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Synthesizable Analog Search on ChEMBL 1k molecules
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100
Validity
SynthesisNet
84.4
88.45
92.5
96.55
Sep 25, 2025
Validity
RR
Morgan Similarity
Scaffold Overlap
Gobbi Similarity
Updated 1mo ago
Evaluation Results
Method
Method
Links
Validity
RR
Morgan Similarity
Scaffold Overlap
Gobbi Similarity
SynthesisNet
MCMC version=non-MCMC,...
2025.09
100
7
54.3
53
45.2
SynGA
Filter=Sim
2025.09
100
6.4
63.1
63.8
53.4
SynGA
Filter=MLP, Time=250 m
2025.09
100
19.6
71.1
69.4
62.3
SynFormer
Parameters=default, Ti...
2025.09
99.8
19
66.8
66.7
63.5
ChemProjector
2025.09
98.8
13.3
59.8
58.7
55.7
SynNet
2025.09
85
5.4
42.7
41.7
26.8
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