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Reactions Similar in Bond Changes to M0169

Please note, this page may take a while to load. This displays the reactions with similar (as calculated by a Tanimoto similarity) to the reaction M0169 at the level of the bond changes defined. The fingerprint from which the Tanimoto similarity score is calculated is continuous (i.e. it takes into account the number of different bond changes as well as the identity of the bond changes).


Reactive Centre (Manual Annotation) of Target Reaction

Bonds Formed Bonds Cleaved Bonds Changed in Order Atom Types Involved
C-O
N-H
C-N
O-H
None
C
H
N
O

Key

1.0-0.9 0.9-0.8 0.8-0.7 0.7-0.6 0.6-0.5 0.5-0.4 0.4-0.3 0.3-0.2 0.2-0.1 0.1-0.0 =0

Results

Reactions identical to M0169

There are 26 identical reactions with respect to the bond changes.

Overall Reaction Similarity Composite Reaction Similarity Catalytic Machinary Similarity Total Similarity
M0017
2.4.2.1
0.80.61530.09990.5049Compare
M0091
2.4.2.2
0.80.66660.21580.5672Compare
M0076
2.4.2.30
0.80.26660.27410.3218Compare
M0039
3.2.2.1
10.27770.23820.3400Compare
M0071
3.2.2.3
10.33330.40530.4179Compare
M0313
3.2.2.21
10.24130.47560.3757Compare
M0167
3.4.11.10
10.428500.3785Compare
M0005
3.4.16.6
110.66060.9151Compare
M0172
3.4.19.-
10.33330.14250.3522Compare
M0173
3.4.21.4
10.86660.32720.7450Compare
M0238
3.4.21.97
10.86660.25860.7279Compare
M0174
3.4.22.2
10.41930.10960.3999Compare
M0175
3.4.23.16
10.27270.15450.3158Compare
M0177
3.4.25.1
10.86660.24800.7252Compare
M0301
3.5.1.2
10.59250.49990.6101Compare
M0241
3.5.1.11
10.65710.21530.5809Compare
M0266
3.5.1.26
10.86660.08330.6841Compare
M0029
3.5.1.38
10.22830.24550.3097Compare
M0098
3.5.1.88
10.400.36Compare
M0288
3.5.1.93
10.72090.180.6135Compare
M0002
3.5.2.6
10.6410.15900.5564Compare
M0210
3.5.2.6
10.48140.19450.4615Compare
M0016
3.5.2.6
10.26310.13080.3037Compare
M0258
3.5.2.6
10.09670.450.2753Compare
M0257
3.5.2.6
10.44180.27680.4563Compare
M0015
3.5.2.6
10.09670.01140.1657Compare

Reactions similar to M0169

There are 5 similar (Tanimoto Score ≥ 0.75) reactions.

Overall Reaction Similarity Composite Reaction Similarity Catalytic Machinary Similarity Total Similarity
M0244
2.4.2.28
0.750.33330.12850.3237Compare
M0168
3.4.13.19
0.750.42850.25710.4178Compare
M0170
3.4.15.1
0.750.29720.360.3581Compare
M0171
3.4.17.1
0.830.27770.01470.2675Compare
M0176
3.4.24.27
0.750.45450.53340.5037Compare

OVERVIEW OF ALL RESULTS

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