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Reactions Similar in Bond Changes to M0020

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 M0020 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 (Composite) Annotation) of Target Reaction

Bonds Formed Bonds Cleaved Bonds Changed in Order Atom Types Involved
C-H
C-H
N-H
N-H
N-H
N-H
O-H
O-H
N-H
N-H
N-H
N-H
O-H
O-H
O-H
R-H
The C-C bond changes from a single to double bond
The C-C bond changes from a single to double bond
The C-N bond changes from a single to double bond
The C-N bond changes from a single to double bond
The C-O bond changes from a single to double bond
The C-O bond changes from a single to double bond
The C-C bond changes from a double to single bond
The C-C bond changes from a double to single bond
The C-C bond changes from a double to single bond
The C-N bond changes from a double to single bond
The C-N bond changes from a double to single bond
The C-O bond changes from a double to single bond
The C-O bond changes from a double to single bond
C
H
N
O
R

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 M0020

There are 0 identical reactions with respect to the bond changes.

Reactions similar to M0020

There are 24 similar (Tanimoto Score ≥ 0.65) reactions.

Overall Reaction Similarity Composite Reaction Similarity Catalytic Machinary Similarity Total Similarity
M0353
00Compare
M0021
1.1.1.38
0.350.54160.17800.4322Compare
M0274
1.2.3.3
00.59440.04760.3982Compare
M0106
1.2.4.1
00.72610.56080.6121Compare
M0280
1.2.4.4
00.72610.16800.5139Compare
M0119
1.2.7.1
00.55550.25970.426Compare
M0294
1.3.5.1
0.620.43820.68920.5196Compare
M0067
1.4.1.1
0.170.47190.18960.3717Compare
M0111
1.4.7.1
0.220.61840.17130.4670Compare
M0120
1.5.1.20
0.270.71840.18850.5413Compare
M0281
1.5.5.1
0.070.66190.09580.4618Compare
M0115
1.5.99.12
0.040.6190.19270.4545Compare
M0117
1.6.2.4
0.120.640.0060.43Compare
M0003
1.6.5.2
0.070.71280.12790.5029Compare
M0118
1.7.3.3
0.050.46870.11250.3377Compare
M0219
2.2.1.1
00.62570.37050.4993Compare
M0289
2.2.1.6
00.59210.05710.3991Compare
M0090
3.3.1.1
00.64770.16880.4632Compare
M0215
4.1.1.1
0.280.6580.30560.5326Compare
M0220
4.1.1.7
0.280.7640.29990.6001Compare
M0221
4.1.2.38
0.280.76040.18550.5692Compare
M0314
4.1.3.27
0.210.64580.360.5311Compare
M0085
4.2.3.3
0.220.5060.29410.4246Compare
M0185
4.2.99.18
00.550500.3578Compare

OVERVIEW OF ALL RESULTS

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