Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02410683
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 |
CII | N-[(1S)-2-methyl-1-(pyridin-4-ylcarbamoyl)propyl]cyclohexanecarboxamide | A | 2W0A | 0.71 | |
BVF | 4-METHYLPYRIDIN-2-AMINE | A,B | 3E67 | 0.71 | |
BVF | 4-METHYLPYRIDIN-2-AMINE | A | 2EUT | 0.71 | |
D4G | A,B,C,D | 2FDY | 0.7 | ||
2AP | 2-AMINOPYRIDINE | A | 1AEO | 0.77 | |
11X | N-(pyridin-3-ylmethyl)aniline | A | 3EJ0 | 0.79 | |
3MP | 3-METHYLPYRIDINE | A | 1EUB | 0.72 | |
3MP | 3-METHYLPYRIDINE | A | 1BM6 | 0.72 | |
4AP | 4-AMINOPYRIDINE | A | 1AEG | 0.9 | |
8AP | N~3~-BENZYLPYRIDINE-2,3-DIAMINE | A | 2OHM | 0.74 | |
Y27 | (R)-TRANS-4-(1-AMINOETHYL)-N-(4- PYRIDYL) CYCLOHEXANECARBOXAMIDE | A | 2GNF | 0.71 | |
Y27 | (R)-TRANS-4-(1-AMINOETHYL)-N-(4- PYRIDYL) CYCLOHEXANECARBOXAMIDE | A | 2H9V | 0.71 | |
Y27 | (R)-TRANS-4-(1-AMINOETHYL)-N-(4- PYRIDYL) CYCLOHEXANECARBOXAMIDE | A,B | 2ETR | 0.71 | |
Y27 | (R)-TRANS-4-(1-AMINOETHYL)-N-(4- PYRIDYL) CYCLOHEXANECARBOXAMIDE | A | 2GNJ | 0.71 | |
Y27 | (R)-TRANS-4-(1-AMINOETHYL)-N-(4- PYRIDYL) CYCLOHEXANECARBOXAMIDE | A | 1Q8T | 0.71 | |
286 | 2-ethenyl-1-methylpyridinium | X | 2RC2 | 0.74 | |
APY | 2-AMINOMETHYL-PYRIDINE | A,B,I | 1HIV | 0.82 | |
APY | 2-AMINOMETHYL-PYRIDINE | I | 1IVP | 0.82 | |
DA1 | PYRIDINE-2,5-DIAMINE | A | 2AQD | 0.79 | |
5IQ | ISOQUINOLIN-5-AMINE | A,B | 2F2T | 0.7 | |
245 | 1-(2-chloropyridin-4-yl)-3-phenylurea | A | 2QKN | 0.73 | |
278 | 1-(1-methyl-1H-pyrrol-2-yl)methanamine | X | 2RBV | 0.74 | |
8IP | N~3~-(3-PYRIDIN-3-YLBENZYL)PYRIDINE- 2,3-DIAMINE | A | 2OHR | 0.7 | |
I11 | [[CYCLOHEXANESULFONYL-GLYCYL]-3[PYRIDIN- 4-YL-AMINOMETHYL]ALANYL]PIPERIDINE | H | 1UVS | 0.7 | |
LG4 | 5-METHYLPYRIDIN-2-AMINE | A | 2EUP | 0.71 | |
9DA | 9-DEAZAADENINE | A | 1L1R | 0.76 | |
9DA | 9-DEAZAADENINE | A | 1L1Q | 0.76 | |
275 | 5-amino-1,2-dimethylpyridinium | X | 2RBW | 0.82 | |
HBP | 1,7-HEPTYLENE-BIS-N,N'-SYN-2-PYRIDINIUMALDOXIME | A,B | 2GYV | 0.7 | |
HBP | 1,7-HEPTYLENE-BIS-N,N'-SYN-2-PYRIDINIUMALDOXIME | A,B | 2JF0 | 0.7 | |
3AP | 3-AMINOPYRIDINE | A | 1AEF | 0.9 | |
NTN | ISONICOTINAMIDINE | A | 7ADH | 0.73 |