3
Candidates
{"O": 1, "N": 1, "P": 2}
Ground Truth
{"O": 6, "P": 3}
Top-1 Prediction
0.300
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
0.00 ± 0.00
COc1cccc2c1C(=O)c1c3[OH]->[Ru+2][O]c(c4c3[C@@H](O[C@H]3C[C@H](N)[C@H](O)[C@H](C)O3)C[C@](O)(C(=O)CO)...
#1
TOP-1
0.00 ± 0.00
COc1cccc2c1C(=O)c1c3[OH]->[Ru+2][O]c(c4c3[C@@H](O[C@H]3C[C@H](N)[C@H](O)[C@H](C)O3)C[C@](O)(C(=O)CO)...
#1
TOP-1
0.00 ± 0.00
COc1cccc2c1C(=O)c1c3[OH]->[Ru+2][O]c(c4c3[C@@H](O[C@H]3C[C@H](N)[C@H](O)[C@H](C)O3)C[C@](O)(C(=O)CO)...
#1
TOP-1
0.00 ± 0.00
COc1cccc2c1C(=O)c1c3[OH]->[Ru+2][O]c(c4c3[C@@H](O[C@H]3C[C@H](N)[C@H](O)[C@H](C)O3)C[C@](O)(C(=O)CO)...
#1
TOP-1
0.00 ± 0.00
COc1cccc2c1C(=O)c1c3[OH]->[Ru+2][O]c(c4c3[C@@H](O[C@H]3C[C@H](N)[C@H](O)[C@H](C)O3)C[C@](O)(C(=O)CO)...
#1
TOP-1
0.00 ± 0.00
COc1cccc2c1C(=O)c1c3[OH]->[Ru+2][O]c(c4c3[C@@H](O[C@H]3C[C@H](N)[C@H](O)[C@H](C)O3)C[C@](O)(C(=O)CO)...
#1
TOP-1
0.00 ± 0.00
COc1cccc2c1C(=O)c1c3[OH]->[Ru+2][O]c(c4c3[C@@H](O[C@H]3C[C@H](N)[C@H](O)[C@H](C)O3)C[C@](O)(C(=O)CO)...
#1
TOP-1
0.00 ± 0.00
COc1cccc2c1C(=O)c1c3[OH]->[Ru+2][O]c(c4c3[C@@H](O[C@H]3C[C@H](N)[C@H](O)[C@H](C)O3)C[C@](O)(C(=O)CO)...
#1
TOP-1
0.00 ± 0.00
COc1cccc2c1C(=O)c1c3[OH]->[Ru+2][O]c(c4c3[C@@H](O[C@H]3C[C@H](N)[C@H](O)[C@H](C)O3)C[C@](O)(C(=O)CO)...
#2
0.00 ± 0.00
COc1cc[cH]2->[Ru+2][O]c3c4c(c(O)c5c3C(=O)c2c1C5=O)[C@@H](O[C@H]1C[C@H](N)[C@H](O)[C@H](C)O1)C[C@](O)...
#2
0.00 ± 0.00
COc1cc[cH]2->[Ru+2][O]c3c4c(c(O)c5c3C(=O)c2c1C5=O)[C@@H](O[C@H]1C[C@H](N)[C@H](O)[C@H](C)O1)C[C@](O)...
#2
0.00 ± 0.00
COc1cc[cH]2->[Ru+2][O]c3c4c(c(O)c5c3C(=O)c2c1C5=O)[C@@H](O[C@H]1C[C@H](N)[C@H](O)[C@H](C)O1)C[C@](O)...
#2
0.00 ± 0.00
COc1cc[cH]2->[Ru+2][O]c3c4c(c(O)c5c3C(=O)c2c1C5=O)[C@@H](O[C@H]1C[C@H](N)[C@H](O)[C@H](C)O1)C[C@](O)...
#2
0.00 ± 0.00
COc1cc[cH]2->[Ru+2][O]c3c4c(c(O)c5c3C(=O)c2c1C5=O)[C@@H](O[C@H]1C[C@H](N)[C@H](O)[C@H](C)O1)C[C@](O)...
#2
0.00 ± 0.00
COc1cc[cH]2->[Ru+2][O]c3c4c(c(O)c5c3C(=O)c2c1C5=O)[C@@H](O[C@H]1C[C@H](N)[C@H](O)[C@H](C)O1)C[C@](O)...
#2
0.00 ± 0.00
COc1cc[cH]2->[Ru+2][O]c3c4c(c(O)c5c3C(=O)c2c1C5=O)[C@@H](O[C@H]1C[C@H](N)[C@H](O)[C@H](C)O1)C[C@](O)...
#2
0.00 ± 0.00
COc1cc[cH]2->[Ru+2][O]c3c4c(c(O)c5c3C(=O)c2c1C5=O)[C@@H](O[C@H]1C[C@H](N)[C@H](O)[C@H](C)O1)C[C@](O)...
#2
0.00 ± 0.00
COc1cc[cH]2->[Ru+2][O]c3c4c(c(O)c5c3C(=O)c2c1C5=O)[C@@H](O[C@H]1C[C@H](N)[C@H](O)[C@H](C)O1)C[C@](O)...
#3
0.00 ± 0.00
COc1c[cH]2->[Ru+2][O]c3c4c(c(O)c5c3C(=O)c(c2)c1C5=O)[C@@H](O[C@H]1C[C@H](N)[C@H](O)[C@H](C)O1)C[C@](...
#3
0.00 ± 0.00
COc1c[cH]2->[Ru+2][O]c3c4c(c(O)c5c3C(=O)c(c2)c1C5=O)[C@@H](O[C@H]1C[C@H](N)[C@H](O)[C@H](C)O1)C[C@](...
#3
0.00 ± 0.00
COc1c[cH]2->[Ru+2][O]c3c4c(c(O)c5c3C(=O)c(c2)c1C5=O)[C@@H](O[C@H]1C[C@H](N)[C@H](O)[C@H](C)O1)C[C@](...
#3
0.00 ± 0.00
COc1c[cH]2->[Ru+2][O]c3c4c(c(O)c5c3C(=O)c(c2)c1C5=O)[C@@H](O[C@H]1C[C@H](N)[C@H](O)[C@H](C)O1)C[C@](...
#3
0.00 ± 0.00
COc1c[cH]2->[Ru+2][O]c3c4c(c(O)c5c3C(=O)c(c2)c1C5=O)[C@@H](O[C@H]1C[C@H](N)[C@H](O)[C@H](C)O1)C[C@](...
#3
0.00 ± 0.00
COc1c[cH]2->[Ru+2][O]c3c4c(c(O)c5c3C(=O)c(c2)c1C5=O)[C@@H](O[C@H]1C[C@H](N)[C@H](O)[C@H](C)O1)C[C@](...
#3
0.00 ± 0.00
COc1c[cH]2->[Ru+2][O]c3c4c(c(O)c5c3C(=O)c(c2)c1C5=O)[C@@H](O[C@H]1C[C@H](N)[C@H](O)[C@H](C)O1)C[C@](...
#3
0.00 ± 0.00
COc1c[cH]2->[Ru+2][O]c3c4c(c(O)c5c3C(=O)c(c2)c1C5=O)[C@@H](O[C@H]1C[C@H](N)[C@H](O)[C@H](C)O1)C[C@](...
#3
0.00 ± 0.00
COc1c[cH]2->[Ru+2][O]c3c4c(c(O)c5c3C(=O)c(c2)c1C5=O)[C@@H](O[C@H]1C[C@H](N)[C@H](O)[C@H](C)O1)C[C@](...
#4
0.00 ± 0.00
COc1cccc2c1C(=O)c1c(O)c3c(c([O-])c1C2=O)C[C@@](O)(C(=O)CO)C[C@@H]3O[C@H]1C[C@H]([NH2]->[Ru+3])[C@H](...
#4
0.00 ± 0.00
COc1cccc2c1C(=O)c1c(O)c3c(c([O-])c1C2=O)C[C@@](O)(C(=O)CO)C[C@@H]3O[C@H]1C[C@H]([NH2]->[Ru+3])[C@H](...
#4
0.00 ± 0.00
COc1cccc2c1C(=O)c1c(O)c3c(c([O-])c1C2=O)C[C@@](O)(C(=O)CO)C[C@@H]3O[C@H]1C[C@H]([NH2]->[Ru+3])[C@H](...