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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] |
*** | ZEI | 0.692 | 4Y4 | 0.690 | N0E | 0.680 | V85 | 0.680 |
BN5 | 0.606 | 1PB | 0.600 | KRA | 0.593 | RAC | 0.581 | JYZ | 0.567 |
HOF | 0.562 |
Nrank | Protein | Nresidue | pdb_id+asym_id |
1 | Fab 29G12 light chain | 213 |
[RAC]:![]() |
2 | Fab 29G12 heavy chain | 211 |
[RAC]:![]() |
3 | Q3Y6H8_PSEAI Neutral metalloproteinase | 298 |
[V85]:![]() |
4 | CSK21_HUMAN Casein kinase II subunit alpha | 328 |
[JYZ]:![]() |
5 | R1AB_SARS2 Helicase | 585 |
[N0E]:![]() |
6 | SCN5A_RAT:SCN5A_RAT:SCN5A_RAT:B7UCZ6_9RHAB Sodium channel protein type 5 subunit alpha,Sodium channel protein type 5 subunit alpha,Sodium channel protein type 5 subunit alpha,G protein/GFP fusion protein | 1118 |
[4Y4]:![]() |
7 | POLG_SOUV3 Genome polyprotein | 172 |
[N0E]:![]() ![]() |
8 | AOFB_HUMAN AMINE OXIDASE [FLAVIN-CONTAINING] B | 499 |
[1PB]:![]() ![]() |
9 | PYRI4_STRRG Spiro-conjugate synthase | 163 |
[HOF]:![]() ![]() ![]() ![]() |
10 | PHS2_RABIT Glycogen phosphorylase, muscle form | 816 |
[BN5]:![]() ![]() ![]() ![]() |
11 | TRPV1_HUMAN Transient receptor potential cation channel subfamily V member 1 | 531 |
[ZEI]:![]() ![]() ![]() ![]() ![]() ![]() ![]() ![]() |