Data for (Study ST003367)
(Analysis AN005519)Values for each metabolite have been scaled by dividing by the mean across all factors Run Hierarchial cluster analysis on this study | Run Heatmap cluster analysis on this study| Metabolite | F1 | F2 | F3 | F4 | F5 | F6 | F7 | F8 | F9 | F10 | F11 | F12 | F13 | F14 | F15 | F16 | F17 |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Acetyl-CoA 303 | 2.4496 | 2.5250 | 2.1489 | 2.7478 | 2.4774 | 2.5750 | 2.4065 | 0.0003 | 0.0005 | 0.0005 | 0.0003 | 0.0003 | 0.0004 | 0.0002 | 0.0002 | 0.0003 | 0.0002 |
| Acetyl-CoA 428 | 1.0096 | 1.0313 | 0.8818 | 1.0638 | 1.0309 | 1.0309 | 0.9517 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
| Adenosylcobalamin 147 | 1.6577 | 1.7013 | 2.1273 | 4.7982 | 1.5264 | 1.7816 | 1.4250 | 0.1483 | 0.2078 | 0.3075 | 0.1491 | 0.2858 | 0.2407 | 0.1934 | 0.2330 | 0.2009 | 0.2615 |
| Adenosylcobalamin 341 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
| Alanine PARENT POS | 2.1619 | 2.1830 | 2.1159 | 2.1588 | 2.1209 | 2.1593 | 2.0110 | 0.2995 | 0.3233 | 0.3360 | 0.3160 | 0.3134 | 0.3422 | 0.3166 | 0.0225 | 0.0275 | 0.2315 |
| Asparagine 87 | 1.5445 | 1.8024 | 1.7243 | 1.6706 | 1.6481 | 1.6400 | 1.5852 | 0.7068 | 0.7144 | 0.7285 | 0.6840 | 0.6899 | 0.7102 | 0.6991 | 0.7015 | 0.7399 | 0.1065 |
| Biotin 227 | 2.0458 | 1.3426 | 1.1355 | 1.2536 | 1.5015 | 1.1400 | 1.0473 | 0.9588 | 0.9759 | 1.0534 | 0.9718 | 0.9735 | 1.0030 | 0.9724 | 0.9095 | 0.9750 | 0.0240 |
| Choline 60 | 1.2580 | 1.2925 | 1.5270 | 1.5537 | 1.6406 | 1.5702 | 1.2408 | 0.6125 | 0.5984 | 0.6521 | 0.5896 | 0.5917 | 0.6009 | 0.5951 | 1.0408 | 1.0621 | 2.9679 |
| Citrulline 113 | 0.6584 | 0.7529 | 0.8050 | 0.6837 | 0.8527 | 0.6005 | 0.7368 | 1.3935 | 1.4713 | 1.6154 | 1.3741 | 1.0779 | 1.7727 | 1.5034 | 1.4727 | 1.3623 | 0.3853 |
| Citrulline 70 | 2.2203 | 1.7962 | 1.6161 | 1.7459 | 1.8686 | 1.7163 | 1.6546 | 0.5454 | 0.5705 | 0.6622 | 0.4927 | 0.5748 | 0.5404 | 0.5885 | 0.5526 | 0.5747 | 0.1196 |
| Cyanocobalamin 147 | 0.1453 | 0.1484 | 0.1393 | 0.1092 | 0.0861 | 0.1042 | 0.0890 | 0.1240 | 0.1544 | 0.1720 | 0.1535 | 0.1973 | 0.1785 | 0.1504 | 0.2781 | 0.1388 | 22.8192 |
| Cyanocobalamin 457 | 0.0811 | 0.1183 | 0.0748 | 0.0779 | 0.0804 | 0.0633 | 0.0741 | 0.0483 | 0.1136 | 0.0611 | 0.0650 | 0.1253 | 0.0476 | 0.1026 | 0.1233 | 0.0803 | 21.5808 |
| Cysteine 76 | 1.4554 | 2.8642 | 1.5891 | 2.2052 | 2.3952 | 1.8759 | 1.4362 | 0.3612 | 0.4680 | 0.3974 | 0.4095 | 0.3837 | 0.3765 | 0.3299 | 0.3640 | 0.3899 | 0.7664 |
| Cysteine PARENT POS | 0.5761 | 0.5101 | 0.5420 | 0.5485 | 0.6218 | 0.4787 | 0.6152 | 1.8086 | 0.7009 | 1.5021 | 1.2033 | 1.0265 | 1.8779 | 1.3979 | 1.9868 | 0.8647 | 2.0193 |
| Doxycycline 321 | 1.1115 | 2.9113 | 1.1125 | 1.1478 | 0.7367 | 0.5148 | 0.9535 | 1.0260 | 0.4949 | 0.8746 | 0.5051 | 0.8706 | 0.7173 | 1.0399 | 0.7509 | 1.0352 | 0.5180 |
| Fasnall 218 | 1.2955 | 1.5020 | 1.3002 | 1.0137 | 1.2258 | 0.8099 | 1.0996 | 1.0033 | 0.7944 | 1.1574 | 0.8011 | 0.8491 | 0.8983 | 0.7313 | 1.1767 | 0.7097 | 0.8139 |
| Folic 295 | 0.7723 | 0.9639 | 0.8413 | 0.7012 | 0.7638 | 0.5867 | 0.5809 | 1.1982 | 1.1649 | 1.3268 | 1.2750 | 1.2552 | 1.2400 | 1.2444 | 1.1912 | 1.1579 | 3.3638 |
| Glutamine 130 | 1.0705 | 1.2707 | 1.2868 | 1.2641 | 1.2275 | 1.2108 | 1.1209 | 0.9510 | 0.8922 | 0.9878 | 0.9495 | 0.9519 | 0.9487 | 0.9523 | 1.1546 | 1.0210 | 1.7422 |
| Glutamine 84 | 1.1319 | 1.2377 | 1.2591 | 1.2019 | 1.2033 | 1.2019 | 1.1668 | 0.9523 | 0.9433 | 0.9971 | 0.9415 | 0.9606 | 0.9794 | 0.9710 | 1.0181 | 1.0949 | 1.6474 |
| Glycine PARENT POS | 2.0579 | 2.0410 | 1.9001 | 1.9557 | 1.9803 | 1.9093 | 1.9356 | 0.3936 | 0.3836 | 0.4031 | 0.3679 | 0.3923 | 0.3914 | 0.3864 | 0.3624 | 0.3905 | 0.6742 |
| GSK2194069 344 | 0.7906 | 0.8159 | 1.3762 | 1.3579 | 1.1014 | 1.1189 | 1.0920 | 1.2881 | 0.7181 | 0.7256 | 0.5030 | 1.1334 | 0.6524 | 0.9974 | 0.8417 | 1.0029 | 1.1508 |
| Histidine 110 POS | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
| Histidine 83 | 0.9986 | NA | 0.9386 | NA | NA | NA | 1.0628 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
| Isoleucine 69 | 1.2041 | 1.3854 | 1.3023 | 1.2246 | 1.1780 | 1.1091 | 1.1247 | 0.9817 | 0.9491 | 1.0107 | 0.9552 | 0.9781 | 0.9783 | 0.9863 | 1.1044 | 1.1318 | 1.2317 |
| Leucine 86 | 1.2998 | 1.2295 | 1.2966 | 1.3216 | 1.2850 | 1.1374 | 1.1083 | 0.9353 | 0.9585 | 0.9933 | 0.9613 | 0.9115 | 0.9725 | 0.9466 | 1.1282 | 1.1490 | 1.2775 |
| Lysine 84 | 0.7768 | 1.0802 | 0.9461 | 0.7268 | 0.7470 | 0.5481 | 0.5840 | 1.0925 | 1.1020 | 1.2159 | 1.0675 | 1.0889 | 1.1166 | 1.1158 | 1.1967 | 1.3062 | 4.2625 |
| Malonyl-CoA 303 | 2.9893 | 2.7059 | 2.1091 | 2.2638 | 2.2449 | 2.2986 | 2.0144 | 0.0035 | 0.0051 | 0.0023 | 0.0022 | 0.0036 | 0.0016 | 0.0036 | 0.0052 | 0.0045 | 0.0046 |
| Malonyl-CoA 428 | 1.2459 | 1.1183 | 0.8666 | 0.9631 | 0.9737 | 0.9720 | 0.8603 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
| Methionine 104 | 1.2966 | 1.4601 | 1.3858 | 1.2847 | 1.2649 | 1.2260 | 1.1860 | 0.9374 | 0.8972 | 0.9529 | 0.8807 | 0.9338 | 0.8940 | 0.9025 | 0.9033 | 1.0255 | 1.3090 |
| Methionine 61 | 1.3085 | 1.5094 | 1.3860 | 1.2963 | 1.2649 | 1.2208 | 1.1714 | 0.9014 | 0.8737 | 0.9378 | 0.8776 | 0.8899 | 0.8841 | 0.8990 | 0.9018 | 1.0375 | 1.3655 |
| Methylcobalamin 147 | 1.1965 | 1.0954 | 1.8642 | 1.6295 | 1.1980 | 1.4931 | 2.0882 | 0.4891 | 0.4423 | 0.6435 | 0.4408 | 0.6638 | 0.6484 | 0.6738 | 0.3141 | 0.6277 | 1.9082 |
| Methylcobalamin 636 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
| Myristoyl-CoA 428 | 2.6811 | 2.0211 | 2.1072 | 1.5360 | 2.8663 | 3.2822 | 2.7623 | 0.0040 | 0.0056 | 0.0078 | 0.0054 | 0.0091 | 0.0079 | 0.0073 | 0.0240 | 0.0063 | 0.0060 |
| NAD+ 428 | 2.3318 | 2.3760 | 2.1485 | 2.3416 | 2.3145 | 2.3078 | 2.1792 | 0.0001 | 0.0001 | 0.0001 | 0.0001 | 0.0000 | 0.0001 | 0.0001 | 0.0000 | 0.0000 | 0.0000 |
| NAD+ 524 | 2.5700 | 2.6296 | 2.2897 | 2.5710 | 2.4108 | 2.4799 | 2.3806 | 0.0001 | 0.0003 | 0.0001 | 0.0002 | 0.0002 | 0.0002 | 0.0002 | 0.0001 | 0.0001 | 0.0001 |
| NADH 348 | 1.7968 | 1.7238 | 1.1628 | 1.3759 | 1.4026 | 1.2087 | 1.3284 | 0.0002 | NA | NA | NA | NA | NA | 0.0003 | NA | 0.0002 | 0.0008 |
| NADH 649 | 3.1764 | 2.9610 | 1.9442 | 2.4204 | 2.4272 | 2.0958 | 2.2940 | 0.0016 | 0.0018 | 0.0010 | 0.0011 | 0.0010 | 0.0014 | 0.0012 | 0.0015 | 0.0015 | 0.0016 |
| Niaciamide 106 | 0.7684 | 0.9625 | 0.9970 | 0.8152 | 0.8538 | 0.6790 | 0.5923 | 1.1103 | 1.2211 | 1.3051 | 1.1617 | 1.1844 | 1.2190 | 1.1563 | 1.2118 | 1.2004 | 3.2224 |
| Niaciamide 80 | 0.8577 | 1.0905 | 1.0810 | 0.9026 | 0.9357 | 0.7786 | 0.6648 | 1.1202 | 1.1892 | 1.2763 | 1.1647 | 1.1671 | 1.2161 | 1.1543 | 1.1758 | 1.2219 | 2.3897 |
| O-Acetyl-L-carnitine 145 | 2.5505 | 2.5252 | 2.2370 | 2.5663 | 2.3624 | 2.4109 | 2.3432 | 0.0418 | 0.0501 | 0.0489 | 0.0557 | 0.0527 | 0.0392 | 0.0429 | 0.0168 | 0.0096 | 0.0005 |
| O-Acetyl-L-carnitine 85 | 2.5373 | 2.5346 | 2.2755 | 2.5656 | 2.4156 | 2.3883 | 2.3278 | 0.0396 | 0.0389 | 0.0425 | 0.0414 | 0.0416 | 0.0406 | 0.0394 | 0.0061 | 0.0068 | 0.0002 |
| Ornithine 70 | 1.1126 | 1.3775 | 1.2232 | 1.0753 | 1.1015 | 0.8822 | 0.8733 | 1.2047 | 1.2935 | 1.3658 | 1.1729 | 1.2583 | 1.3013 | 1.2291 | 0.8727 | 0.9619 | 0.0017 |
| pABA 120 | 0.1612 | 0.2984 | 0.4642 | 0.0762 | 0.5602 | 0.0545 | 0.1534 | 1.0078 | 1.0809 | 1.0110 | 0.8280 | 1.0189 | 0.9441 | 1.0137 | 7.7975 | 8.2714 | 0.6472 |
| Pantothenic 202 | 2.1703 | 1.4978 | 1.3876 | 1.5541 | 1.7685 | 1.5596 | 1.2886 | 0.4316 | 0.4491 | 0.5019 | 0.4759 | 0.4675 | 0.4707 | 0.4655 | 0.4848 | 0.4788 | 3.1365 |
| Penicillin G 289 POS | 0.7173 | 0.8194 | 0.7662 | 0.7288 | 0.7399 | 0.6227 | 0.6217 | 1.4783 | 1.5584 | 1.6038 | 1.4968 | 1.5178 | 1.5225 | 1.4758 | 1.6309 | 1.8410 | 0.0000 |
| Proline 70 | 1.5421 | 1.6111 | 1.5734 | 1.5439 | 1.4909 | 1.4108 | 1.3303 | 0.7883 | 0.7797 | 0.8070 | 0.7638 | 0.7779 | 0.7689 | 0.7824 | 0.8288 | 0.8575 | 0.7674 |
| Puro Heavy 121 | 1.1570 | 1.0584 | 2.0993 | 5.8339 | 0.9893 | 1.0019 | 0.9284 | 0.2489 | 0.4169 | 0.4356 | 0.4071 | 1.2577 | 0.2780 | 0.4670 | 0.4147 | 0.2472 | 0.2226 |
| Pyridoxine 134 | 0.6166 | 0.7247 | 0.6840 | 0.6045 | 0.6464 | 0.5299 | 0.5283 | 1.3773 | 1.3308 | 1.4144 | 1.3469 | 1.3585 | 1.3148 | 1.3529 | 1.3938 | 1.4649 | 3.1054 |
| Pyridoxine 152 | 0.6132 | 0.7135 | 0.6713 | 0.5945 | 0.6372 | 0.5192 | 0.5120 | 1.3801 | 1.3490 | 1.4146 | 1.3281 | 1.3654 | 1.3544 | 1.3555 | 1.4736 | 1.5003 | 3.0786 |
| Serine 60 | 1.4145 | 1.6282 | 1.5327 | 1.5624 | 1.5217 | 1.5147 | 1.4403 | 0.7217 | 0.7702 | 0.7946 | 0.7616 | 0.7420 | 0.7514 | 0.7626 | 0.8282 | 0.8961 | 0.7934 |
| Thiamine 122 | 1.1871 | 1.3796 | 1.2543 | 1.1578 | 1.1596 | 1.0330 | 1.0453 | 0.9460 | 0.9423 | 1.0020 | 0.9434 | 0.9588 | 0.9745 | 0.9598 | 0.9102 | 0.9594 | 2.1732 |
| Threonine 102 | 0.9193 | 1.0431 | 1.0152 | 0.9818 | 0.9678 | 0.9382 | 0.8927 | 1.0341 | 1.0383 | 1.0898 | 0.9890 | 1.0440 | 1.0469 | 1.0386 | 1.0735 | 1.2048 | 3.1352 |
| Threonine 74 POS | 0.9066 | 1.0362 | 1.0258 | 0.9840 | 0.9894 | 0.9566 | 0.9162 | 1.0544 | 1.0378 | 1.0720 | 1.0206 | 1.0397 | 1.0539 | 1.0536 | 1.0899 | 1.1840 | 3.0265 |
| Tryptophan 118 | 1.5722 | 1.8435 | 1.5580 | 1.5628 | 1.5106 | 1.3391 | 1.3181 | 0.6731 | 0.6774 | 0.7178 | 0.6519 | 0.6926 | 0.6796 | 0.6874 | 0.6987 | 0.8298 | 1.5784 |
| Tryptophan 146 | 1.5966 | 1.8074 | 1.5610 | 1.4858 | 1.5430 | 1.3774 | 1.3048 | 0.7002 | 0.6768 | 0.6938 | 0.6497 | 0.7104 | 0.6778 | 0.6870 | 0.7204 | 0.8202 | 1.6048 |
| Tyrosine 123 | 1.0921 | 1.4519 | 1.2055 | 1.1704 | 1.0936 | 1.0848 | 1.0119 | 1.0061 | 0.9561 | 1.0288 | 0.9461 | 0.9511 | 0.9346 | 0.9726 | 1.0215 | 1.0976 | 2.0266 |
| Tyrosine 136 | 1.1668 | 1.4874 | 1.1908 | 1.2115 | 1.1474 | 1.0792 | 0.9860 | 0.9709 | 0.9523 | 0.9628 | 0.9776 | 0.9790 | 0.9366 | 0.9491 | 0.9469 | 1.1025 | 1.9698 |
| Urea 44 | 0.9116 | 1.0581 | 1.0316 | 0.9119 | 0.8829 | 0.7844 | 0.8011 | 1.3678 | 1.3866 | 1.4638 | 1.3497 | 1.3946 | 1.4292 | 1.3940 | 1.0655 | 1.1121 | 0.0218 |
| Valine 55 | 0.9652 | 1.1306 | 1.0678 | 0.9849 | 0.9509 | 0.8958 | 0.9078 | 1.0413 | 1.0027 | 1.0529 | 0.9821 | 1.0133 | 1.0207 | 1.0369 | 1.1898 | 1.2599 | 3.0108 |
| Valine 72 | 1.0047 | 1.1786 | 1.1094 | 1.0278 | 0.9881 | 0.9581 | 0.9339 | 1.0240 | 0.9977 | 1.0807 | 0.9969 | 1.0166 | 1.0161 | 1.0344 | 1.1203 | 1.2452 | 2.6059 |
Factors:
| F1 | Sample source:BT-474 Breast cancer cells | Sample Type:Intracellular | Drug Treatment:100 uM C75 |
| F2 | Sample source:BT-474 Breast cancer cells | Sample Type:Intracellular | Drug Treatment:15 uM C75 |
| F3 | Sample source:BT-474 Breast cancer cells | Sample Type:Intracellular | Drug Treatment:1 uM C75 |
| F4 | Sample source:BT-474 Breast cancer cells | Sample Type:Intracellular | Drug Treatment:20 uM C75 |
| F5 | Sample source:BT-474 Breast cancer cells | Sample Type:Intracellular | Drug Treatment:40 uM C75 |
| F6 | Sample source:BT-474 Breast cancer cells | Sample Type:Intracellular | Drug Treatment:5 uM C75 |
| F7 | Sample source:BT-474 Breast cancer cells | Sample Type:Intracellular | Drug Treatment:Control |
| F8 | Sample source:BT-474 Breast cancer cells | Sample Type:Medium | Drug Treatment:100 uM C75 |
| F9 | Sample source:BT-474 Breast cancer cells | Sample Type:Medium | Drug Treatment:15 uM C75 |
| F10 | Sample source:BT-474 Breast cancer cells | Sample Type:Medium | Drug Treatment:1 uM C75 |
| F11 | Sample source:BT-474 Breast cancer cells | Sample Type:Medium | Drug Treatment:20 uM C75 |
| F12 | Sample source:BT-474 Breast cancer cells | Sample Type:Medium | Drug Treatment:40 uM C75 |
| F13 | Sample source:BT-474 Breast cancer cells | Sample Type:Medium | Drug Treatment:5 uM C75 |
| F14 | Sample source:BT-474 Breast cancer cells | Sample Type:Medium | Drug Treatment:Control |
| F15 | Sample source:NA | Sample Type:Medium | Drug Treatment:Control |
| F16 | Sample source:NA | Sample Type:Medium | Drug Treatment:NA |
| F17 | Sample source:NA | Sample Type:QC | Drug Treatment:NA |
