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Reactions Similar in Bond Changes to M0313

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 M0313 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 M0313

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
0.80.28570.02960.2731Compare
M0091
2.4.2.2
0.80.230700.2299Compare
M0076
2.4.2.30
0.80.40.29990.4149Compare
M0039
3.2.2.1
10.29410.2250.3474Compare
M0071
3.2.2.3
10.53840.25730.5142Compare
M0167
3.4.11.10
10.454500.3954Compare
M0169
3.4.14.5
10.24130.47560.3757Compare
M0005
3.4.16.6
10.24130.39060.3544Compare
M0172
3.4.19.-
10.26310.450.3835Compare
M0173
3.4.21.4
10.18510.24280.2810Compare
M0238
3.4.21.97
10.185100.2203Compare
M0174
3.4.22.2
10.250.02960.2699Compare
M0175
3.4.23.16
10.18510.23880.2800Compare
M0177
3.4.25.1
10.18510.15690.2595Compare
M0301
3.5.1.2
10.14810.25710.2605Compare
M0241
3.5.1.11
10.17240.21030.2646Compare
M0266
3.5.1.26
10.18510.01080.2230Compare
M0029
3.5.1.38
10.10.2250.2212Compare
M0098
3.5.1.88
10.384600.3499Compare
M0288
3.5.1.93
10.162700.2057Compare
M0002
3.5.2.6
10.176400.2146Compare
M0210
3.5.2.6
10.191400.2244Compare
M0016
3.5.2.6
10.20.32180.3104Compare
M0258
3.5.2.6
10.42850.90.6035Compare
M0257
3.5.2.6
10.22580.08180.2672Compare
M0015
3.5.2.6
10.428500.3785Compare

Reactions similar to M0313

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
0.750.45450.450.4829Compare
M0168
3.4.13.19
0.750.45450.31300.4486Compare
M0170
3.4.15.1
0.750.26310.12390.2769Compare
M0171
3.4.17.1
0.830.222200.2277Compare
M0176
3.4.24.27
0.750.14280.46510.2840Compare

OVERVIEW OF ALL RESULTS

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