Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00099814
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 |
KET | 2-[(3-HYDROXY-2-METHYL-5-PHOSPHONOOXYMETHYL- PYRIDIN-4-YLMETHYLENE)-AMINO]-SUCCINIC ACID | A | 1MAP | 0.71 | |
NA4 | 4-[5-(2-CARBOXY-1-FORMYL-ETHYLCARBAMOYL)- PYRIDIN-3-YL]-BENZOIC ACID | A,C | 1RHM | 0.74 | |
4HG | N-[(4-HYDROXY-8-IODOISOQUINOLIN- 3-YL)CARBONYL]GLYCINE | A | 2G19 | 0.73 | |
4HG | N-[(4-HYDROXY-8-IODOISOQUINOLIN- 3-YL)CARBONYL]GLYCINE | A | 2G1M | 0.73 | |
NCA | NICOTINAMIDE | A,B | 2E5D | 0.73 | |
NCA | NICOTINAMIDE | A,B,C,D | 2Z77 | 0.73 | |
NCA | NICOTINAMIDE | A,B | 1DMA | 0.73 | |
NCA | NICOTINAMIDE | A,B | 1ISM | 0.73 | |
NCA | NICOTINAMIDE | A,B | 1YC5 | 0.73 | |
NCA | NICOTINAMIDE | A | 2ZB7 | 0.73 | |
NCA | NICOTINAMIDE | A,B,C,D,E,F, G,H | 1R15 | 0.73 | |
NCA | NICOTINAMIDE | A,B | 2QQG | 0.73 | |
NCA | NICOTINAMIDE | A | 2OTV | 0.73 | |
NCA | NICOTINAMIDE | A | 2QHF | 0.73 | |
NCA | NICOTINAMIDE | A,B,C,D | 2C8A | 0.73 | |
NCA | NICOTINAMIDE | A,B | 2HJH | 0.73 | |
NCA | NICOTINAMIDE | A | 2A15 | 0.73 | |
NCA | NICOTINAMIDE | A | 2R6V | 0.73 | |
NCA | NICOTINAMIDE | A,B | 1ISI | 0.73 | |
NCA | NICOTINAMIDE | A,D,E | 2R9J | 0.73 | |
NCA | NICOTINAMIDE | A | 2H4J | 0.73 | |
NCA | NICOTINAMIDE | A,B | 2OD9 | 0.73 | |
NCA | NICOTINAMIDE | A,B,C,D,E | 1YC2 | 0.73 | |
NCA | NICOTINAMIDE | A,B | 3DZG | 0.73 | |
NCA | NICOTINAMIDE | A | 1OJU | 0.73 | |
NNO | 6-HYDROXYISONICOTINIC ACID N-OXIDE | M,N,O,P,Q,R | 3PCK | 0.75 | |
NNO | 6-HYDROXYISONICOTINIC ACID N-OXIDE | M,N,O,P,Q,R | 3PCM | 0.75 | |
PD2 | PYRIDINE-2,4-DICARBOXYLIC ACID | A,B,C | 2W2I | 0.7 | |
PD2 | PYRIDINE-2,4-DICARBOXYLIC ACID | A | 2GKL | 0.7 | |
PD2 | PYRIDINE-2,4-DICARBOXYLIC ACID | A,B | 2VD7 | 0.7 | |
PD2 | PYRIDINE-2,4-DICARBOXYLIC ACID | A,B | 2JIG | 0.7 | |
NA3 | (3S)-3-{[(5-BROMOPYRIDIN-3-YL)CARBONYL]AMINO}- 4-OXOBUTANOIC ACID | A | 1RE1 | 0.74 | |
NIO | NICOTINIC ACID | A | 1JHQ | 0.73 | |
NIO | NICOTINIC ACID | A | 1L5L | 0.73 | |
NIO | NICOTINIC ACID | A | 2F7F | 0.73 | |
NIO | NICOTINIC ACID | A | 1L5K | 0.73 | |
NIO | NICOTINIC ACID | A | 1JHY | 0.73 | |
NIO | NICOTINIC ACID | A,B | 1FSL | 0.73 | |
NIO | NICOTINIC ACID | A | 1L5M | 0.73 | |
NIO | NICOTINIC ACID | A | 1LH6 | 0.73 | |
NIO | NICOTINIC ACID | A | 1JHO | 0.73 | |
NIO | NICOTINIC ACID | A | 3CI8 | 0.73 | |
NIO | NICOTINIC ACID | A,B,C,D | 1ICU | 0.73 | |
NIO | NICOTINIC ACID | A,B,C,D,E,F, G,H | 3HRD | 0.73 | |
NIO | NICOTINIC ACID | A | 1JHA | 0.73 | |
NIO | NICOTINIC ACID | A | 1JHV | 0.73 | |
NIO | NICOTINIC ACID | A | 1L4N | 0.73 | |
NIO | NICOTINIC ACID | A | 2LH6 | 0.73 | |
NIO | NICOTINIC ACID | A | 1D0V | 0.73 | |
NIO | NICOTINIC ACID | A,B,C,D | 1ICV | 0.73 | |
NIO | NICOTINIC ACID | A,B | 1ICR | 0.73 | |
NIO | NICOTINIC ACID | A | 1JHR | 0.73 | |
PYC | PYRROLE-2-CARBOXYLATE | A | 1W62 | 0.71 | |
PYC | PYRROLE-2-CARBOXYLATE | A,B | 1L9D | 0.71 | |
PYC | PYRROLE-2-CARBOXYLATE | A,B | 2CWH | 0.71 | |
PYC | PYRROLE-2-CARBOXYLATE | A,B | 1W61 | 0.71 | |
PYC | PYRROLE-2-CARBOXYLATE | A,B | 1ELI | 0.71 | |
NTM | QUINOLINIC ACID | A | 3C2O | 0.73 | |
NTM | QUINOLINIC ACID | A,B | 1QAP | 0.73 | |
NTM | QUINOLINIC ACID | A,B,C,D,E,F | 1QPQ | 0.73 | |
NTM | QUINOLINIC ACID | A,B,C | 2B7N | 0.73 | |
INO | 2-HYDROXYISONICOTINIC ACID N-OXIDE | M,N,O,P,Q,R | 3PCL | 0.72 | |
INO | 2-HYDROXYISONICOTINIC ACID N-OXIDE | M,N,O,P,Q,R | 3PCJ | 0.72 | |
POI | N~2~-ACETYL-N~5~-({3-HYDROXY-2- METHYL-5-[(PHOSPHONOOXY)METHYL]PYRIDIN- 4-YL}METHYL)-L-ORNITHINE | A,B | 1WKG | 0.72 | |
PYX | S-[S-THIOPYRIDOXAMINYL]CYSTEINE | A,B | 1A2D | 0.7 | |
3HM | 5-hydroxy-6-methylpyridine-3-carboxylic acid | A,B | 3GMC | 0.78 | |
ORX | N~2~-({3-HYDROXY-2-METHYL-5-[(PHOSPHONOOXY)METHYL]PYRIDIN- 4-YL}METHYL)-D-ORNITHINE | A,B,C,D | 1SZR | 0.7 | |
ORX | N~2~-({3-HYDROXY-2-METHYL-5-[(PHOSPHONOOXY)METHYL]PYRIDIN- 4-YL}METHYL)-D-ORNITHINE | A,B,C,D | 1NJJ | 0.7 | |
BRT | 5-BROMONICOTINAMIDE | A,B | 1GXZ | 0.71 | |
D2G | N-METHYL(5-(PYRIDIN-3-YL)FURAN- 2-YL)METHANAMINE | A,B,C,D | 2FDV | 0.7 |