 28.7037 0.9992 3178498 Maybridge4_004311 Cc1ccc(CSc2nc(C)c(Oc3cccc(c3)C(F)(F)F)c(=O)n2C)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 D22 compound treatment 0.069 -4.0E-4 -0.1 0.073 -0.00113 -0.32 -0.296 -0.8916 3065294 Maybridge4_004312 FC(F)(F)C1CCN(CC1)C(=O)Nc2ccc(cc2)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 D23 mock treatment 0.069 -4.0E-4 -0.1 0.074 -1.33E-4 -0.04 -0.0991 -0.905 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 D24 positive control 0.078 0.0086 2.21 0.08 0.00587 1.63 2.721 0.9888 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 E01 compound treatment 0.091 0.0216 5.56 0.098 0.0239 6.65 8.6324 0.9961 3065295 Maybridge4_004313 CSc1scc(N)c1S(=O)(=O)C(C)C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 E02 compound treatment 0.07 6.0E-4 0.15 0.078 0.00387 1.08 0.8707 0.8004 3178499 Maybridge4_004314 Cc1cc(nn1C)C(=O)NN 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 E03 compound treatment 0.077 0.0076 1.96 0.113 0.0389 10.82 9.0375 0.8216 3178500 Maybridge4_004315 Cc1c(cc(c2ccccc2)n1CCSCc3c(F)cccc3Cl)C(=O)O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 E04 compound treatment 0.111 0.0416 10.71 0.126 0.0519 14.44 17.7875 0.9892 3065296 Maybridge4_004316 C(Oc1ccc(cc1)C2SCCS2)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 E05 compound treatment 0.093 0.0236 6.08 0.098 0.0239 6.65 8.9965 0.999 1532983 Maybridge4_004317 Clc1ccc(cc1Cl)c2csc(CC#N)n2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 E06 compound treatment 0.072 0.0026 0.67 0.076 0.00187 0.52 0.8409 0.9922 3178501 Maybridge4_004318 Cc1cc(CSc2cc(C)c(Cl)cc2C)no1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 E07 compound treatment 0.14 0.0706 18.18 0.144 0.0699 19.46 26.6118 0.9994 3178502 Maybridge4_004319 CC(C)OC(=O)Cc1csc(n1)c2ccc(Oc3ccc(cn3)C(F)(F)F)cc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 E08 compound treatment 0.101 0.0316 8.14 0.115 0.0409 11.38 13.8007 0.9865 3065298 Maybridge4_004320 C/N=c/1\scc(C)n1\N=C\c2c(Cl)cccc2Cl 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 E09 compound treatment 0.105 0.0356 9.17 0.108 0.0339 9.43 13.1505 0.9999 1516019 Maybridge4_004321 Cc1noc(C)c1c2nc(no2)c3c(Cl)cccc3Cl 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 E10 compound treatment 0.077 0.0076 1.96 0.081 0.00687 1.91 2.7359 0.9999 1538780 Maybridge4_004322 NNC(=O)Cc1csc(n1)c2cccc(c2)n3cccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 E11 compound treatment 0.159 0.0896 23.07 0.168 0.0939 26.14 34.7971 0.9981 1280770 Maybridge4_004323 Cc1oc(cc1C(=O)N2CCC(O)(CC2)c3ccc(Cl)cc3)c4ccc(Cl)cc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 E12 compound treatment 0.078 0.0086 2.21 0.081 0.00687 1.91 2.9179 0.9973 3065299 Maybridge4_004324 Clc1ccc(cc1)S(=O)(=O)Cc2nc(CSc3ccccn3)cs2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 E13 compound treatment 0.071 0.0016 0.41 0.073 -0.00113 -0.32 0.0681 0.1312 1082796 Maybridge4_004325 CC(C)(C)C(=O)CN1C(=O)c2ccccc2C1=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 E14 compound treatment 0.101 0.0316 8.14 0.097 0.0229 6.37 10.2561 0.9927 1345163 Maybridge4_004326 Clc1cccc(Cl)c1Cc2nc(NC(=O)NN3CCOCC3)cs2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 E15 compound treatment 0.128 0.0586 15.09 0.132 0.0579 16.12 22.064 0.9995 3065350 Maybridge4_004327 FC(F)(F)Oc1ccc(/C=C/C(=O)Nc2ccc3[nH]cc(C#N)c3c2)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 E16 compound treatment 0.071 0.0016 0.41 0.075 8.67E-4 0.24 0.462 0.9676 3178503 Maybridge4_004328 NNC(=O)c1csc(n1)c2cccs2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 E17 compound treatment 0.091 0.0216 5.56 0.097 0.0229 6.37 8.4355 0.9977 3178504 Maybridge4_004329 CC1=CSC2SC(=C(C)C21)C3=NNC(O)(C3)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 E18 compound treatment 0.121 0.0516 13.29 0.131 0.0569 15.84 20.5927 0.9962 3065351 Maybridge4_004330 Cc1nc(COc2cccc(Cl)c2)sc1c3ccnn3C(=O)C=C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 E19 compound treatment 0.072 0.0026 0.67 0.072 -0.00213 -0.59 0.0532 0.0595 3178505 Maybridge4_004331 CC(C)(C)c1nc2scc(c3ccc(Cl)cc3)n2n1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 E20 compound treatment 0.158 0.0886 22.81 0.161 0.0869 24.19 33.2366 0.9996 1595891 Maybridge4_004332 Clc1ccc(SC(=O)CCn2c(=O)oc3ccccc23)c(Cl)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 E21 compound treatment 0.073 0.0036 0.93 0.082 0.00787 2.19 2.2046 0.9267 3178506 Maybridge4_004333 NNC(=O)c1nc(no1)c2ccccc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 E22 compound treatment 0.092 0.0226 5.82 0.096 0.0219 6.09 8.4206 0.9997 3065354 Maybridge4_004334 Cc1nc(cs1)C(=S)N 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 E23 mock treatment 0.069 -4.0E-4 -0.1 0.073 -0.00113 -0.32 -0.296 -0.8916 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 E24 positive control 0.08 0.0106 2.73 0.081 0.00687 1.91 3.282 0.9849 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 F01 compound treatment 0.074 0.0046 1.18 0.081 0.00687 1.91 2.1897 0.9735 1669430 Maybridge4_004335 Cc1c(C(=O)Oc2ccc(Cl)cc2)n(C)oc1=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 F02 compound treatment 0.072 0.0026 0.67 0.079 0.00487 1.36 1.4317 0.9471 1470635 Maybridge4_004336 CCOC(=O)c1cc(on1)c2csc(CS(=O)(=O)C)n2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 F03 compound treatment 0.108 0.0386 9.94 0.119 0.0449 12.5 15.8628 0.9936 3178507 Maybridge4_004337 FC(F)(F)c1ccnc(Oc2ccc(cc2)C3=NCCS3)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 F04 compound treatment 0.072 0.0026 0.67 0.08 0.00587 1.63 1.6286 0.9224 3065356 Maybridge4_004338 Cc1n[nH]c(=O)c2nc(sc12)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 F05 compound treatment 0.114 0.0446 11.48 0.115 0.0409 11.38 16.1675 1.0 3178508 Maybridge4_004339 FC(F)(F)Oc1ccc(cc1)c2noc(NC(=O)NN3CCCCC3)n2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 F06 compound treatment 0.159 0.0896 23.07 0.182 0.108 30.04 37.5541 0.9915 3178509 Maybridge4_004340 Cc1nc2ccccn2c1c3ccnc(SCC(=O)c4ccc(Cl)cc4)n3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 F07 compound treatment 0.074 0.0046 1.18 0.079 0.00487 1.36 1.7958 0.9977 3065357 Maybridge4_004341 Cc1nnsc1c2onc(C)c2C(=O)N 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 F08 compound treatment 0.109 0.0396 10.2 0.116 0.0419 11.66 15.4541 0.9978 3065359 Maybridge4_004342 Cc1nc2ccccn2c1c3ccnn3C(=O)c4ccc(cc4)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 F09 compound treatment 0.195 0.126 32.34 0.195 0.121 33.66 46.6682 0.9998 1733300 Maybridge4_004343 Sc1nccc(n1)c2csc(COc3ccccc3Cl)n2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 F10 compound treatment 0.131 0.0616 15.86 0.156 0.0819 22.8 27.3364 0.9843 3178510 Maybridge4_004344 Cc1onc(c1c2csc(Nc3ccccc3Cl)n2)c4ccccc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 F11 compound treatment 0.072 0.0026 0.67 0.08 0.00587 1.63 1.6286 0.9224 3178511 Maybridge4_004345 COC(=O)c1sccc1NC(=O)C2CCCS2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 F12 compound treatment 0.072 0.0026 0.67 0.077 0.00287 0.8 1.0379 0.9962 3065409 Maybridge4_004346 COC(OC)c1c(cnn1C(=O)Nc2ccccc2)C(=O)OC 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 F13 compound treatment 0.102 0.0326 8.39 0.096 0.0219 6.09 10.2412 0.9876 3178512 Maybridge4_004347 CCOC(=O)c1nn(cc(Sc2nnc(n2C)C(F)(F)F)c1=O)c3ccc(cc3)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 F14 compound treatment 0.108 0.0386 9.94 0.13 0.0559 15.56 18.029 0.9766 3065410 Maybridge4_004348 Cc1cc(no1)c2c(C(=O)Sc3ccccc3)c(C)nn2c4ccccc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 F15 compound treatment 0.084 0.0146 3.76 0.085 0.0109 3.03 4.798 0.9942 3178513 Maybridge4_004349 CN(C)C(=O)Oc1nc(nc(C)c1Oc2ccc(Cl)cc2Cl)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 F16 compound treatment 0.103 0.0336 8.65 0.104 0.0299 8.32 11.9987 0.9998 3065413 Maybridge4_004350 Cc1noc2ncnc(SCc3ccc(cc3)C(F)(F)F)c12 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 F17 compound treatment 0.141 0.0716 18.43 0.152 0.0779 21.69 28.3693 0.9967 1122678 Maybridge4_004351 Cn1ccnc1Sc2cnc(SCc3ccc(Cl)cc3)nc2c4ccccc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 F18 compound treatment 0.071 0.0016 0.41 0.077 0.00287 0.8 0.8558 0.9526 1056664 Maybridge4_004352 NC(=O)COc1ccc(Cl)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 F19 compound treatment 0.131 0.0616 15.86 0.111 0.0369 10.27 18.4748 0.9778 3178514 Maybridge4_004353 COC(OC)c1ccc(C#N)c(SCc2ccc(Cl)cc2)n1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 F20 compound treatment 0.142 0.0726 18.69 0.138 0.0639 17.79 25.7944 0.9997 3065416 Maybridge4_004354 Cc1ccc(/N=C/c2c(Sc3ccc(Cl)cc3)nc4sccn24)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 F21 compound treatment 0.089 0.0196 5.05 0.096 0.0219 6.09 7.8744 0.9956 3178515 Maybridge4_004355 COc1ccc(C/N=C/c2ccnc(SCc3ccc(Cl)cc3Cl)n2)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 F22 compound treatment 0.148 0.0786 20.24 0.152 0.0779 21.69 29.6437 0.9994 1543403 Maybridge4_004356 CC(C)(C)c1ccc(OCc2ncc(c(N)n2)S(=O)(=O)c3ccccc3)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 F23 mock treatment 0.069 -4.0E-4 -0.1 0.073 -0.00113 -0.32 -0.296 -0.8916 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 F24 positive control 0.08 0.0106 2.73 0.08 0.00587 1.63 3.0851 0.9699 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 G01 compound treatment 0.09 0.0206 5.3 0.095 0.0209 5.81 7.8596 0.999 3065419 Maybridge4_004357 CCOC(=O)c1cc(oc1C(F)(F)F)c2ccc(Cl)cc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 G02 compound treatment 0.07 6.0E-4 0.15 0.078 0.00387 1.08 0.8707 0.8004 3178592 Maybridge4_004358 NNC(=O)Cc1csc2nc(nn12)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 G03 compound treatment 0.095 0.0256 6.59 0.105 0.0309 8.6 10.7391 0.9914 1715416 Maybridge4_004359 CCOC(=O)c1cc(c2ccccc2)n(CCNC(=O)OC(C)(C)C)c1C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 G04 compound treatment 0.069 -4.0E-4 -0.1 0.074 -1.33E-4 -0.04 -0.0991 -0.905 3178593 Maybridge4_004360 Cc1n[nH]c(c2cccs2)c1C(=O)NN 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 G05 compound treatment 0.077 0.0076 1.96 0.085 0.0109 3.03 3.5236 0.9777 1728275 Maybridge4_004361 Cc1ccc(cc1)c2csc(CS(=O)(=O)C(C)(C)C)n2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 G06 compound treatment 0.079 0.0096 2.47 0.087 0.0129 3.58 4.2815 0.9836 3178594 Maybridge4_004362 NNC(=O)c1cc(CSc2ccc(Cl)cc2)on1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 G07 compound treatment 0.077 0.0076 1.96 0.083 0.00887 2.47 3.1297 0.9934 1526465 Maybridge4_004363 CC(C)(C)S(=O)(=O)Cc1nc(cs1)c2cccc(F)c2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 G08 compound treatment 0.158 0.0886 22.81 0.15 0.0759 21.13 31.0704 0.9993 3065422 Maybridge4_004364 Clc1ccc(CSc2ncc([nH]2)c3ccc(Cl)cc3)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 G09 compound treatment 0.072 0.0026 0.67 0.084 0.00987 2.75 2.4163 0.8544 1241834 Maybridge4_004365 Fc1ccc(CS(=O)(=O)Cc2noc(n2)c3ccno3)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 G10 compound treatment 0.066 -0.0034 -0.88 0.077 0.00287 0.8 -0.0545 -0.046 3064623 Maybridge4_004366 Cc1ccc(cc1)C(=O)CSc2nc(n[nH]2)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 G11 compound treatment 0.137 0.0676 17.4 0.147 0.0729 20.29 26.6564 0.9971 3178595 Maybridge4_004367 Fc1ccc2[nH]c3CN(CCc3c2c1)S(=O)(=O)c4ccc(s4)c5cc(on5)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 G12 compound treatment 0.195 0.126 32.34 0.201 0.127 35.33 47.8498 0.999 3064626 Maybridge4_004368 CCOC(=O)c1sc(SCC(=O)c2ccc(Cl)cc2Cl)nc1C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 G13 compound treatment 0.139 0.0696 17.92 0.139 0.0649 18.06 25.4451 1.0 1519116 Maybridge4_004369 CCOC(=O)c1c(C)n(c(c1S(=O)(=O)NCc2ccccc2)c3ccccc3)c4ccccc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 G14 compound treatment 0.067 -0.0024 -0.62 0.076 0.00187 0.52 -0.0693 -0.0859 3064627 Maybridge4_004370 N/C(=N\O)/CS(=O)(=O)Cc1ccc(F)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 G15 compound treatment 0.069 -4.0E-4 -0.1 0.073 -0.00113 -0.32 -0.296 -0.8916 3178596 Maybridge4_004371 OC1(CC(=NN1)C2(CC3CC4CC(C3)C2)C4)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 G16 compound treatment 0.069 -4.0E-4 -0.1 0.075 8.67E-4 0.24 0.0978 0.3729 3064629 Maybridge4_004372 Cc1nc(CSc2nnc([nH]2)C(C)(C)C)cs1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 G17 compound treatment 0.072 0.0026 0.67 0.077 0.00287 0.8 1.0379 0.9962 3178597 Maybridge4_004373 CN1N=C(CC1(O)C(F)(F)F)c2coc3ccccc23 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 G18 compound treatment 0.072 0.0026 0.67 0.076 0.00187 0.52 0.8409 0.9922 1698546 Maybridge4_004374 CC(C)n1c(SCC(=O)O)nc2cc(Cl)ccc12 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 G19 compound treatment 0.07 6.0E-4 0.15 0.075 8.67E-4 0.24 0.2799 0.9768 2121946 Maybridge4_004375 FC(F)(F)c1n[nH]c(SCc2ccc(Cl)cc2)n1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 G20 compound treatment 0.084 0.0146 3.76 0.084 0.00987 2.75 4.601 0.9881 3064630 Maybridge4_004376 FC(F)(F)c1ccc(SC(=O)CCn2c(=O)oc3ccccc23)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 G21 compound treatment 0.071 0.0016 0.41 0.073 -0.00113 -0.32 0.0681 0.1312 3178598 Maybridge4_004377 CSc1nc(nn1C(=O)N(C)C)c2ccc(Cl)cc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 G22 compound treatment 0.067 -0.0024 -0.62 0.072 -0.00213 -0.59 -0.857 -0.9998 1190557 Maybridge4_004378 Fc1ccc(cc1)n2ccc(=O)c(n2)c3cc[nH]n3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 G23 mock treatment 0.068 -0.0014 -0.36 0.075 8.67E-4 0.24 -0.0842 -0.1941 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 G24 positive control 0.08 0.0106 2.73 0.081 0.00687 1.91 3.282 0.9849 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 H01 compound treatment 0.102 0.0326 8.39 0.119 0.0449 12.5 14.7705 0.9813 3178599 Maybridge4_004379 FC(F)(F)c1ccc(Cn2c(=O)oc3ccccc23)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 H02 compound treatment 0.099 0.0296 7.62 0.109 0.0349 9.71 12.2551 0.9928 3178600 Maybridge4_004380 FC(F)(F)c1ccc(cc1)c2nc(cs2)C(=O)/C=C/N3CCOCC3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 H03 compound treatment 0.07 6.0E-4 0.15 0.077 0.00287 0.8 0.6738 0.8286 1643215 Maybridge4_004381 Cc1cc(C(=O)NN)n(n1)C(C)(C)C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 H04 compound treatment 0.07 6.0E-4 0.15 0.075 8.67E-4 0.24 0.2799 0.9768 3064634 Maybridge4_004382 Cc1nc2c(=O)n(nc(C)c2s1)c3cc(ccc3Cl)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 H05 compound treatment 0.072 0.0026 0.67 0.077 0.00287 0.8 1.0379 0.9962 3178601 Maybridge4_004383 Cc1nc(nc(O)c1Cl)c2ccccc2OC(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 H06 compound treatment 0.11 0.0406 10.45 0.114 0.0399 11.1 15.2423 0.9995 3178602 Maybridge4_004384 Cc1nc2ccccn2c1c3ccnc(SCC(=O)c4cccc(c4)C(F)(F)F)n3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 H07 compound treatment 0.074 0.0046 1.18 0.083 0.00887 2.47 2.5835 0.9434 3064670 Maybridge4_004385 CC(C)(C)c1csc(n1)c2ccc(OC(F)(F)F)cc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 H08 compound treatment 0.078 0.0086 2.21 0.083 0.00887 2.47 3.3118 0.9985 1738969 Maybridge4_004386 Cc1nc2ccccn2c1c3ccnn3C(=O)c4ccc(Cl)cc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 H09 compound treatment 0.074 0.0046 1.18 0.082 0.00787 2.19 2.3866 0.9583 3064672 Maybridge4_004387 CCOC(=O)c1c(Sc2ccccc2)cnn1C(=O)c3ccc(cc3)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 H10 compound treatment 0.096 0.0266 6.85 0.103 0.0289 8.04 10.5273 0.9968 3178603 Maybridge4_004388 O=C(c1ccno1)n2nccc2c3cc(no3)c4ccccc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 H11 compound treatment 0.117 0.0476 12.26 0.125 0.0509 14.17 18.6829 0.9974 3064674 Maybridge4_004389 CCOC(=O)c1[nH]ncc1Sc2ccc(Cl)cc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 H12 compound treatment 0.075 0.0056 1.44 0.08 0.00587 1.63 2.1748 0.9981 3178604 Maybridge4_004390 CCOC(=O)c1cc(nn1C(=O)C)c2ccc(Cl)s2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 H13 compound treatment 0.107 0.0376 9.68 0.108 0.0339 9.43 13.5146 0.9999 1154209 Maybridge4_004391 CCOC(=O)c1nn(cc(Sc2ccc(Cl)cc2)c1=O)c3cccc(Cl)c3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 H14 compound treatment 0.071 0.0016 0.41 0.077 0.00287 0.8 0.8558 0.9526 3064675 Maybridge4_004392 Cc1cc(no1)c2nc(cs2)c3ccnn3C(=O)Nc4cccc(Cl)c4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 H15 compound treatment 0.071 0.0016 0.41 0.075 8.67E-4 0.24 0.462 0.9676 1612205 Maybridge4_004393 Cc1nc(C)c(Oc2ccc(Cl)cc2Cl)c(n1)N3CCCCC3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 H16 compound treatment 0.073 0.0036 0.93 0.077 0.00287 0.8 1.2199 0.9972 3064677 Maybridge4_004394 Cc1nc(nc(Sc2ccccc2Cl)c1Oc3ccccc3)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 H17 compound treatment 0.135 0.0656 16.89 0.14 0.0659 18.34 24.9138 0.9992 1277240 Maybridge4_004395 Cn1ccnc1Sc2cnc(SCC(=O)c3ccc(Cl)cc3)nc2c4ccccc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 H18 compound treatment 0.079 0.0096 2.47 0.085 0.0109 3.03 3.8877 0.995 3178605 Maybridge4_004396 COC(OC)c1nc(SCC(=O)Nc2ccc(cc2)C(C)C)ncc1C(=O)O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 H19 compound treatment 0.071 0.0016 0.41 0.076 0.00187 0.52 0.6589 0.9934 1575021 Maybridge4_004397 Cc1onc2c(=O)n(nc(C)c12)c3ccc(C)cc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 H20 compound treatment 0.095 0.0256 6.59 0.092 0.0179 4.98 8.1791 0.9904 1613403 Maybridge4_004398 CCOC(=O)c1cnc(nc1Nc2ccc(C)cc2)c3cccs3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 H21 compound treatment 0.149 0.0796 20.49 0.157 0.0829 23.08 30.8104 0.9982 3178606 Maybridge4_004399 COc1ccccc1CC/N=C/c2ccnc(SCc3ccc(Cl)cc3Cl)n2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 H22 compound treatment 0.153 0.0836 21.52 0.16 0.0859 23.91 32.1294 0.9986 3064678 Maybridge4_004400 FC(F)(F)COc1ccc(cn1)c2nc(cs2)c3ccc(Cl)cc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 H23 mock treatment 0.068 -0.0014 -0.36 0.076 0.00187 0.52 0.1127 0.1782 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 H24 positive control 0.081 0.0116 2.99 0.081 0.00687 1.91 3.4641 0.9768 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 I01 compound treatment 0.167 0.0976 25.13 0.174 0.0999 27.81 37.4352 0.9987 1124762 Maybridge4_004401 Cc1oc(cc1COC(=O)Nc2ccccc2)c3ccc(Cl)cc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 I02 compound treatment 0.095 0.0256 6.59 0.111 0.0369 10.27 11.9207 0.977 3064679 Maybridge4_004402 Oc1nnc(SCC=C)n1c2ccc(Cl)cc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 I03 compound treatment 0.073 0.0036 0.93 0.08 0.00587 1.63 1.8107 0.9639 3178607 Maybridge4_004403 Cc1ccc(cc1)c2csc(n2)c3ccc(cc3)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 I04 compound treatment 0.21 0.141 36.2 0.212 0.138 38.4 52.7468 0.9996 3178608 Maybridge4_004404 O=C(Oc1ccc2ccccc2c1C3SCCS3)c4cccs4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 I05 compound treatment 0.078 0.0086 2.21 0.084 0.00987 2.75 3.5087 0.9943 3064680 Maybridge4_004405 Fc1cccc(c1)c2csc(COc3ccccc3Cl)n2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 I06 compound treatment 0.073 0.0036 0.93 0.077 0.00287 0.8 1.2199 0.9972 3064719 Maybridge4_004406 CCOC(=O)c1cc(COc2c(Cl)cccc2Cl)on1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 I07 compound treatment 0.078 0.0086 2.21 0.076 0.00187 0.52 1.9333 0.85 1539274 Maybridge4_004407 COc1ccc(cc1OC)c2nc(CS(=O)(=O)c3ccc(F)cc3)no2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 I08 compound treatment 0.071 0.0016 0.41 0.075 8.67E-4 0.24 0.462 0.9676 3064721 Maybridge4_004408 COC(=O)c1c(C)n[nH]c1c2snnc2C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 I09 compound treatment 0.156 0.0866 22.3 0.159 0.0849 23.63 32.4786 0.9996 3178609 Maybridge4_004409 Cc1c(cc(c2ccccc2)n1CCSCc3c(F)cccc3Cl)C(=O)NCc4ccco4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 I10 compound treatment 0.069 -4.0E-4 -0.1 0.074 -1.33E-4 -0.04 -0.0991 -0.905 3064722 Maybridge4_004410 FC(F)(F)c1ccccc1c2ncc(o2)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 I11 compound treatment 0.08 0.0106 2.73 0.087 0.0129 3.58 4.4636 0.991 3178610 Maybridge4_004411 COC(=O)C1SCCN1S(=O)(=O)c2ccc(s2)c3cc(on3)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 I12 compound treatment 0.172 0.103 26.42 0.166 0.0919 25.58 36.77 0.9999 3064724 Maybridge4_004412 CCOC(=O)c1sc(COc2ccc(cc2)C3SCCS3)nc1C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 I13 compound treatment 0.142 0.0726 18.69 0.113 0.0389 10.82 20.8713 0.9663 3178611 Maybridge4_004413 CCOC(=O)c1c(C)oc(c1S(=O)(=O)NCc2ccccc2)c3ccc(Cl)cc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 I14 compound treatment 0.126 0.0566 14.57 0.125 0.0509 14.17 20.3214 0.9999 1359873 Maybridge4_004414 CCOC(=O)c1sc(COc2ccc(cc2)C(C)(C)C)nc1C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 I15 compound treatment 0.067 -0.0024 -0.62 0.073 -0.00113 -0.32 -0.6601 -0.9514 1719811 Maybridge4_004415 COC(=O)c1cc(oc1C)S(=O)(=O)N2CCOCC2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 I16 compound treatment 0.163 0.0936 24.1 0.161 0.0869 24.19 34.1469 1.0 3064726 Maybridge4_004416 Fc1ccc(NC(=O)Nc2csc(n2)c3cccs3)c(F)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 I17 compound treatment 0.072 0.0026 0.67 0.076 0.00187 0.52 0.8409 0.9922 3178696 Maybridge4_004417 CCOC(=O)c1cc(C)nc(Sc2ccccn2)c1C#N 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 I18 compound treatment 0.07 6.0E-4 0.15 0.074 -1.33E-4 -0.04 0.083 0.5223 1015446 Maybridge4_004418 NNS(=O)(=O)c1ccc(Cl)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 I19 compound treatment 0.071 0.0016 0.41 0.075 8.67E-4 0.24 0.462 0.9676 3178697 Maybridge4_004419 CSc1nnc(c2ccc(cc2)C(C)(C)C)n1C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 I20 compound treatment 0.155 0.0856 22.04 0.152 0.0779 21.69 30.9181 1.0 3064729 Maybridge4_004420 CC(C)n1c(SCC(=O)c2ccc(C)cc2)nc3cc(ccc13)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 I21 compound treatment 0.068 -0.0014 -0.36 0.083 0.00887 2.47 1.4912 0.5976 3178698 Maybridge4_004421 CSc1n[nH]c(=O)n1C2CCCCC2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 I22 compound treatment 0.322 0.253 65.04 0.314 0.24 66.8 93.2237 0.9999 1629116 Maybridge4_004422 Fc1ccc(cc1)n2ccc(=O)c(n2)c3ccnc(S)n3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 I23 mock treatment 0.068 -0.0014 -0.36 0.074 -1.33E-4 -0.04 -0.2811 -0.7758 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 I24 positive control 0.08 0.0106 2.73 0.083 0.00887 2.47 3.6759 0.9988 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 J01 compound treatment 0.136 0.0666 17.15 0.137 0.0629 17.51 24.5051 0.9999 3064730 Maybridge4_004423 Cc1cc(C)c(C#N)c(SCc2nc(no2)c3ccc(OC(F)(F)F)cc3)n1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 J02 compound treatment 0.07 6.0E-4 0.15 0.076 0.00187 0.52 0.4768 0.8792 3178699 Maybridge4_004424 COC(=O)c1noc(C)c1C(=O)/C=C/N2CCCCC2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 J03 compound treatment 0.07 6.0E-4 0.15 0.076 0.00187 0.52 0.4768 0.8792 1578491 Maybridge4_004425 CC(C)(C)c1cc(no1)C(=O)NN 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 J04 compound treatment 0.074 0.0046 1.18 0.075 8.67E-4 0.24 1.0081 0.8341 1270914 Maybridge4_004426 Cc1cc(no1)c2nc(cs2)C(=O)N3CCCCC3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 J05 compound treatment 0.084 0.0146 3.76 0.089 0.0149 4.14 5.5857 0.9988 1517245 Maybridge4_004427 CN(C)C(=O)c1noc(C)c1c2cc[nH]c(=S)n2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 J06 compound treatment 0.102 0.0326 8.39 0.106 0.0319 8.87 12.2105 0.9996 1241417 Maybridge4_004428 CC(C)c1ccc(NC(=O)CSc2nccc(n2)c3c(C)nc4ccccn34)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 J07 compound treatment 0.09 0.0206 5.3 0.091 0.0169 4.7 7.0719 0.9982 3064781 Maybridge4_004429 FC(F)(F)Oc1ccccc1c2nnc(o2)c3ccccc3Cl 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 J08 compound treatment 0.072 0.0026 0.67 0.077 0.00287 0.8 1.0379 0.9962 1319855 Maybridge4_004430 Cc1nc2ccccn2c1c3ccnn3C(=O)c4ccno4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 J09 compound treatment 0.162 0.0926 23.84 0.154 0.0799 22.24 32.5864 0.9994 3178700 Maybridge4_004431 Clc1ccccc1OCc2nc(cs2)c3ccnc(SCC(=O)c4ccccc4)n3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 J10 compound treatment 0.104 0.0346 8.91 0.101 0.0269 7.48 11.5899 0.9962 3178701 Maybridge4_004432 FC(F)(F)c1ccc(cc1)S(=O)(=O)n2nccc2c3cc(no3)c4ccccc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 J11 compound treatment 0.069 -4.0E-4 -0.1 0.073 -0.00113 -0.32 -0.296 -0.8916 3064782 Maybridge4_004433 FC(F)(F)c1cccnc1SCc2ccc(Cl)cc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 J12 compound treatment 0.148 0.0786 20.24 0.147 0.0729 20.29 28.6591 1.0 1133437 Maybridge4_004434 COC(OC)c1nc2sc(C(=O)OC)c(N)c2cc1C(=O)OC 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 J13 compound treatment 0.073 0.0036 0.93 0.079 0.00487 1.36 1.6138 0.9828 3178702 Maybridge4_004435 CN(C)/C=C(\Sc1ccc(cn1)C(F)(F)F)/C(=O)c2ccc(C)cc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 J14 compound treatment 0.13 0.0606 15.6 0.118 0.0439 12.22 19.6712 0.9927 3178703 Maybridge4_004436 Cc1cc(no1)c2nc(cs2)c3ccnn3S(=O)(=O)c4cccc(c4)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 J15 compound treatment 0.077 0.0076 1.96 0.076 0.00187 0.52 1.7512 0.865 3064785 Maybridge4_004437 Cc1nc(C)c(Oc2ccc(Cl)cc2Cl)c(O)n1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 J16 compound treatment 0.069 -4.0E-4 -0.1 0.076 0.00187 0.52 0.2948 0.5562 3064786 Maybridge4_004438 COC(=O)c1c(C)nn(c1c2snnc2C)c3ccc(OC(F)(F)F)cc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 J17 compound treatment 0.074 0.0046 1.18 0.078 0.00387 1.08 1.5989 0.9989 3178704 Maybridge4_004439 Cc1cc(no1)c2noc(n2)c3cc(C)on3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 J18 compound treatment 0.071 0.0016 0.41 0.078 0.00387 1.08 1.0527 0.9131 3064787 Maybridge4_004440 CSc1[nH]c(=O)[nH]c(=O)c1C#N 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 J19 compound treatment 0.135 0.0656 16.89 0.139 0.0649 18.06 24.7169 0.9994 3178705 Maybridge4_004441 O/N=C/c1ccnc(SCc2ccc(Cl)cc2)n1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 J20 compound treatment 0.087 0.0176 4.53 0.094 0.0199 5.53 7.1165 0.9951 1443040 Maybridge4_004442 CCOC(=O)c1cnc(nc1Nc2ccc(Cl)cc2)c3cccs3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 J21 compound treatment 0.068 -0.0014 -0.36 0.107 0.0329 9.15 6.2174 0.6787 1496600 Maybridge4_004443 CN(C)C(=O)Oc1nc(NC(=O)C)nc(C)c1Oc2ccccc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 J22 compound treatment 0.118 0.0486 12.51 0.14 0.0659 18.34 21.8188 0.9826 1705322 Maybridge4_004444 Cc1nc(COc2ccc(cc2)C(C)(C)C)ncc1S(=O)(=O)c3ccc(Cl)cc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 J23 mock treatment 0.068 -0.0014 -0.36 0.103 0.0289 8.04 5.4297 0.6747 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 J24 positive control 0.078 0.0086 2.21 0.106 0.0319 8.87 7.841 0.8573 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 K01 compound treatment 0.128 0.0586 15.09 0.136 0.0619 17.23 22.8517 0.9978 3064790 Maybridge4_004445 FC(F)(F)c1oc(cc1COC(=O)Nc2ccccc2)c3ccc(Cl)cc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 K02 compound treatment 0.07 6.0E-4 0.15 0.076 0.00187 0.52 0.4768 0.8792 3178706 Maybridge4_004446 CSc1nnc(c2ccc(cc2)C(C)(C)C)n1Cc3ccco3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 K03 compound treatment 0.137 0.0676 17.4 0.141 0.0669 18.62 25.4749 0.9994 3064791 Maybridge4_004447 FC(F)(F)c1ccc(cc1)c2nc(cs2)c3ccc(C#N)cc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 K04 compound treatment 0.084 0.0146 3.76 0.09 0.0159 4.42 5.7826 0.9968 3065620 Maybridge4_004448 CC(C)(C)c1nnc(SCc2nc(no2)c3cccc(c3)n4cccc4)[nH]1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 K05 compound treatment 0.114 0.0446 11.48 0.12 0.0459 12.77 17.1521 0.9986 3065621 Maybridge4_004449 FC(F)(F)c1ccc(cc1)c2csc(CS(=O)(=O)Cc3cccc(c3)C(F)(F)F)n2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 K06 compound treatment 0.076 0.0066 1.7 0.078 0.00387 1.08 1.963 0.9758 3065622 Maybridge4_004450 NNC(=O)c1cc(COc2c(Cl)cccc2Cl)on1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 K07 compound treatment 0.108 0.0386 9.94 0.123 0.0489 13.61 16.6505 0.9881 1292280 Maybridge4_004451 CC1(C)CCC(C)(C)c2cc(ccc21)c3csc(CC#N)n3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 K08 compound treatment 0.11 0.0406 10.45 0.123 0.0489 13.61 17.0146 0.9915 3065623 Maybridge4_004452 COC(=O)c1c(C)nn(C(=O)c2cccs2)c1c3snnc3C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 K09 compound treatment 0.135 0.0656 16.89 0.128 0.0539 15.0 22.5507 0.9983 3065624 Maybridge4_004453 Cc1ccc(NC(=O)c2cc3cc(OC(F)(F)F)ccc3[nH]2)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 K10 compound treatment 0.07 6.0E-4 0.15 0.075 8.67E-4 0.24 0.2799 0.9768 3065625 Maybridge4_004454 Clc1cc(Cl)cc(OCc2nn[nH]n2)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 K11 compound treatment 0.067 -0.0024 -0.62 0.072 -0.00213 -0.59 -0.857 -0.9998 3178707 Maybridge4_004455 CC1(C)C(NS(=O)(=O)c2ccc(s2)c3cc(on3)C(F)(F)F)[C@@]4(C)CCC1C4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 K12 compound treatment 0.065 -0.0044 -1.13 0.067 -0.00713 -1.99 -2.2058 -0.9645 3065626 Maybridge4_004456 Oc1nnc(S)n1Cc2ccccc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 K13 compound treatment 0.161 0.0916 23.58 0.162 0.0879 24.47 33.9797 0.9998 1404401 Maybridge4_004457 Cc1cc(C)c2cc([nH]c2c1)C(=O)Nc3ccccc3Cl 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 K14 compound treatment 0.077 0.0076 1.96 0.085 0.0109 3.03 3.5236 0.9777 1365668 Maybridge4_004458 Cc1nc(COc2ccc(cc2)C(C)(C)C)sc1C(=O)NN 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 K15 compound treatment 0.076 0.0066 1.7 0.081 0.00687 1.91 2.5538 0.9983 3065627 Maybridge4_004459 Cc1c(sc2ccccc12)C3=NNC(O)(C3)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 K16 compound treatment 0.217 0.148 38.0 0.208 0.134 37.28 53.2335 1.0 1324032 Maybridge4_004460 NC(=S)CS(=O)(=O)c1ccccn1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 K17 compound treatment 0.07 6.0E-4 0.15 0.075 8.67E-4 0.24 0.2799 0.9768 1539758 Maybridge4_004461 CN(C)C(=O)Nc1c(C)onc1c2c(Cl)cccc2Cl 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 K18 compound treatment 0.09 0.0206 5.3 0.089 0.0149 4.14 6.678 0.9925 3065628 Maybridge4_004462 CCOC(=O)CSc1nc2cc(Cl)c(Cl)cc2n1CC 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 K19 compound treatment 0.074 0.0046 1.18 0.08 0.00587 1.63 1.9928 0.9875 1230780 Maybridge4_004463 Cc1cc(NC(=O)NN2CCOCC2)nn1c3c(Cl)cccc3Cl 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 K20 compound treatment 0.137 0.0676 17.4 0.138 0.0639 17.79 24.8841 0.9999 3065629 Maybridge4_004464 CCOC(=O)c1sc(nc1OC(=O)c2ccc(cc2)C(F)(F)F)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 K21 compound treatment 0.099 0.0296 7.62 0.107 0.0329 9.15 11.8612 0.9959 3178708 Maybridge4_004465 Clc1cccc(c1)n2c(SCC=C)n[nH]c2=O 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 K22 compound treatment 0.067 -0.0024 -0.62 0.073 -0.00113 -0.32 -0.6601 -0.9514 3065630 Maybridge4_004466 NNC(=O)Cc1cc(Br)sc1Br 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 K23 mock treatment 0.068 -0.0014 -0.36 0.075 8.67E-4 0.24 -0.0842 -0.1941 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 K24 positive control 0.078 0.0086 2.21 0.087 0.0129 3.58 4.0995 0.9732 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 L01 compound treatment 0.132 0.0626 16.12 0.138 0.0639 17.79 23.9738 0.9988 3178709 Maybridge4_004467 CC(C)(C)c1cc(C(=O)Oc2ccc(Cl)cc2)n(Cc3ccccc3)n1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 L02 compound treatment 0.304 0.235 60.4 0.298 0.224 62.35 86.7959 0.9999 3065631 Maybridge4_004468 CCOC(=O)c1cc(on1)C(=O)/C=C/N(C)C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 L03 compound treatment 0.1 0.0306 7.88 0.112 0.0379 10.55 13.0279 0.9897 3178710 Maybridge4_004469 Cc1cc(no1)c2nnc(o2)c3cccc(c3)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 L04 compound treatment 0.076 0.0066 1.7 0.08 0.00587 1.63 2.3569 0.9998 3178711 Maybridge4_004470 CCOC(=O)c1nc(C)sc1c2ccnn2S(=O)(=O)c3ccccc3C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 L05 compound treatment 0.072 0.0026 0.67 0.078 0.00387 1.08 1.2348 0.9738 1698871 Maybridge4_004471 O=C(Nc1ccno1)N2CCOCC2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 L06 compound treatment 0.071 0.0016 0.41 0.069 -0.00513 -1.43 -0.7196 -0.4837 3065632 Maybridge4_004472 COC(Cn1c(S)nnc1c2ccccc2)OC 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 L07 compound treatment 0.091 0.0216 5.56 0.092 0.0179 4.98 7.4509 0.9985 3178712 Maybridge4_004473 FC(F)(F)Oc1ccc(cc1)c2nnc(o2)c3cccnc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 L08 compound treatment 0.084 0.0146 3.76 0.088 0.0139 3.86 5.3887 0.9999 3178713 Maybridge4_004474 COC(Cn1c(SCC(=O)c2cccc(c2)C(F)(F)F)nnc1c3ccc(Cl)cc3)OC 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 L09 compound treatment 0.078 0.0086 2.21 0.079 0.00487 1.36 2.5241 0.9723 3065633 Maybridge4_004475 CCOC(=O)c1c(Sc2ccccc2)cnn1C(=O)Nc3cccc(Cl)c3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 L10 compound treatment 0.082 0.0126 3.24 0.087 0.0129 3.58 4.8277 0.9988 3178714 Maybridge4_004476 COC(Cn1c(SCC(=O)Nc2cc(Cl)cc(Cl)c2)nnc1c3ccccc3)OC 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 L11 compound treatment 0.068 -0.0014 -0.36 0.074 -1.33E-4 -0.04 -0.2811 -0.7758 3065634 Maybridge4_004477 Cc1ccc(CSc2ncccc2C(F)(F)F)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 L12 compound treatment 0.094 0.0246 6.33 0.104 0.0299 8.32 10.3601 0.991 3065635 Maybridge4_004478 CSc1nccc(n1)c2c(C)onc2c3ccc(Cl)cc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 L13 compound treatment 0.068 -0.0014 -0.36 0.074 -1.33E-4 -0.04 -0.2811 -0.7758 1231547 Maybridge4_004479 Cc1nccc(n1)c2nn(ccc2=O)c3ccc(F)cc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 L14 compound treatment 0.151 0.0816 21.01 0.164 0.0899 25.03 32.553 0.9962 3178715 Maybridge4_004480 Cc1cc(no1)c2nc(C)c(s2)c3nnc(SCC(=O)Nc4ccccc4)n3C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 L15 compound treatment 0.068 -0.0014 -0.36 0.073 -0.00113 -0.32 -0.4781 -0.9978 1650913 Maybridge4_004481 CN(C)C(=O)Oc1nc(C)nc(C)c1Oc2ccc(C)cc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 L16 compound treatment 0.066 -0.0034 -0.88 0.076 0.00187 0.52 -0.2514 -0.2469 3178716 Maybridge4_004482 Cc1c(sc2nc(nn12)c3ccc(Cl)cc3)C(=O)Oc4ccc(C)cc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 L17 compound treatment 0.07 6.0E-4 0.15 0.076 0.00187 0.52 0.4768 0.8792 3065636 Maybridge4_004483 Cc1cc(no1)c2noc(n2)c3snnc3C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 L18 compound treatment 0.071 0.0016 0.41 0.075 8.67E-4 0.24 0.462 0.9676 1687470 Maybridge4_004484 O=c1[nH]c(Nc2ccccc2)c(C#N)c(=O)[nH]1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 L19 compound treatment 0.104 0.0346 8.91 0.098 0.0239 6.65 10.9992 0.9896 3178791 Maybridge4_004485 COC(OC)c1ccc(C#N)c(SCc2ccc(C)cc2)n1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 L20 compound treatment 0.109 0.0396 10.2 0.121 0.0469 13.05 16.4387 0.9925 1451924 Maybridge4_004486 CSc1nc(COc2ccc(cc2)C(C)(C)C)nc(N)c1C#N 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 L21 compound treatment 0.089 0.0196 5.05 0.09 0.0159 4.42 6.6929 0.9978 3065637 Maybridge4_004487 FC(F)(F)c1cnc(S)c(c1)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 L22 compound treatment 0.23 0.161 41.35 0.21 0.136 37.84 55.9941 0.999 3178792 Maybridge4_004488 CCOC(=O)CSc1nc2sccn2c1/C=N/c3cc(Cl)cc(Cl)c3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 L23 mock treatment 0.071 0.0016 0.41 0.073 -0.00113 -0.32 0.0681 0.1312 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 L24 positive control 0.077 0.0076 1.96 0.083 0.00887 2.47 3.1297 0.9934 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 M01 compound treatment 0.165 0.0956 24.61 0.169 0.0949 26.42 36.0864 0.9994 3065638 Maybridge4_004489 Cc1oc(cc1C(=O)C(=C2SCCS2)C#N)C(C)(C)C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 M02 compound treatment 0.07 6.0E-4 0.15 0.077 0.00287 0.8 0.6738 0.8286 3065639 Maybridge4_004490 Nc1nnc(SCc2nc(no2)c3ccccc3)[nH]1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 M03 compound treatment 0.107 0.0376 9.68 0.108 0.0339 9.43 13.5146 0.9999 1454547 Maybridge4_004491 C1COc2ccc(cc2OC1)c3csc(n3)c4ccc(cc4)c5csnn5 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 M04 compound treatment 0.106 0.0366 9.42 0.116 0.0419 11.66 14.9079 0.9944 3178793 Maybridge4_004492 CCN(CC)C(=O)Oc1nnc(SC(C)C)n1c2ccc(Cl)c(Cl)c2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 M05 compound treatment 0.165 0.0956 24.61 0.152 0.0779 21.69 32.7387 0.998 1188621 Maybridge4_004493 CC(C)(C)c1cc(cc(c1O)C(C)(C)C)c2csc(n2)c3ccno3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 M06 compound treatment 0.1 0.0306 7.88 0.111 0.0369 10.27 12.831 0.9914 3178794 Maybridge4_004494 Clc1ccccc1C(=O)Oc2ccc(cc2)C3=NCCS3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 M07 compound treatment 0.087 0.0176 4.53 0.091 0.0169 4.7 6.5257 0.9998 3065640 Maybridge4_004495 Cc1ccc(cc1)c2noc(n2)c3cc(nn3Cc4ccccc4)C(C)(C)C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 M08 compound treatment 0.071 0.0016 0.41 0.075 8.67E-4 0.24 0.462 0.9676 3178795 Maybridge4_004496 COCc1cc(OC(=O)N(C)C)nc(COc2ccc(Cl)cc2)n1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 M09 compound treatment 0.073 0.0036 0.93 0.074 -1.33E-4 -0.04 0.6292 0.6782 1583006 Maybridge4_004497 Cc1c(cc(c2ccccc2)n1CCCN3CCOCC3)C(=O)Nc4ccccc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 M10 compound treatment 0.068 -0.0014 -0.36 0.073 -0.00113 -0.32 -0.4781 -0.9978 3065641 Maybridge4_004498 FC(F)(F)c1ccccc1C(=O)NC(=O)NN2CCCCC2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 M11 compound treatment 0.18 0.111 28.48 0.186 0.112 31.15 42.165 0.999 1136828 Maybridge4_004499 CSc1c(C#N)c(nn1c2ccccc2)c3cc(oc3C)C(C)(C)C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 M12 compound treatment 0.083 0.0136 3.5 0.088 0.0139 3.86 5.2067 0.9988 3065642 Maybridge4_004500 NNC(=O)c1cccc(COc2ccc(cc2)C3SCCS3)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 M13 compound treatment 0.106 0.0366 9.42 0.11 0.0359 9.99 13.7264 0.9996 1241045 Maybridge4_004501 COc1ccc2[nH]c(cc2c1)C(=O)N(C)c3ccc(F)cc3F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 M14 compound treatment 0.121 0.0516 13.29 0.117 0.0429 11.94 17.8357 0.9986 1234233 Maybridge4_004502 COc1ccc(OC(=O)c2csc(Cc3c(Cl)cccc3Cl)n2)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 M15 compound treatment 0.104 0.0346 8.91 0.117 0.0429 11.94 14.7407 0.9896 3178796 Maybridge4_004503 CSc1sc(C2=NNC(O)(C2)C(F)(F)F)c3c1C(=O)CCC3(C)C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 M16 compound treatment 0.068 -0.0014 -0.36 0.076 0.00187 0.52 0.1127 0.1782 3065643 Maybridge4_004504 Cc1nc(CS(=O)(=O)c2ccccn2)sc1C(=O)NN 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 M17 compound treatment 0.07 6.0E-4 0.15 0.076 0.00187 0.52 0.4768 0.8792 1507802 Maybridge4_004505 CN(C(=O)N1CCCCC1)c2c(C)onc2c3c(Cl)cccc3Cl 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 M18 compound treatment 0.131 0.0616 15.86 0.132 0.0579 16.12 22.6102 1.0 3178797 Maybridge4_004506 CN(C)/C=C/C(=O)c1sc(COc2ccccc2Cl)nc1C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 M19 compound treatment 0.087 0.0176 4.53 0.087 0.0129 3.58 5.738 0.9932 3065644 Maybridge4_004507 Oc1cc(nc(Cc2c(Cl)cccc2Cl)n1)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 M20 compound treatment 0.122 0.0526 13.54 0.114 0.0399 11.1 17.427 0.9951 3178798 Maybridge4_004508 CC(C)n1c(SCC(=O)C(C)(C)C)nc2cc(ccc12)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 M21 compound treatment 0.062 -0.0074 -1.91 0.063 -0.0111 -3.1 -3.5397 -0.9727 3065645 Maybridge4_004509 Oc1nnc(S)n1c2ccccc2C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 M22 compound treatment 0.097 0.0276 7.11 0.082 0.00787 2.19 6.574 0.884 3178799 Maybridge4_004510 Cc1cc(C)c(C#N)c(SCc2nc(COc3cccc(c3)C(F)(F)F)no2)n1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 M23 mock treatment 0.071 0.0016 0.41 0.075 8.67E-4 0.24 0.462 0.9676 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 M24 positive control 0.078 0.0086 2.21 0.084 0.00987 2.75 3.5087 0.9943 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 N01 compound treatment 0.109 0.0396 10.2 0.121 0.0469 13.05 16.4387 0.9925 3065646 Maybridge4_004511 CC(C)(C)c1cc(C(=O)Oc2cccc(c2)C(F)(F)F)n(Cc3ccccc3)n1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 N02 compound treatment 0.123 0.0536 13.8 0.12 0.0459 12.77 18.7906 0.9993 1256051 Maybridge4_004512 CCOC(=O)c1nc(sc1c2ccnn2C(=O)NC(C)C)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 N03 compound treatment 0.108 0.0386 9.94 0.113 0.0389 10.82 14.6813 0.9991 3065647 Maybridge4_004513 Cc1nn(c(C(=O)Sc2cccc(c2)C(F)(F)F)c1Br)C(C)(C)C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 N04 compound treatment 0.107 0.0376 9.68 0.122 0.0479 13.33 16.2715 0.9877 3178800 Maybridge4_004514 CCOC(=O)c1nc(C)sc1c2ccnn2S(=O)(=O)c3ccc(Cl)cc3Cl 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 N05 compound treatment 0.074 0.0046 1.18 0.081 0.00687 1.91 2.1897 0.9735 1543758 Maybridge4_004515 O=C(NN1CCOCC1)Nc2ccno2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 N06 compound treatment 0.073 0.0036 0.93 0.078 0.00387 1.08 1.4169 0.9972 3178801 Maybridge4_004516 COC(Cn1c(SCc2ccc(Cl)cc2)nnc1c3ccccc3)OC 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 N07 compound treatment 0.071 0.0016 0.41 0.077 0.00287 0.8 0.8558 0.9526 3065648 Maybridge4_004517 Cc1ccc(SC(=O)c2ccc(OC(F)(F)F)cc2)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 N08 compound treatment 0.078 0.0086 2.21 0.078 0.00387 1.08 2.3271 0.9451 3178802 Maybridge4_004518 CN(C)/C=C/C(=O)c1c(C)onc1c2ccccc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 N09 compound treatment 0.092 0.0226 5.82 0.091 0.0169 4.7 7.436 0.9944 3065649 Maybridge4_004519 COC(=O)c1noc(C)c1C(=O)/C=C/N(C)C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 N10 compound treatment 0.07 6.0E-4 0.15 0.074 -1.33E-4 -0.04 0.083 0.5223 3178803 Maybridge4_004520 COC(OC)c1c(cnn1c2ccccc2)C(=O)OC 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 N11 compound treatment 0.073 0.0036 0.93 0.077 0.00287 0.8 1.2199 0.9972 3178804 Maybridge4_004521 CCOC(=O)c1cc(CSc2nnc(O)n2c3ccccc3)nn1C(C)(C)C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 N12 compound treatment 0.072 0.0026 0.67 0.074 -1.33E-4 -0.04 0.4471 0.6669 3065650 Maybridge4_004522 CCOC(Cc1nnc(S)n1C)OCC 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 N13 compound treatment 0.07 6.0E-4 0.15 0.079 0.00487 1.36 1.0676 0.7826 1195492 Maybridge4_004523 CC(C)(C)c1nccc(n1)c2nn(ccc2=O)c3ccc(F)cc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 N14 compound treatment 0.124 0.0546 14.06 0.117 0.0429 11.94 18.3819 0.9967 1316271 Maybridge4_004524 Clc1ccc(cc1)c2c(cnn2S(=O)(=O)c3ccccc3)S(=O)(=O)c4ccc(Cl)cc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 N15 compound treatment 0.079 0.0096 2.47 0.084 0.00987 2.75 3.6908 0.9986 3065651 Maybridge4_004525 CN(C)/C=C(/Sc1ccc(C)cc1)\C(=O)c2ccc(C)cc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 N16 compound treatment 0.077 0.0076 1.96 0.082 0.00787 2.19 2.9328 0.9984 3178805 Maybridge4_004526 Cc1c(NC(=O)Nc2ccccc2)sc3nc(nn13)c4ccc(Cl)cc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 N17 compound treatment 0.09 0.0206 5.3 0.087 0.0129 3.58 6.2842 0.9818 3065652 Maybridge4_004527 COCc1nc(S)c(C#N)cc1C(=O)OC 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 N18 compound treatment 0.118 0.0486 12.51 0.117 0.0429 11.94 17.2896 0.9997 3065697 Maybridge4_004528 NC(=S)c1cnccc1C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 N19 compound treatment 0.287 0.218 56.03 0.279 0.205 57.05 79.9593 1.0 3065698 Maybridge4_004529 COC(OC)c1ccc(C#N)c(SCC(=O)c2ccccc2)n1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 N20 compound treatment 0.154 0.0846 21.78 0.144 0.0699 19.46 29.1606 0.9984 3065699 Maybridge4_004530 COc1ccc(cc1)c2nc(COc3ccccc3Cl)nc(SC)c2C#N 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 N21 compound treatment 0.122 0.0526 13.54 0.123 0.0489 13.61 19.1993 1.0 1685558 Maybridge4_004531 CCOC(=O)c1cc(on1)c2csc(Nc3ccccc3Cl)n2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 N22 compound treatment 0.068 -0.0014 -0.36 0.075 8.67E-4 0.24 -0.0842 -0.1941 3065700 Maybridge4_004532 CSc1nnc(c2ccc(Cl)cc2Cl)n1Cc3ccco3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 N23 mock treatment 0.07 6.0E-4 0.15 0.073 -0.00113 -0.32 -0.1139 -0.3243 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 N24 positive control 0.078 0.0086 2.21 0.083 0.00887 2.47 3.3118 0.9985 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 O01 compound treatment 0.075 0.0056 1.44 0.083 0.00887 2.47 2.7656 0.9672 3065702 Maybridge4_004533 FC(F)(F)Oc1ccccc1NC(=S)NCc2ccc3OCCc3c2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 O02 compound treatment 0.07 6.0E-4 0.15 0.075 8.67E-4 0.24 0.2799 0.9768 3065703 Maybridge4_004534 CC(C)Sc1nnc(O)n1c2ccccc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 O03 compound treatment 0.075 0.0056 1.44 0.08 0.00587 1.63 2.1748 0.9981 3065704 Maybridge4_004535 FC(F)(F)c1ccc(cc1)c2csc(n2)c3ccc(cc3)c4csnn4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 O04 compound treatment 0.069 -4.0E-4 -0.1 0.074 -1.33E-4 -0.04 -0.0991 -0.905 1506889 Maybridge4_004536 Clc1ccc(CSCc2cc(=O)[nH]c(=O)[nH]2)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 O05 compound treatment 0.082 0.0126 3.24 0.09 0.0159 4.42 5.4185 0.9885 3178806 Maybridge4_004537 FC(F)(F)Oc1ccc(cc1)c2nc(CS(=O)(=O)Cc3ccco3)no2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 O06 compound treatment 0.071 0.0016 0.41 0.075 8.67E-4 0.24 0.462 0.9676 3065705 Maybridge4_004538 FC(F)(F)c1ccc(cc1)c2nnc(SCC=C)[nH]2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 O07 compound treatment 0.081 0.0116 2.99 0.089 0.0149 4.14 5.0395 0.9872 3178807 Maybridge4_004539 Fc1ccc(c2nc(no2)c3ccc(cc3)C(F)(F)F)c(Cl)c1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 O08 compound treatment 0.08 0.0106 2.73 0.081 0.00687 1.91 3.282 0.9849 3065706 Maybridge4_004540 FC(F)(F)c1ccc(cc1)C(=O)Sc2ccccc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 O09 compound treatment 0.103 0.0336 8.65 0.109 0.0349 9.71 12.9833 0.9983 1707697 Maybridge4_004541 Fc1ccc(cc1)n2nc(cc2NC(=O)C3CCC3)c4ccc(Cl)cc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 O10 compound treatment 0.068 -0.0014 -0.36 0.072 -0.00213 -0.59 -0.675 -0.9713 3065707 Maybridge4_004542 N/C(=N\O)/CS(=O)(=O)Cc1cccc(c1)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 O11 compound treatment 0.073 0.0036 0.93 0.076 0.00187 0.52 1.023 0.9626 3178808 Maybridge4_004543 COC(=O)C1SCCN1C(=O)c2cc(oc2C)c3ccc(Cl)cc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 O12 compound treatment 0.103 0.0336 8.65 0.11 0.0359 9.99 13.1802 0.9974 3065708 Maybridge4_004544 FC(F)(F)c1ccc(COc2ccc(C#N)cc2Cl)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 O13 compound treatment 0.078 0.0086 2.21 0.086 0.0119 3.3 3.9025 0.981 3178809 Maybridge4_004545 Cc1oc(cc1C(=O)N2CCN(CC2)c3ncccc3C(F)(F)F)C(C)(C)C 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 O14 compound treatment 0.126 0.0566 14.57 0.121 0.0469 13.05 19.5337 0.9985 1687767 Maybridge4_004546 Clc1cccc(Cl)c1Cc2nc(cs2)C(=O)NCc3cccs3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 O15 compound treatment 0.069 -4.0E-4 -0.1 0.073 -0.00113 -0.32 -0.296 -0.8916 1449045 Maybridge4_004547 COC(=O)c1c(C)oc(C)c1S(=O)(=O)N2CCOCC2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 O16 compound treatment 0.069 -4.0E-4 -0.1 0.078 0.00387 1.08 0.6886 0.6366 1404470 Maybridge4_004548 CCn1nc(C)cc1C(=O)NN 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 O17 compound treatment 0.071 0.0016 0.41 0.075 8.67E-4 0.24 0.462 0.9676 3178810 Maybridge4_004549 CN(C)N/C(=N\O)/c1c(F)cccc1Cl 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 O18 compound treatment 0.071 0.0016 0.41 0.076 0.00187 0.52 0.6589 0.9934 3065709 Maybridge4_004550 N/C(=N\O)/COc1ccccc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 O19 compound treatment 0.146 0.0766 19.72 0.168 0.0939 26.14 32.4304 0.9903 3178811 Maybridge4_004551 Oc1cc(nc(Cc2c(Cl)cccc2Cl)n1)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 O20 compound treatment 0.112 0.0426 10.97 0.117 0.0429 11.94 16.1972 0.9991 3065711 Maybridge4_004552 CCn1nc(C)c(Br)c1C(=O)Oc2ccc(Cl)cc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 O21 compound treatment 0.146 0.0766 19.72 0.151 0.0769 21.41 29.0827 0.9992 3178882 Maybridge4_004553 Cc1ccc(CSc2nnc([nH]2)c3ccc(cc3)C(C)(C)C)cc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 O22 compound treatment 0.133 0.0636 16.38 0.136 0.0619 17.23 23.762 0.9997 3178883 Maybridge4_004554 Cc1cc(OCc2noc(CSc3ccc(cn3)C(F)(F)F)n2)cc(C)c1Cl 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 O23 mock treatment 0.071 0.0016 0.41 0.074 -1.33E-4 -0.04 0.265 0.6408 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 O24 positive control 0.079 0.0096 2.47 0.084 0.00987 2.75 3.6908 0.9986 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 P01 compound treatment 0.155 0.0856 22.04 0.16 0.0859 23.91 32.4935 0.9992 1165145 Maybridge4_004555 CC(C)(C)c1cc(C(=O)Nc2ccc(Cl)cc2)n(Cc3ccccc3)n1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 P02 compound treatment 0.08 0.0106 2.73 0.086 0.0119 3.3 4.2667 0.9955 3178884 Maybridge4_004556 CCOC(=O)c1cc(on1)c2ccnn2C(=O)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 P03 compound treatment 0.105 0.0356 9.17 0.112 0.0379 10.55 13.9382 0.9976 3065712 Maybridge4_004557 Cc1cc(no1)c2onc(C)c2C(=O)Sc3ccc(C)cc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 P04 compound treatment 0.077 0.0076 1.96 0.085 0.0109 3.03 3.5236 0.9777 3178885 Maybridge4_004558 Cc1nc(nc(Sc2cccc(c2)C(F)(F)F)c1C)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 P05 compound treatment 0.125 0.0556 14.32 0.136 0.0619 17.23 22.3055 0.9958 3065713 Maybridge4_004559 CCOC(=O)c1noc(C)c1c2csc(COc3cc(Cl)cc(Cl)c3)n2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 P06 compound treatment 0.081 0.0116 2.99 0.087 0.0129 3.58 4.6456 0.9959 3178886 Maybridge4_004560 FC(F)(F)c1ccc(cc1)c2nc(cs2)c3cc(no3)c4ccccc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 P07 compound treatment 0.073 0.0036 0.93 0.081 0.00687 1.91 2.0076 0.9447 1465099 Maybridge4_004561 Cc1cc(no1)c2onc(C)c2C(=O)N 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 P08 compound treatment 0.104 0.0346 8.91 0.111 0.0369 10.27 13.5592 0.9975 1505757 Maybridge4_004562 Cc1nc2ccccn2c1c3ccnn3S(=O)(=O)c4ccc(C)cc4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 P09 compound treatment 0.078 0.0086 2.21 0.08 0.00587 1.63 2.721 0.9888 3065714 Maybridge4_004563 COC(=O)c1noc(C)c1c2ccnn2C(=O)c3cc(cc(c3)C(F)(F)F)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 P10 compound treatment 0.096 0.0266 6.85 0.105 0.0309 8.6 10.9212 0.9937 3178887 Maybridge4_004564 COC(=O)c1cnn(c1/C=N/c2ccc(C)cc2)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 P11 compound treatment 0.081 0.0116 2.99 0.085 0.0109 3.03 4.2518 1.0 3178888 Maybridge4_004565 CC(C)(C)c1ccc(cc1Cn2nnc(n2)c3cccc(c3)C(F)(F)F)c4ncon4 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 P12 compound treatment 0.072 0.0026 0.67 0.078 0.00387 1.08 1.2348 0.9738 1198897 Maybridge4_004566 CC(=O)N(C(=O)C)c1nccc(n1)c2c(C)onc2c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 P13 compound treatment 0.113 0.0436 11.23 0.136 0.0619 17.23 20.1208 0.9785 1188766 Maybridge4_004567 Clc1ccc(cc1)n2ccc(=O)c(n2)C(=O)c3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 P14 compound treatment 0.079 0.0096 2.47 0.085 0.0109 3.03 3.8877 0.995 1729683 Maybridge4_004568 CC(C)NC(=O)n1ncc(c1c2ccc(Cl)cc2)S(=O)(=O)c3ccc(Cl)cc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 P15 compound treatment 0.106 0.0366 9.42 0.101 0.0269 7.48 11.9541 0.9935 1416020 Maybridge4_004569 Cc1[nH]c(=S)[nH]c(=O)c1Oc2ccccc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 P16 compound treatment 0.098 0.0286 7.36 0.111 0.0369 10.27 12.4668 0.9867 3065738 Maybridge4_004570 Cc1c(sc2nc(nn12)C(F)(F)F)C(=O)Sc3ccccc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 P17 compound treatment 0.098 0.0286 7.36 0.096 0.0219 6.09 9.513 0.9955 1418463 Maybridge4_004571 CCOC(=O)c1cc(C#N)c(S)nc1c2ccccc2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 P18 compound treatment 0.071 0.0016 0.41 0.072 -0.00213 -0.59 -0.1288 -0.1782 3065739 Maybridge4_004572 Cn1c(S)nnc1c2ncc(cc2Cl)C(F)(F)F 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 P19 compound treatment 0.134 0.0646 16.63 0.156 0.0819 22.8 27.8826 0.988 3065740 Maybridge4_004573 Cc1onc(C(=O)NN)c1c2csc(COc3ccc(Cl)cc3)n2 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 P20 compound treatment 0.081 0.0116 2.99 0.086 0.0119 3.3 4.4487 0.9987 1093995 Maybridge4_004574 NC(=S)COc1ccccc1 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 P21 compound treatment 0.102 0.0326 8.39 0.107 0.0329 9.15 12.4074 0.9991 3178889 Maybridge4_004575 Cc1cc(no1)c2nc(cs2)c3ccc(Cl)cc3 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 P22 compound treatment 0.071 0.0016 0.41 0.075 8.67E-4 0.24 0.462 0.9676 3065741 Maybridge4_004576 CC(C)S(=O)(=O)/C(=C/N1CCC(CC1)C(F)(F)F)/C#N 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 P23 mock treatment 0.071 0.0016 0.41 0.071 -0.00313 -0.87 -0.3257 -0.3376 1017.0037 EnzCoupledColor(1017.0037) TrypanothioneReductase 1017.0037.2061 P24 positive control 0.08 0.0106 2.73 0.085 0.0109 3.03 4.0697 0.9987