Clustering data with hclust algorithm for (Study ST003315)

Reversed phase POSITIVE ION MODE (Analysis AN005429)
MetaboliteStructureF1F2F3F4F5F6F7F8F9F10F11F12F13F14F15F16F17F18F19F20F21F22F23F24F25F26F27F28F29F30F31F32F33F34F35F36F37F38F39F40F41F42
SerotoninME8697630.091.200.103.091.540.070.190.130.140.090.121.010.120.150.070.061.135.200.371.430.080.060.140.060.150.130.113.530.069.42NA0.010.10NA0.022.760.270.160.070.010.020.08
g-Oxalo-crotonateME8697610.410.940.641.220.700.640.870.982.022.330.490.390.490.410.560.440.700.990.750.420.710.410.750.390.353.280.731.444.662.010.220.330.440.280.513.060.070.607.242.961.501.10
Indole-3-acetateME8697560.580.770.800.800.980.770.920.790.851.931.011.880.920.830.830.540.720.720.541.011.090.680.440.801.041.040.781.240.650.890.550.630.460.180.291.652.508.561.320.611.300.60
AnthranilateME8697590.831.650.141.870.320.690.410.880.270.981.070.820.642.311.921.840.590.740.310.880.460.270.080.052.743.451.031.023.741.090.510.282.970.680.700.320.000.010.340.723.144.37
4-AcetamidobutanoateME8697491.360.550.170.801.360.480.530.630.750.720.831.071.731.100.530.660.710.540.451.352.020.410.231.342.392.740.210.950.305.430.320.400.250.250.190.570.850.103.550.461.010.35
acyl-C4-OHME8697721.120.740.881.161.400.901.860.721.071.080.450.830.470.700.300.310.892.350.552.881.100.351.751.684.553.311.170.110.810.200.610.190.370.100.060.200.340.081.260.841.180.14
ITPME8697340.941.280.830.680.941.491.171.460.861.061.420.500.720.741.330.640.860.680.750.681.080.101.26NA0.850.29NA0.830.641.31NA1.34NA1.250.481.432.041.662.282.050.510.59
L-octanoylcarnitine (acyl-C8)ME8697750.920.760.520.861.372.430.390.730.970.471.032.190.400.712.190.450.870.590.420.770.700.531.000.181.432.153.001.091.190.950.590.320.711.041.010.850.720.451.470.640.300.42
hexanoyl-L-carnitine (acyl-C6)ME8697740.980.890.680.701.213.110.410.850.930.671.021.390.670.591.280.500.780.800.520.700.850.860.840.581.091.422.441.091.371.080.660.480.441.190.860.971.121.141.161.160.290.51
O-Decenoyl-L-carnitine (acyl-C10:1)ME8697770.920.750.551.311.252.310.421.021.070.620.871.730.460.801.450.421.020.850.530.910.700.740.990.270.991.222.851.031.011.090.620.530.701.350.910.891.090.661.361.240.330.44
octenoyl-l-carnitine (acyl-C8:1)ME8697761.371.080.771.260.871.500.451.531.170.730.890.960.550.820.720.371.031.050.770.691.141.230.520.450.630.431.141.240.631.452.421.480.581.741.440.671.951.111.831.550.780.81
L-HomocysteineME8697431.000.930.541.540.950.980.600.800.851.001.572.020.620.821.250.721.220.940.970.891.080.980.430.280.561.080.330.752.060.781.112.331.380.350.541.020.830.440.811.370.830.59
acyl-C5:1ME8697730.620.961.181.280.890.970.651.341.191.091.580.850.871.861.240.750.750.560.561.131.620.831.710.831.060.840.500.890.321.341.090.350.900.680.451.431.320.870.910.681.62NA
glycineME8697220.790.810.690.950.951.120.940.980.790.720.971.190.841.150.860.671.011.370.881.450.720.641.131.011.801.671.610.821.770.830.530.621.090.820.650.791.081.401.191.850.790.65
GuanidinoacetateME8697501.180.870.841.440.960.750.850.891.141.010.881.050.931.160.870.960.911.520.891.250.740.630.820.701.321.171.121.021.571.100.890.351.650.360.370.771.621.851.351.051.110.77
N-Methylethanolamine phosphateME8697641.121.190.901.300.870.900.791.181.751.260.841.080.550.980.910.791.110.991.060.900.690.451.090.491.121.260.760.820.771.001.841.120.930.610.621.350.900.681.610.890.760.76
serineME8697290.831.150.671.011.041.180.770.910.980.670.891.420.751.121.100.820.921.180.921.290.760.751.151.121.050.901.110.831.460.821.140.980.700.690.831.491.341.420.961.410.900.87
acetyl-carnitine (acyl-C2)ME8697690.791.070.941.141.021.000.811.091.010.991.291.011.030.850.920.780.970.940.950.830.881.341.811.240.850.751.031.001.380.890.720.700.770.760.801.001.591.211.851.330.701.10
DimethylglycineME8697440.800.941.100.950.901.180.851.031.231.190.911.030.981.080.900.771.000.880.830.870.990.931.591.180.830.941.040.950.880.921.160.810.700.751.211.181.701.901.241.550.860.98
IDPME8697350.870.910.490.901.230.930.871.041.040.921.271.620.940.810.900.860.621.190.600.651.570.701.120.671.280.890.611.160.840.851.031.591.241.222.101.240.601.421.851.130.881.05
L-CysteateME8697530.851.000.991.031.090.891.080.911.391.191.111.140.980.911.040.820.861.120.870.810.970.971.040.800.940.860.970.851.041.031.731.500.941.161.421.100.660.901.210.800.820.83
2-OxoglutarateME8697410.801.040.690.801.190.970.900.981.360.961.271.390.960.930.870.800.800.970.720.701.100.931.260.911.150.961.041.120.910.751.221.340.961.671.650.930.691.401.151.040.811.08
Picolinic acidME8697600.800.861.151.221.210.971.060.951.361.011.121.331.010.700.800.940.600.980.840.651.120.931.100.941.100.640.641.011.050.961.601.081.001.451.681.071.061.301.171.460.511.05
SphingosineME8697650.811.200.970.881.020.871.140.851.160.791.250.751.270.801.401.530.791.320.680.871.300.961.020.790.841.171.081.131.381.110.750.510.811.170.981.230.230.821.581.491.031.52
NicotinamideME8697400.980.900.831.020.952.011.081.090.871.250.880.741.250.781.060.860.971.050.570.890.790.860.700.800.790.851.621.161.301.070.640.980.960.381.290.880.581.061.100.910.841.04
IMPME8697361.241.301.061.001.190.931.020.851.131.111.040.721.091.021.390.550.761.190.961.710.591.130.571.231.321.180.901.101.160.510.911.061.260.910.900.860.321.020.870.700.630.86
butanoyl-l-carnitine (acyl-C4)ME8697710.781.160.991.241.331.420.741.250.750.671.170.900.921.180.900.660.880.900.601.271.120.900.840.711.001.240.500.860.601.140.860.661.090.650.621.511.081.111.070.542.170.66
propionyl-carnitine (acyl-C3)ME8697700.741.050.881.121.181.450.771.230.981.050.930.890.981.040.920.690.880.870.651.171.141.670.660.631.111.080.721.100.621.060.830.930.970.621.041.460.660.541.160.712.600.74
prolineME8697281.081.110.950.891.050.960.780.831.030.870.791.120.851.151.290.801.011.100.851.481.931.040.770.930.841.060.760.830.591.111.500.951.131.531.261.141.401.050.820.841.540.69
L-Methionine S-oxideME8697541.051.080.780.820.860.950.910.731.011.100.891.191.081.031.250.981.051.090.791.621.431.300.701.110.691.030.530.920.970.960.921.001.481.051.331.630.481.081.081.200.870.59
AllantoateME8697381.041.020.931.551.011.010.830.781.271.130.751.100.730.901.001.021.111.290.821.231.330.810.680.600.921.101.291.160.671.100.580.651.280.851.281.130.720.951.120.671.781.10
gamma-Glutamyl-Se-methylselenocysteineME8697421.231.201.001.491.050.960.840.881.511.120.701.030.660.901.370.951.061.250.811.301.300.780.650.490.851.151.050.900.770.960.720.751.150.801.061.180.861.121.010.611.630.88
OrnithineME8697451.081.070.951.391.090.930.900.831.621.100.771.100.710.961.150.871.041.300.801.221.490.960.640.560.921.061.050.980.801.160.830.761.010.681.151.020.811.090.840.691.560.94
leucine/isoleucineME8697240.940.970.940.731.000.970.900.901.621.330.871.240.891.111.330.740.911.060.731.211.691.610.720.760.650.780.690.930.761.030.940.811.060.801.301.631.141.180.700.731.141.20
lysineME8697250.941.041.000.961.000.970.850.981.501.060.861.210.871.191.250.811.000.990.761.051.501.190.540.510.860.920.961.020.911.120.980.911.100.951.301.180.881.000.740.801.341.12
valineME8697330.981.091.120.891.010.990.970.961.381.300.911.060.861.121.180.831.000.940.831.081.241.000.720.650.800.860.780.940.821.041.250.931.120.771.271.510.961.050.780.681.260.81
methionineME8697260.880.970.730.861.031.000.840.891.251.090.841.230.881.331.480.811.031.300.681.540.881.090.720.800.830.830.770.890.801.030.840.681.300.761.101.441.201.080.720.731.581.04
threonineME8697301.060.960.890.990.911.140.810.900.990.720.861.120.891.121.340.971.151.230.951.341.071.000.811.080.930.910.950.891.101.020.790.771.010.930.991.191.271.510.720.721.170.76
kynurenineME8697580.780.941.071.001.001.021.151.020.780.871.151.021.311.051.020.980.830.910.631.451.421.200.520.710.920.921.011.220.841.131.081.060.931.011.150.980.590.580.980.681.541.40
CholineME8697670.981.060.871.101.050.981.200.991.101.180.810.831.041.031.010.740.961.071.000.870.990.871.201.011.071.101.081.141.041.101.271.081.250.630.791.070.510.771.160.571.130.97
alanineME8697191.021.031.070.951.061.150.901.031.161.000.780.980.910.971.150.870.920.970.911.231.170.990.840.791.060.900.931.000.901.151.371.141.401.491.300.890.710.740.910.791.280.66
glutamineME8697211.131.061.020.961.070.971.031.010.961.000.831.020.921.051.070.930.961.061.031.260.820.800.830.991.131.041.140.871.290.851.031.071.261.080.921.010.921.040.760.891.020.88
histidineME8697230.770.980.860.971.171.051.380.970.940.990.901.030.981.150.940.890.971.140.891.060.981.050.750.780.950.910.870.950.820.910.981.081.270.981.141.110.931.040.860.791.020.97
L-AdrenalineME8697620.991.021.081.151.121.060.960.980.790.871.061.080.830.890.810.840.981.260.861.201.161.080.860.691.050.930.981.030.811.210.920.931.041.170.961.011.020.821.081.081.201.10
L-CarnitineME8697680.811.091.011.141.191.120.941.100.920.920.900.980.921.051.080.750.911.110.891.231.081.010.790.641.040.891.070.931.101.131.000.811.050.930.891.050.790.781.311.011.380.74
AcetylcholineME8697660.981.020.881.051.091.040.911.100.980.850.961.080.981.211.230.981.011.091.041.061.011.240.980.740.830.910.870.921.060.790.830.731.110.800.901.050.980.791.110.890.910.83
phenylalanineME8697270.860.920.800.921.021.070.771.041.191.110.941.361.001.191.300.820.871.070.771.221.121.050.860.820.910.950.700.990.871.010.800.931.200.811.131.240.750.860.981.041.290.92
IndolepyruvateME8697570.721.031.000.861.110.890.860.881.361.210.850.991.081.181.721.370.810.730.731.211.151.480.461.061.131.090.141.150.820.960.921.161.200.911.061.360.571.230.830.662.241.06
tyrosineME8697320.761.040.800.861.080.880.830.861.231.250.860.981.081.221.381.190.830.940.761.251.251.360.650.881.151.210.750.970.900.990.801.121.290.931.111.270.601.070.901.042.231.14
3-MethyleneoxindoleME8697551.040.880.810.761.090.831.081.041.470.821.001.170.891.141.190.790.951.150.631.471.321.070.360.770.601.270.980.641.200.750.801.431.080.410.702.270.380.781.501.231.751.04
Pyridoxamine 5^-phosphateME8697390.731.030.780.931.201.060.890.931.121.160.870.971.071.221.210.900.981.010.741.341.330.810.531.030.931.030.200.970.770.870.781.111.690.580.881.880.630.841.200.931.431.21
tryptophanME8697310.870.920.890.841.131.110.970.801.171.190.871.060.991.021.250.970.911.160.721.431.430.850.530.740.861.001.130.911.170.880.921.271.280.580.951.670.660.721.300.871.431.31
CreatineME8697470.701.170.691.021.101.470.941.230.991.680.721.030.971.110.960.530.791.260.811.151.981.881.021.000.720.650.550.710.610.870.970.720.300.871.240.971.421.760.930.750.480.50
L-CitrullineME8697461.271.121.121.210.961.040.781.140.940.841.031.060.911.100.990.841.340.871.011.130.901.130.870.581.031.090.640.880.581.010.300.210.960.160.250.661.861.560.940.881.640.83
trans-4-Hydroxy-L-prolineME8697510.840.970.841.110.821.030.840.970.701.151.101.121.440.951.151.171.021.031.081.421.181.170.660.590.980.910.720.740.800.780.510.650.990.780.860.761.402.720.780.720.571.01
arginineME8697201.081.060.750.940.731.050.671.061.040.810.941.480.951.241.020.791.160.971.011.211.061.270.540.901.261.200.600.830.820.881.060.931.160.570.431.011.491.580.770.710.630.89
CreatinineME8697480.960.861.310.881.080.970.980.930.801.020.991.120.940.871.060.871.150.951.031.131.561.580.710.690.870.930.840.990.970.960.960.921.100.640.820.751.711.931.080.861.070.79
TaurineME8697521.161.170.731.331.200.981.140.721.241.130.830.830.880.801.250.711.161.460.811.110.670.930.600.491.290.701.200.922.790.960.381.140.620.461.121.120.180.870.971.421.730.77
XanthineME8697371.271.131.201.231.100.581.200.661.681.530.830.700.970.721.070.580.691.340.701.130.690.710.710.630.631.071.351.331.711.480.470.670.421.572.261.630.120.721.720.301.981.66

Factors:

F1Histology :Ductal | Lab Ki67 Group :High BL, High W5 | PEPI Score :>0 | Visit :Baseline | Arm :Combination
F2Histology :Ductal | Lab Ki67 Group :High BL, High W5 | PEPI Score :>0 | Visit :Baseline | Arm :Fulvestrant
F3Histology :Ductal | Lab Ki67 Group :High BL, High W5 | PEPI Score :>0 | Visit :C4D1 | Arm :Combination
F4Histology :Ductal | Lab Ki67 Group :High BL, High W5 | PEPI Score :>0 | Visit :C4D1 | Arm :Fulvestrant
F5Histology :Ductal | Lab Ki67 Group :High BL, Low W5 | PEPI Score :>0 | Visit :Baseline | Arm :Combination
F6Histology :Ductal | Lab Ki67 Group :High BL, Low W5 | PEPI Score :>0 | Visit :Baseline | Arm :Fulvestrant
F7Histology :Ductal | Lab Ki67 Group :High BL, Low W5 | PEPI Score :>0 | Visit :C4D1 | Arm :Combination
F8Histology :Ductal | Lab Ki67 Group :High BL, Low W5 | PEPI Score :>0 | Visit :C4D1 | Arm :Fulvestrant
F9Histology :Ductal | Lab Ki67 Group :Low BL, Low W5 | PEPI Score :0 | Visit :Baseline | Arm :Combination
F10Histology :Ductal | Lab Ki67 Group :Low BL, Low W5 | PEPI Score :0 | Visit :C4D1 | Arm :Combination
F11Histology :Ductal | Lab Ki67 Group :Low BL, Low W5 | PEPI Score :>0 | Visit :Baseline | Arm :Combination
F12Histology :Ductal | Lab Ki67 Group :Low BL, Low W5 | PEPI Score :>0 | Visit :Baseline | Arm :Fulvestrant
F13Histology :Ductal | Lab Ki67 Group :Low BL, Low W5 | PEPI Score :>0 | Visit :C4D1 | Arm :Combination
F14Histology :Ductal | Lab Ki67 Group :Low BL, Low W5 | PEPI Score :>0 | Visit :C4D1 | Arm :Fulvestrant
F15Histology :Ductal | Lab Ki67 Group :not available | PEPI Score :0 | Visit :Baseline | Arm :Combination
F16Histology :Ductal | Lab Ki67 Group :not available | PEPI Score :0 | Visit :C4D1 | Arm :Combination
F17Histology :Ductal | Lab Ki67 Group :not available | PEPI Score :>0 | Visit :Baseline | Arm :Combination
F18Histology :Ductal | Lab Ki67 Group :not available | PEPI Score :>0 | Visit :Baseline | Arm :Fulvestrant
F19Histology :Ductal | Lab Ki67 Group :not available | PEPI Score :>0 | Visit :C4D1 | Arm :Combination
F20Histology :Ductal | Lab Ki67 Group :not available | PEPI Score :>0 | Visit :C4D1 | Arm :Fulvestrant
F21Histology :Lobular | Lab Ki67 Group :High BL, High W5 | PEPI Score :>0 | Visit :Baseline | Arm :Combination
F22Histology :Lobular | Lab Ki67 Group :High BL, High W5 | PEPI Score :>0 | Visit :C4D1 | Arm :Combination
F23Histology :Lobular | Lab Ki67 Group :High BL, Low W5 | PEPI Score :0 | Visit :Baseline | Arm :Combination
F24Histology :Lobular | Lab Ki67 Group :High BL, Low W5 | PEPI Score :0 | Visit :C4D1 | Arm :Combination
F25Histology :Lobular | Lab Ki67 Group :Low BL, Low W5 | PEPI Score :0 | Visit :Baseline | Arm :Fulvestrant
F26Histology :Lobular | Lab Ki67 Group :Low BL, Low W5 | PEPI Score :0 | Visit :C4D1 | Arm :Fulvestrant
F27Histology :Lobular | Lab Ki67 Group :Low BL, Low W5 | PEPI Score :>0 | Visit :Baseline | Arm :Combination
F28Histology :Lobular | Lab Ki67 Group :Low BL, Low W5 | PEPI Score :>0 | Visit :Baseline | Arm :Fulvestrant
F29Histology :Lobular | Lab Ki67 Group :Low BL, Low W5 | PEPI Score :>0 | Visit :C4D1 | Arm :Combination
F30Histology :Lobular | Lab Ki67 Group :Low BL, Low W5 | PEPI Score :>0 | Visit :C4D1 | Arm :Fulvestrant
F31Histology :Lobular | Lab Ki67 Group :not available | PEPI Score :0 | Visit :Baseline | Arm :Combination
F32Histology :Lobular | Lab Ki67 Group :not available | PEPI Score :0 | Visit :C4D1 | Arm :Combination
F33Histology :Lobular | Lab Ki67 Group :not available | PEPI Score :>0 | Visit :Baseline | Arm :Combination
F34Histology :Lobular | Lab Ki67 Group :not available | PEPI Score :>0 | Visit :Baseline | Arm :Fulvestrant
F35Histology :Lobular | Lab Ki67 Group :not available | PEPI Score :>0 | Visit :C4D1 | Arm :Fulvestrant
F36Histology :not available | Lab Ki67 Group :not available | PEPI Score :not available | Visit :Baseline | Arm :not enrolled, baseline only
F37Histology :Other | Lab Ki67 Group :High BL, High W5 | PEPI Score :>0 | Visit :Baseline | Arm :Combination
F38Histology :Other | Lab Ki67 Group :High BL, High W5 | PEPI Score :>0 | Visit :C4D1 | Arm :Combination
F39Histology :Other | Lab Ki67 Group :High BL, Low W5 | PEPI Score :>0 | Visit :Baseline | Arm :Combination
F40Histology :Other | Lab Ki67 Group :High BL, Low W5 | PEPI Score :>0 | Visit :C4D1 | Arm :Combination
F41Histology :Other | Lab Ki67 Group :Low BL, Low W5 | PEPI Score :0 | Visit :Baseline | Arm :Combination
F42Histology :Other | Lab Ki67 Group :Low BL, Low W5 | PEPI Score :0 | Visit :C4D1 | Arm :Combination
Data matrix
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