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threshold chemical similarty (tanimoto coefficient) |
[0.5] [0.6] [0.7] [0.8] [0.9] [1.0] | max number of compounds | [1] [5] [10] [20] [30] [40] [50] |
compound | similarity | compound | similarity | compound | similarity | compound | similarity | compound | similarity |
query [2D] [3D] |
*** | 16B | 0.731 | 48C | 0.731 | 7OK | 0.731 | 7K8 | 0.692 |
NOH | 0.692 | 48O | 0.679 | B8T | 0.667 | BQO | 0.667 | CMR | 0.654 |
MMT | 0.654 |
Nrank | Protein | Nresidue | pdb_id+asym_id |
1 | BGAT_HUMAN Histo-blood group ABO system transferase | 281 |
[48C]:![]() ![]() |
2 | UMPS_HUMAN Uridine 5'-monophosphate synthase | 256 |
[16B]:![]() ![]() ![]() ![]() |
3 | Q9NDD3_TRISP Thymidylate synthase | 287 |
[7K8]:![]() ![]() ![]() ![]() |
4 | Q9Y052_CAEEL Thymidylate synthase | 289 |
[NOH]:![]() ![]() ![]() ![]() |
5 | TYSY_MOUSE Thymidylate synthase | 283 |
[NOH]:![]() ![]() ![]() ![]() ![]() ![]() ![]() ![]() ![]() ![]() ![]() ![]() |