2
Candidates
{"N": 8}
Ground Truth
{"N": 6}
Top-1 Prediction
0.750
Match Score
⚠ Per-candidate scores unavailable for sequential. Showing 30 candidates from single-ligand scoring.
For sequential results only top-1 prediction is stored.
#1
TOP-1
0.38 ± 0.00
NCCCOc1ccc(-c2cc3-c4cccc[n]4->[Ru+2]4<-[n]5ccccc5-c(c2)[n]->43)cc1
#1
TOP-1
0.38 ± 0.00
NCCCOc1ccc(-c2cc3-c4cccc[n]4->[Ru+2]4<-[n]5ccccc5-c(c2)[n]->43)cc1
#1
TOP-1
0.38 ± 0.00
NCCCOc1ccc(-c2cc3-c4cccc[n]4->[Ru+2]4<-[n]5ccccc5-c(c2)[n]->43)cc1
#1
TOP-1
0.38 ± 0.00
NCCCOc1ccc(-c2cc3-c4cccc[n]4->[Ru+2]4<-[n]5ccccc5-c(c2)[n]->43)cc1
#1
TOP-1
0.38 ± 0.00
NCCCOc1ccc(-c2cc3-c4cccc[n]4->[Ru+2]4<-[n]5ccccc5-c(c2)[n]->43)cc1
#1
TOP-1
0.38 ± 0.00
NCCCOc1ccc(-c2cc3-c4cccc[n]4->[Ru+2]4<-[n]5ccccc5-c(c2)[n]->43)cc1
#1
TOP-1
0.38 ± 0.00
NCCCOc1ccc(-c2cc3-c4cccc[n]4->[Ru+2]4<-[n]5ccccc5-c(c2)[n]->43)cc1
#1
TOP-1
0.38 ± 0.00
NCCCOc1ccc(-c2cc3-c4cccc[n]4->[Ru+2]4<-[n]5ccccc5-c(c2)[n]->43)cc1
#1
TOP-1
0.38 ± 0.00
NCCCOc1ccc(-c2cc3-c4cccc[n]4->[Ru+2]4<-[n]5ccccc5-c(c2)[n]->43)cc1
#1
TOP-1
0.98 ± 0.02
CC1=CC(C)=[N+]2C1=C(c1ccc(-c3cc4-c5cccc[n]5->[Ru+2]5<-[n]6ccccc6-c(c3)[n]->54)cc1)c1c(C)cc(C)n1[B-]2...
#1
TOP-1
0.25 ± 0.41
CC1=CC(C)=[N+]2C1=C(c1ccc(-c3cc4-c5cccc[n]5->[Ru+2]567(<-[n]8ccccc8-c8cc(-c9ccc(OCCCN)cc9)cc(-c9cccc...
#2
0.01 ± 0.00
NCCCOc1ccc(-c2cc(-c3ccccn3)[n]3->[Ru+2]<-[n]4ccccc4-c3c2)cc1
#2
0.01 ± 0.00
NCCCOc1ccc(-c2cc(-c3ccccn3)[n]3->[Ru+2]<-[n]4ccccc4-c3c2)cc1
#2
0.01 ± 0.00
NCCCOc1ccc(-c2cc(-c3ccccn3)[n]3->[Ru+2]<-[n]4ccccc4-c3c2)cc1
#2
0.01 ± 0.00
NCCCOc1ccc(-c2cc(-c3ccccn3)[n]3->[Ru+2]<-[n]4ccccc4-c3c2)cc1
#2
0.01 ± 0.00
NCCCOc1ccc(-c2cc(-c3ccccn3)[n]3->[Ru+2]<-[n]4ccccc4-c3c2)cc1
#2
0.01 ± 0.00
NCCCOc1ccc(-c2cc(-c3ccccn3)[n]3->[Ru+2]<-[n]4ccccc4-c3c2)cc1
#2
0.01 ± 0.00
NCCCOc1ccc(-c2cc(-c3ccccn3)[n]3->[Ru+2]<-[n]4ccccc4-c3c2)cc1
#2
0.01 ± 0.00
NCCCOc1ccc(-c2cc(-c3ccccn3)[n]3->[Ru+2]<-[n]4ccccc4-c3c2)cc1
#2
0.01 ± 0.00
NCCCOc1ccc(-c2cc(-c3ccccn3)[n]3->[Ru+2]<-[n]4ccccc4-c3c2)cc1
#2
0.16 ± 0.11
CC1=CC(C)=[N+]2C1=C(c1ccc(-c3cc(-c4ccccn4)[n]4->[Ru+2]<-[n]5ccccc5-c4c3)cc1)c1c(C)cc(C)n1[B-]2(F)F
#2
0.09 ± 0.19
CC1=CC(C)=[N+]2C1=C(c1ccc(-c3cc4-c5cccc[n]5->[Ru+2]56(<-[NH2]CCCOc7ccc(-c8cc(-c9ccccn9)nc(-c9cccc[n]...
#3
0.00 ± 0.00
[Ru+2]<-[NH2]CCCOc1ccc(-c2cc(-c3ccccn3)nc(-c3ccccn3)c2)cc1
#3
0.00 ± 0.00
[Ru+2]<-[NH2]CCCOc1ccc(-c2cc(-c3ccccn3)nc(-c3ccccn3)c2)cc1
#3
0.00 ± 0.00
[Ru+2]<-[NH2]CCCOc1ccc(-c2cc(-c3ccccn3)nc(-c3ccccn3)c2)cc1
#3
0.00 ± 0.00
[Ru+2]<-[NH2]CCCOc1ccc(-c2cc(-c3ccccn3)nc(-c3ccccn3)c2)cc1
#3
0.00 ± 0.00
[Ru+2]<-[NH2]CCCOc1ccc(-c2cc(-c3ccccn3)nc(-c3ccccn3)c2)cc1
#3
0.00 ± 0.00
[Ru+2]<-[NH2]CCCOc1ccc(-c2cc(-c3ccccn3)nc(-c3ccccn3)c2)cc1
#3
0.00 ± 0.00
[Ru+2]<-[NH2]CCCOc1ccc(-c2cc(-c3ccccn3)nc(-c3ccccn3)c2)cc1
#3
0.00 ± 0.00
[Ru+2]<-[NH2]CCCOc1ccc(-c2cc(-c3ccccn3)nc(-c3ccccn3)c2)cc1