Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02814441
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 |
APY | 2-AMINOMETHYL-PYRIDINE | A,B,I | 1HIV | 0.74 | |
APY | 2-AMINOMETHYL-PYRIDINE | I | 1IVP | 0.74 | |
GVH | 1H-PYRROLO[2,3-B]PYRIDINE | A | 2UVX | 0.71 | |
2AP | 2-AMINOPYRIDINE | A | 1AEO | 0.84 | |
LG4 | 5-METHYLPYRIDIN-2-AMINE | A | 2EUP | 0.84 | |
275 | 5-amino-1,2-dimethylpyridinium | X | 2RBW | 0.72 | |
BVF | 4-METHYLPYRIDIN-2-AMINE | A,B | 3E67 | 0.83 | |
BVF | 4-METHYLPYRIDIN-2-AMINE | A | 2EUT | 0.83 | |
26D | PYRIDINE-2,6-DIAMINE | A | 2ANZ | 0.77 | |
AT2 | ETHYL 4-[(4-METHYLPYRIDIN-2-YL)AMINO]PIPERIDINE- 1-CARBOXYLATE | A,B | 3E7S | 0.7 | |
AT2 | ETHYL 4-[(4-METHYLPYRIDIN-2-YL)AMINO]PIPERIDINE- 1-CARBOXYLATE | A,B | 3E7M | 0.7 | |
AT2 | ETHYL 4-[(4-METHYLPYRIDIN-2-YL)AMINO]PIPERIDINE- 1-CARBOXYLATE | A,B,C,D | 3E7G | 0.7 | |
3MP | 3-METHYLPYRIDINE | A | 1EUB | 0.72 | |
3MP | 3-METHYLPYRIDINE | A | 1BM6 | 0.72 | |
286 | 2-ethenyl-1-methylpyridinium | X | 2RC2 | 0.71 | |
3AP | 3-AMINOPYRIDINE | A | 1AEF | 0.73 | |
CBQ | [(5-CHLORO-PYRIDIN-2-YLAMINO)-PHOSPHONO- METHYL]-PHOSPHONIC ACID | A,B | 1T1S | 0.74 | |
JI2 | N-{(3S,4S)-4-[(6-aminopyridin-2- yl)methyl]pyrrolidin-3-yl}ethane- 1,2-diamine | A,B | 3B3N | 0.71 | |
JI2 | N-{(3S,4S)-4-[(6-aminopyridin-2- yl)methyl]pyrrolidin-3-yl}ethane- 1,2-diamine | A,B | 3DQR | 0.71 | |
1SQ | ISOQUINOLIN-1-AMINE | A | 2OHK | 0.74 | |
8AP | N~3~-BENZYLPYRIDINE-2,3-DIAMINE | A | 2OHM | 0.76 | |
MPI | IMIDAZO[1,2-A]PYRIDINE | A | 1AEM | 0.72 | |
DA1 | PYRIDINE-2,5-DIAMINE | A | 2AQD | 0.81 | |
1BY | [2-(PYRIDIN-2-YLAMINO)ETHANE-1,1- DIYL]BIS(PHOSPHONIC ACID) | A,B | 2I19 | 0.78 | |
NTN | ISONICOTINAMIDINE | A | 7ADH | 0.75 | |
11X | N-(pyridin-3-ylmethyl)aniline | A | 3EJ0 | 0.72 | |
4AP | 4-AMINOPYRIDINE | A | 1AEG | 0.73 | |
8IP | N~3~-(3-PYRIDIN-3-YLBENZYL)PYRIDINE- 2,3-DIAMINE | A | 2OHR | 0.72 |