Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02805361
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 |
364 | 3-BIPHENYL-3-YL-1-(2-HYDROXY-2,2- DIPHOSPHONOETHYL)PYRIDINIUM | A,B | 2E94 | 0.71 |  |
PLR | (5-HYDROXY-4,6-DIMETHYLPYRIDIN- 3-YL)METHYL DIHYDROGEN PHOSPHATE | A,B | 3GZC | 0.72 | |
| PLR | (5-HYDROXY-4,6-DIMETHYLPYRIDIN- 3-YL)METHYL DIHYDROGEN PHOSPHATE | A | 2GJ4 | 0.72 | |
| PLR | (5-HYDROXY-4,6-DIMETHYLPYRIDIN- 3-YL)METHYL DIHYDROGEN PHOSPHATE | A | 2GM9 | 0.72 | |
| PLR | (5-HYDROXY-4,6-DIMETHYLPYRIDIN- 3-YL)METHYL DIHYDROGEN PHOSPHATE | A,B | 2IEG | 0.72 | |
| PLR | (5-HYDROXY-4,6-DIMETHYLPYRIDIN- 3-YL)METHYL DIHYDROGEN PHOSPHATE | A,B | 2IEI | 0.72 | |
| PLR | (5-HYDROXY-4,6-DIMETHYLPYRIDIN- 3-YL)METHYL DIHYDROGEN PHOSPHATE | A,B,C,D,E,F | 3FZ8 | 0.72 | |
| PLR | (5-HYDROXY-4,6-DIMETHYLPYRIDIN- 3-YL)METHYL DIHYDROGEN PHOSPHATE | A,B,C,D,E,F | 1PMO | 0.72 | |
| PLR | (5-HYDROXY-4,6-DIMETHYLPYRIDIN- 3-YL)METHYL DIHYDROGEN PHOSPHATE | A,B,C,D,E,F | 3FSL | 0.72 | |
| PLR | (5-HYDROXY-4,6-DIMETHYLPYRIDIN- 3-YL)METHYL DIHYDROGEN PHOSPHATE | A | 2CFB | 0.72 | |
| PLR | (5-HYDROXY-4,6-DIMETHYLPYRIDIN- 3-YL)METHYL DIHYDROGEN PHOSPHATE | A,B,C,D | 3GZD | 0.72 | |
PAA | (N-METHYLPYRIDYL)ACETIC ACID | I | 1HBT | 0.79 | |
PYF | 3-PYRIDINYLCARBINOL | A,B | 1R16 | 0.84 | |
RIS | 1-HYDROXY-2-(3-PYRIDINYL)ETHYLIDENE BIS- PHOSPHONIC ACID | A | 1YV5 | 0.85 | |
| RIS | 1-HYDROXY-2-(3-PYRIDINYL)ETHYLIDENE BIS- PHOSPHONIC ACID | A,B | 1RQJ | 0.85 | |
| RIS | 1-HYDROXY-2-(3-PYRIDINYL)ETHYLIDENE BIS- PHOSPHONIC ACID | A | 1YQ7 | 0.85 | |
| RIS | 1-HYDROXY-2-(3-PYRIDINYL)ETHYLIDENE BIS- PHOSPHONIC ACID | A | 1YHL | 0.85 | |
| RIS | 1-HYDROXY-2-(3-PYRIDINYL)ETHYLIDENE BIS- PHOSPHONIC ACID | A | 2QIS | 0.85 | |
| RIS | 1-HYDROXY-2-(3-PYRIDINYL)ETHYLIDENE BIS- PHOSPHONIC ACID | A,B | 2O1O | 0.85 | |
PXP | PYRIDOXINE-5'-PHOSPHATE | A,B,C,D | 1HO4 | 0.71 | |
| PXP | PYRIDOXINE-5'-PHOSPHATE | A,B,C,D,E,F, G,H | 3F4N | 0.71 | |
| PXP | PYRIDOXINE-5'-PHOSPHATE | A,B,C,D | 1SZR | 0.71 | |
218 | 1-[(4-AMINO-2-METHYLPYRIMIDIN-5- YL)METHYL]-3-(2-HYDROXYETHYL)-2- METHYLPYRIDINIUM | A | 2HOP | 0.74 | |
NI9 | 3-FLUORO-1-(2-HYDROXY-2,2-DIPHOSPHONOETHYL)PYRIDINIUM | A | 2OPM | 0.7 | |
| NI9 | 3-FLUORO-1-(2-HYDROXY-2,2-DIPHOSPHONOETHYL)PYRIDINIUM | A,B | 3DYF | 0.7 | |
| NI9 | 3-FLUORO-1-(2-HYDROXY-2,2-DIPHOSPHONOETHYL)PYRIDINIUM | A,B | 3DYG | 0.7 | |
BVF | 4-METHYLPYRIDIN-2-AMINE | A,B | 3E67 | 0.71 | |
| BVF | 4-METHYLPYRIDIN-2-AMINE | A | 2EUT | 0.71 | |
TSC | (1S)-1-AMINO-2-(1H-INDOL-3-YL)ETHANOL | D,H | 2AH0 | 0.71 | |
| TSC | (1S)-1-AMINO-2-(1H-INDOL-3-YL)ETHANOL | D,H | 2AGZ | 0.71 | |
PY7 | PYRIDIN-4-YLMETHANOL | A | 2EUR | 0.85 | |
PY2 | 3-(MERCAPTOMETHYLENE)PYRIDINE | A,B | 1IDA | 0.75 | |
LG4 | 5-METHYLPYRIDIN-2-AMINE | A | 2EUP | 0.72 | |
APY | 2-AMINOMETHYL-PYRIDINE | A,B,I | 1HIV | 0.7 | |
| APY | 2-AMINOMETHYL-PYRIDINE | I | 1IVP | 0.7 | |
PXM | 4-(AMINOMETHYL)-5-(HYDROXYMETHYL)- 2-METHYLPYRIDIN-3-OL | A | 1RFT | 0.74 | |
| PXM | 4-(AMINOMETHYL)-5-(HYDROXYMETHYL)- 2-METHYLPYRIDIN-3-OL | A,B | 2Z9V | 0.74 | |
3MP | 3-METHYLPYRIDINE | A | 1EUB | 0.8 | |
| 3MP | 3-METHYLPYRIDINE | A | 1BM6 | 0.8 | |
286 | 2-ethenyl-1-methylpyridinium | X | 2RC2 | 0.74 | |
P0P | [4-(DIHYDROXYMETHYL)-5-HYDROXY- 6-METHYLPYRIDIN-3-YL]METHYL DIHYDROGEN PHOSPHATE | A,B | 2GMS | 0.7 | |
11X | N-(pyridin-3-ylmethyl)aniline | A | 3EJ0 | 0.73 | |
5IQ | ISOQUINOLIN-5-AMINE | A,B | 2F2T | 0.7 | |
DRP | 2-DEOXYRIBOFURANOSYL-PYRIDINE-5'- MONOPHOSPHATE | A,B | 1JES | 0.74 | |
NTN | ISONICOTINAMIDINE | A | 7ADH | 0.74 | |
ISQ | ISOQUINOLINE | A | 1GDK | 0.74 | |
OBI | 1,1'-(OXYDIMETHYLENE)BIS(4-FORMYLPYRIDINIUM)DIOXIME | A,B | 2GYW | 0.76 | |
NCT | (S)-3-(1-METHYLPYRROLIDIN-2-YL)PYRIDINE | A,B,C,D,E,F, G,H,I,J,K,L, M,N,O,P,Q,R, S,T | 1UW6 | 0.77 | |
| NCT | (S)-3-(1-METHYLPYRROLIDIN-2-YL)PYRIDINE | A | 1P2Y | 0.77 | |
| NCT | (S)-3-(1-METHYLPYRROLIDIN-2-YL)PYRIDINE | A | 1P7R | 0.77 | |
11P | [(7R)-6,7-dihydro-5H-cyclopenta[c]pyridin- 7-yl(hydroxy)methylene]bis(phosphonic acid) | A | 2RAH | 0.79 | |
NIO | NICOTINIC ACID | A | 1JHQ | 0.71 | |
| NIO | NICOTINIC ACID | A | 1L5L | 0.71 | |
| NIO | NICOTINIC ACID | A | 2F7F | 0.71 | |
| NIO | NICOTINIC ACID | A | 1L5K | 0.71 | |
| NIO | NICOTINIC ACID | A | 1JHY | 0.71 | |
| NIO | NICOTINIC ACID | A,B | 1FSL | 0.71 | |
| NIO | NICOTINIC ACID | A | 1L5M | 0.71 | |
| NIO | NICOTINIC ACID | A | 1LH6 | 0.71 | |
| NIO | NICOTINIC ACID | A | 1JHO | 0.71 | |
| NIO | NICOTINIC ACID | A | 3CI8 | 0.71 | |
| NIO | NICOTINIC ACID | A,B,C,D | 1ICU | 0.71 | |
| NIO | NICOTINIC ACID | A,B,C,D,E,F, G,H | 3HRD | 0.71 | |
| NIO | NICOTINIC ACID | A | 1JHA | 0.71 | |
| NIO | NICOTINIC ACID | A | 1JHV | 0.71 | |
| NIO | NICOTINIC ACID | A | 1L4N | 0.71 | |
| NIO | NICOTINIC ACID | A | 2LH6 | 0.71 | |
| NIO | NICOTINIC ACID | A | 1D0V | 0.71 | |
| NIO | NICOTINIC ACID | A,B,C,D | 1ICV | 0.71 | |
| NIO | NICOTINIC ACID | A,B | 1ICR | 0.71 | |
| NIO | NICOTINIC ACID | A | 1JHR | 0.71 | |
PBO | 1-PYRIDIN-3-YLBUTAN-1-ONE | A | 1PYJ | 0.73 | |
PRR | 3-(METHYL-PYRIDINIUM)ALANINE | H,I,J | 7KME | 0.74 | |