3
Candidates
{"N": 6}
Ground Truth
{"N": 12}
Top-1 Prediction
0.500
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
0.30 ± 0.00
COc1cc2c(cc1OCC(=O)Nc1cc3cccnc3c3ncccc13)c(Nc1ccc(F)c(Cl)c1)nc[n]2->[Ru+2]1<-[n]2ccccc2-c2cccc[n]->1...
#1
TOP-1
0.30 ± 0.00
COc1cc2c(cc1OCC(=O)Nc1cc3cccnc3c3ncccc13)c(Nc1ccc(F)c(Cl)c1)nc[n]2->[Ru+2]1<-[n]2ccccc2-c2cccc[n]->1...
#1
TOP-1
0.30 ± 0.00
COc1cc2c(cc1OCC(=O)Nc1cc3cccnc3c3ncccc13)c(Nc1ccc(F)c(Cl)c1)nc[n]2->[Ru+2]1<-[n]2ccccc2-c2cccc[n]->1...
#1
TOP-1
0.30 ± 0.00
COc1cc2c(cc1OCC(=O)Nc1cc3cccnc3c3ncccc13)c(Nc1ccc(F)c(Cl)c1)nc[n]2->[Ru+2]1<-[n]2ccccc2-c2cccc[n]->1...
#1
TOP-1
0.30 ± 0.00
COc1cc2c(cc1OCC(=O)Nc1cc3cccnc3c3ncccc13)c(Nc1ccc(F)c(Cl)c1)nc[n]2->[Ru+2]1<-[n]2ccccc2-c2cccc[n]->1...
#1
TOP-1
0.30 ± 0.00
COc1cc2c(cc1OCC(=O)Nc1cc3cccnc3c3ncccc13)c(Nc1ccc(F)c(Cl)c1)nc[n]2->[Ru+2]1<-[n]2ccccc2-c2cccc[n]->1...
#1
TOP-1
0.30 ± 0.00
COc1cc2c(cc1OCC(=O)Nc1cc3cccnc3c3ncccc13)c(Nc1ccc(F)c(Cl)c1)nc[n]2->[Ru+2]1<-[n]2ccccc2-c2cccc[n]->1...
#1
TOP-1
0.30 ± 0.00
COc1cc2c(cc1OCC(=O)Nc1cc3cccnc3c3ncccc13)c(Nc1ccc(F)c(Cl)c1)nc[n]2->[Ru+2]1<-[n]2ccccc2-c2cccc[n]->1...
#1
TOP-1
0.30 ± 0.00
COc1cc2c(cc1OCC(=O)Nc1cc3cccnc3c3ncccc13)c(Nc1ccc(F)c(Cl)c1)nc[n]2->[Ru+2]1<-[n]2ccccc2-c2cccc[n]->1...
#2
0.05 ± 0.00
COc1cc2c(cc1OCC(=O)Nc1cc3cccnc3c3ncccc13)c(Nc1ccc(F)c(Cl)c1)nc[n]2->[Ru+2]
#2
0.05 ± 0.00
COc1cc2c(cc1OCC(=O)Nc1cc3cccnc3c3ncccc13)c(Nc1ccc(F)c(Cl)c1)nc[n]2->[Ru+2]
#2
0.05 ± 0.00
COc1cc2c(cc1OCC(=O)Nc1cc3cccnc3c3ncccc13)c(Nc1ccc(F)c(Cl)c1)nc[n]2->[Ru+2]
#2
0.05 ± 0.00
COc1cc2c(cc1OCC(=O)Nc1cc3cccnc3c3ncccc13)c(Nc1ccc(F)c(Cl)c1)nc[n]2->[Ru+2]
#2
0.05 ± 0.00
COc1cc2c(cc1OCC(=O)Nc1cc3cccnc3c3ncccc13)c(Nc1ccc(F)c(Cl)c1)nc[n]2->[Ru+2]
#2
0.05 ± 0.00
COc1cc2c(cc1OCC(=O)Nc1cc3cccnc3c3ncccc13)c(Nc1ccc(F)c(Cl)c1)nc[n]2->[Ru+2]
#2
0.05 ± 0.00
COc1cc2c(cc1OCC(=O)Nc1cc3cccnc3c3ncccc13)c(Nc1ccc(F)c(Cl)c1)nc[n]2->[Ru+2]
#2
0.05 ± 0.00
COc1cc2c(cc1OCC(=O)Nc1cc3cccnc3c3ncccc13)c(Nc1ccc(F)c(Cl)c1)nc[n]2->[Ru+2]
#2
0.05 ± 0.00
COc1cc2c(cc1OCC(=O)Nc1cc3cccnc3c3ncccc13)c(Nc1ccc(F)c(Cl)c1)nc[n]2->[Ru+2]
#3
0.04 ± 0.00
COc1cc2c(cc1OCC(=O)Nc1cc3cccnc3c3ncccc13)c(Nc1ccc(F)c(Cl)c1)nc[n]2->[Ru+2]12(<-[n]3ccccc3-c3cccc[n]-...
#3
0.04 ± 0.00
COc1cc2c(cc1OCC(=O)Nc1cc3cccnc3c3ncccc13)c(Nc1ccc(F)c(Cl)c1)nc[n]2->[Ru+2]12(<-[n]3ccccc3-c3cccc[n]-...
#3
0.04 ± 0.00
COc1cc2c(cc1OCC(=O)Nc1cc3cccnc3c3ncccc13)c(Nc1ccc(F)c(Cl)c1)nc[n]2->[Ru+2]12(<-[n]3ccccc3-c3cccc[n]-...
#3
0.04 ± 0.00
COc1cc2c(cc1OCC(=O)Nc1cc3cccnc3c3ncccc13)c(Nc1ccc(F)c(Cl)c1)nc[n]2->[Ru+2]12(<-[n]3ccccc3-c3cccc[n]-...
#3
0.04 ± 0.00
COc1cc2c(cc1OCC(=O)Nc1cc3cccnc3c3ncccc13)c(Nc1ccc(F)c(Cl)c1)nc[n]2->[Ru+2]12(<-[n]3ccccc3-c3cccc[n]-...
#3
0.04 ± 0.00
COc1cc2c(cc1OCC(=O)Nc1cc3cccnc3c3ncccc13)c(Nc1ccc(F)c(Cl)c1)nc[n]2->[Ru+2]12(<-[n]3ccccc3-c3cccc[n]-...
#3
0.04 ± 0.00
COc1cc2c(cc1OCC(=O)Nc1cc3cccnc3c3ncccc13)c(Nc1ccc(F)c(Cl)c1)nc[n]2->[Ru+2]12(<-[n]3ccccc3-c3cccc[n]-...
#3
0.04 ± 0.00
COc1cc2c(cc1OCC(=O)Nc1cc3cccnc3c3ncccc13)c(Nc1ccc(F)c(Cl)c1)nc[n]2->[Ru+2]12(<-[n]3ccccc3-c3cccc[n]-...
#3
0.04 ± 0.00
COc1cc2c(cc1OCC(=O)Nc1cc3cccnc3c3ncccc13)c(Nc1ccc(F)c(Cl)c1)nc[n]2->[Ru+2]12(<-[n]3ccccc3-c3cccc[n]-...
#4
0.02 ± 0.00
COc1cc2ncnc(Nc3ccc(F)c(Cl)c3)c2cc1OCC(=O)Nc1cc2cccnc2c2c1ccc[n]2->[Ru+2]
#4
0.02 ± 0.00
COc1cc2ncnc(Nc3ccc(F)c(Cl)c3)c2cc1OCC(=O)Nc1cc2cccnc2c2c1ccc[n]2->[Ru+2]
#4
0.02 ± 0.00
COc1cc2ncnc(Nc3ccc(F)c(Cl)c3)c2cc1OCC(=O)Nc1cc2cccnc2c2c1ccc[n]2->[Ru+2]