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Reactions Similar in Bond Changes to M0101

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 M0101 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
O-H
P-O
O-H
P-O
None
H
O
P

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 M0101

There are 28 identical reactions with respect to the bond changes.

Overall Reaction Similarity Composite Reaction Similarity Catalytic Machinary Similarity Total Similarity
M0365
00Compare
M0338
00Compare
M0352
00Compare
M0209
2.7.1.20
10.263100.2710Compare
M0152
2.7.8.7
10.280.3790.3767Compare
M0246
2.7.10.1
10.33330.01430.3202Compare
M0035
2.7.11.19
10.33330.020.3216Compare
M0282
2.7.12.2
10.307600.2999Compare
M0044
3.1.3.1
10.30430.01860.3024Compare
M0043
3.1.3.2
10.17640.68070.3848Compare
M0047
3.1.3.48
10.33330.21280.3698Compare
M0027
3.1.4.3
10.33330.02220.3221Compare
M0028
3.1.4.11
10.25920.51420.3970Compare
M0242
3.1.4.41
10.60.19990.5399Compare
M0300
3.1.4.46
10.2380.46360.3706Compare
M0160
3.1.11.2
10.17640.17850.2592Compare
M0321
3.1.13.5
10.33330.02120.3219Compare
M0041
3.1.21.1
10.22220.47280.3626Compare
M0161
3.1.22.4
10.1250.59990.3312Compare
M0163
3.1.26.4
10.17640.450.3271Compare
M0164
3.1.27.5
10.2380.450.3672Compare
M0042
3.1.30.2
10.20.27510.2987Compare
M0165
3.1.31.1
10.250.01560.2664Compare
M0178
3.6.3.14
10.15780.0140.2060Compare
M0179
3.6.4.9
10.2500.2625Compare
M0058
4.6.1.1
10.142800.1928Compare
M0026
4.6.1.13
10.22220.360.3344Compare
M0206
5.4.2.6
10.2500.2625Compare

Reactions similar to M0101

There are 3 similar (Tanimoto Score ≥ 0.75) reactions.

Overall Reaction Similarity Composite Reaction Similarity Catalytic Machinary Similarity Total Similarity
M0151
2.7.6.3
0.750.20.01840.2096Compare
M0011
3.1.21.2
10.333300.3166Compare
M0202
6.5.1.1
0.750.818100.6067Compare

OVERVIEW OF ALL RESULTS

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