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Reactions Similar in Bond Changes to M0215

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 M0215 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-H
C-C
O-H
The C-O bond changes from a single to double bond
C
H
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 M0215

There are 4 identical reactions with respect to the bond changes.

Overall Reaction Similarity Composite Reaction Similarity Catalytic Machinary Similarity Total Similarity
M0220
4.1.1.7
10.80280.73620.8058Compare
M0217
4.1.2.37
10.10460.23640.2270Compare
M0221
4.1.2.38
10.84820.53530.7851Compare
M0182
4.1.3.30
0.80.21630.2340.2790Compare

Reactions similar to M0215

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

Overall Reaction Similarity Composite Reaction Similarity Catalytic Machinary Similarity Total Similarity
M0231
4.1.1.2
0.80.20930.18740.2628Compare
M0049
4.1.1.22
0.50.65650.28530.5480Compare
M0050
4.1.1.23
0.750.06350.15110.1540Compare
M0070
4.1.1.41
0.50.05680.27920.1567Compare
M0236
4.1.1.85
0.50.21510.51040.3174Compare

OVERVIEW OF ALL RESULTS

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