Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03626139
You can sort the columns by Ligand, Ligand name, PDB and Tanimoto.
You can sort the columns by Ligand, Ligand name, PDB and Tanimoto.
| Ligand | Ligand name | Chain | PDB | Tanimoto | Ligand in PDB |
|---|---|---|---|---|---|
| Ligand | Ligand name | Chain | PDB | Tanimoto | Ligand in PDB |
721 | 3-butoxy-1-(2,2-diphosphonoethyl)pyridinium | A,B | 3DYH | 0.88 |  |
9IP | N~3~-[3-(5-METHOXYPYRIDIN-3-YL)BENZYL]PYRIDINE- 2,3-DIAMINE | A | 2OHS | 0.72 | |
PY7 | PYRIDIN-4-YLMETHANOL | A | 2EUR | 0.73 | |
286 | 2-ethenyl-1-methylpyridinium | X | 2RC2 | 0.71 | |
TCD | 3,5-DICHLORO-2-{4-[(3,5-DICHLOROPYRIDIN- 2-YL)OXY]PHENOXY}PYRIDINE | A,B,C,D,E,F, G,H | 1XLS | 0.7 | |
3IP | 3-(BENZYLOXY)PYRIDIN-2-AMINE | A | 1W7H | 0.78 | |
LI4 | 3-(1-NAPHTHYLMETHOXY)PYRIDIN-2- AMINE | A | 1WBW | 0.73 | |
H86 | 3-(decyloxy)-5-(3,5-difluorophenyl)- 1-(2,2-diphosphonoethyl)pyridinium | A,B | 2Z78 | 0.74 | |
282 | 3-methoxypyridine | X | 2RBZ | 0.98 | |
714 | 1-(2,2-diphosphonoethyl)-3-(octyloxy)pyridinium | A,B | 3EFQ | 0.85 | |
4PY | (2S)-1-(6H-INDOL-3-YL)-3-{[5-(7H- PYRAZOLO[3,4-C]PYRIDIN-5-YL)PYRIDIN- 3-YL]OXY}PROPAN-2-AMINE | E | 2OJF | 0.74 | |
D1G | N,N-DIMETHYL(5-(PYRIDIN-3-YL)FURAN- 2-YL)METHANAMINE | A,B,C,D | 2FDU | 0.7 | |
PYF | 3-PYRIDINYLCARBINOL | A,B | 1R16 | 0.71 | |
722 | 1-(2,2-diphosphonoethyl)-3-(heptyloxy)pyridinium | A,B | 3EGT | 0.86 | |
B71 | 3-(DECYLOXY)-1-(2,2-DIPHOSPHONOETHYL)PYRIDINIUM | A,B | 2ZEU | 0.84 | |
| B71 | 3-(DECYLOXY)-1-(2,2-DIPHOSPHONOETHYL)PYRIDINIUM | A,B | 2ZEV | 0.84 | |