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Reactions Similar in Bond Changes to M0175

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 M0175 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-O
N-H
O-H
O-H
O-H
C-N
O-H
O-H
O-H
O-H
The C-O bond changes from a single to double bond
The C-O bond changes from a double to single bond
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 M0175

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

Reactions similar to M0175

There are 38 similar (Tanimoto Score ≥ 0.65) reactions.

Overall Reaction Similarity Composite Reaction Similarity Catalytic Machinary Similarity Total Similarity
M0328
00Compare
M0351
00Compare
M0359
00Compare
M0255
1.1.1.1
0.10.52940.02160.3595Compare
M0322
1.1.3.9
0.110.60.01960.4060Compare
M0099
1.1.99.8
0.160.65780.29040.5168Compare
M0107
1.2.99.2
0.250.418100.2967Compare
M0121
1.8.3.1
0.250.45450.00420.3214Compare
M0250
1.11.1.10
00.52940.19860.3937Compare
M0138
1.15.1.1
00.43390.01430.2856Compare
M0268
2.1.1.13
0.330.62260.23020.4955Compare
M0205
2.4.1.1
0.330.562500.3989Compare
M0209
2.7.1.20
0.140.680.24380.5172Compare
M0345
3.1.2.4
0.330.56250.69660.5731Compare
M0047
3.1.3.48
0.140.53330.16570.4023Compare
M0158
3.1.6.8
0.140.65850.10580.4687Compare
M0165
3.1.31.1
0.140.71420.02310.4842Compare
M0039
3.2.2.1
10.680.22250.5976Compare
M0167
3.4.11.10
10.565200.4673Compare
M0168
3.4.13.19
0.750.56520.23770.5018Compare
M0170
3.4.15.1
0.750.83330.01270.6198Compare
M0171
3.4.17.1
0.830.9090.02040.6792Compare
M0240
3.5.1.-
0.610.58130.27680.5085Compare
M0301
3.5.1.2
10.547100.4556Compare
M0025
3.5.1.59
0.540.59180.18800.4862Compare
M0288
3.5.1.93
10.489300.4180Compare
M0002
3.5.2.6
10.621600.5040Compare
M0210
3.5.2.6
10.727200.5726Compare
M0016
3.5.2.6
10.760.2250.6502Compare
M0257
3.5.2.6
10.81250.0140.6316Compare
M0097
3.5.4.5
0.50.793100.5655Compare
M0284
3.5.5.8
0.330.68180.01750.4808Compare
M0060
3.5.99.6
0.430.49150.39250.4613Compare
M0182
4.1.3.30
0.120.69690.18360.5113Compare
M0032
4.4.1.5
00.53840.01220.3530Compare
M0273
5.1.3.4
00.60.2250.4462Compare
M0325
5.4.4.2
0.070.58820.00980.3924Compare
M0269
5.5.1.1
0.160.70370.01790.4785Compare

OVERVIEW OF ALL RESULTS

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