Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03801831
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 |
HQU![]() | 3-HYDROXYQUINALDIC ACID | C,D | 193D | 0.75 | ![]() |
R69![]() | N-[4-({4-[5-(DIMETHYLAMINO)-2-HYDROXYBENZOYL]BENZOYL}AMINO)AZEPAN- 3-YL]ISONICOTINAMIDE | A | 1XH4 | 0.73 | ![]() |
R69![]() | N-[4-({4-[5-(DIMETHYLAMINO)-2-HYDROXYBENZOYL]BENZOYL}AMINO)AZEPAN- 3-YL]ISONICOTINAMIDE | A | 1XH9 | 0.73 | ![]() |
LG2![]() | 6-[1-(3,5,5,8,8-PENTAMETHYL-5,6,7,8- TETRAHYDRONAPHTHALEN-2-YL)CYCLOPROPYL]PYRIDINE- 3-CARBOXYLIC ACID | A,B,C,D | 1H9U | 0.72 | ![]() |
KAM![]() | N-[7-KETO-8-AMINOPELARGONIC ACID]- [3-HYDROXY-2-METHYL-5-PHOSPHONOOXYMETHYL- PYRIDIN-4-YL-METHANE] | A | 1DJ9 | 0.7 | ![]() |
PYU![]() | 2-(1H-pyrrol-1-ylcarbonyl)benzene- 1,3,5-triol | A,B | 3EKO | 0.71 | ![]() |
PMC![]() | 3-(PHOSPHONOMETHYL)PYRIDINE-2-CARBOXYLIC ACID | A,B,C,D,E,F, G,H,I,J,K,L | 1I43 | 0.72 | ![]() |
6PC![]() | PYRIDINE-2-CARBOXYLIC ACID | A | 2OLN | 0.72 | ![]() |
6PC![]() | PYRIDINE-2-CARBOXYLIC ACID | A | 2OLO | 0.72 | ![]() |
NNO![]() | 6-HYDROXYISONICOTINIC ACID N-OXIDE | M,N,O,P,Q,R | 3PCK | 0.72 | ![]() |
NNO![]() | 6-HYDROXYISONICOTINIC ACID N-OXIDE | M,N,O,P,Q,R | 3PCM | 0.72 | ![]() |
4HG![]() | N-[(4-HYDROXY-8-IODOISOQUINOLIN- 3-YL)CARBONYL]GLYCINE | A | 2G19 | 0.78 | ![]() |
4HG![]() | N-[(4-HYDROXY-8-IODOISOQUINOLIN- 3-YL)CARBONYL]GLYCINE | A | 2G1M | 0.78 | ![]() |
3HM![]() | 5-hydroxy-6-methylpyridine-3-carboxylic acid | A,B | 3GMC | 0.76 | ![]() |
PD2![]() | PYRIDINE-2,4-DICARBOXYLIC ACID | A,B,C | 2W2I | 0.75 | ![]() |
PD2![]() | PYRIDINE-2,4-DICARBOXYLIC ACID | A | 2GKL | 0.75 | ![]() |
PD2![]() | PYRIDINE-2,4-DICARBOXYLIC ACID | A,B | 2VD7 | 0.75 | ![]() |
PD2![]() | PYRIDINE-2,4-DICARBOXYLIC ACID | A,B | 2JIG | 0.75 | ![]() |
NIO![]() | NICOTINIC ACID | A | 1JHQ | 0.7 | ![]() |
NIO![]() | NICOTINIC ACID | A | 1L5L | 0.7 | ![]() |
NIO![]() | NICOTINIC ACID | A | 2F7F | 0.7 | ![]() |
NIO![]() | NICOTINIC ACID | A | 1L5K | 0.7 | ![]() |
NIO![]() | NICOTINIC ACID | A | 1JHY | 0.7 | ![]() |
NIO![]() | NICOTINIC ACID | A,B | 1FSL | 0.7 | ![]() |
NIO![]() | NICOTINIC ACID | A | 1L5M | 0.7 | ![]() |
NIO![]() | NICOTINIC ACID | A | 1LH6 | 0.7 | ![]() |
NIO![]() | NICOTINIC ACID | A | 1JHO | 0.7 | ![]() |
NIO![]() | NICOTINIC ACID | A | 3CI8 | 0.7 | ![]() |
NIO![]() | NICOTINIC ACID | A,B,C,D | 1ICU | 0.7 | ![]() |
NIO![]() | NICOTINIC ACID | A,B,C,D,E,F, G,H | 3HRD | 0.7 | ![]() |
NIO![]() | NICOTINIC ACID | A | 1JHA | 0.7 | ![]() |
NIO![]() | NICOTINIC ACID | A | 1JHV | 0.7 | ![]() |
NIO![]() | NICOTINIC ACID | A | 1L4N | 0.7 | ![]() |
NIO![]() | NICOTINIC ACID | A | 2LH6 | 0.7 | ![]() |
NIO![]() | NICOTINIC ACID | A | 1D0V | 0.7 | ![]() |
NIO![]() | NICOTINIC ACID | A,B,C,D | 1ICV | 0.7 | ![]() |
NIO![]() | NICOTINIC ACID | A,B | 1ICR | 0.7 | ![]() |
NIO![]() | NICOTINIC ACID | A | 1JHR | 0.7 | ![]() |
QND![]() | QUINALDIC ACID | A,B | 1IDA | 0.71 | ![]() |
PXG![]() | 3-[O-PHOSPHONOPYRIDOXYL]--AMINO- BENZOIC ACID | A | 1B9I | 0.75 | ![]() |
PXL![]() | 3-HYDROXY-5-(HYDROXYMETHYL)-2-METHYLISONICOTINALDEHYDE | A,B | 3FHX | 0.71 | ![]() |
PXL![]() | 3-HYDROXY-5-(HYDROXYMETHYL)-2-METHYLISONICOTINALDEHYDE | A,B | 2DDW | 0.71 | ![]() |
PXL![]() | 3-HYDROXY-5-(HYDROXYMETHYL)-2-METHYLISONICOTINALDEHYDE | A,B | 2Z9W | 0.71 | ![]() |
PXL![]() | 3-HYDROXY-5-(HYDROXYMETHYL)-2-METHYLISONICOTINALDEHYDE | A,B | 2Z9X | 0.71 | ![]() |
PXL![]() | 3-HYDROXY-5-(HYDROXYMETHYL)-2-METHYLISONICOTINALDEHYDE | A,B | 1TD2 | 0.71 | ![]() |
I01![]() | (4R)-4-(2-FLUORO-6-HYDROXY-3-METHOXY- BENZOYL)-BENZOIC ACID (3R)-3-[(PYRIDINE- 4-CARBONYL)AMINO]-AZEPAN-4-YL ESTER | A | 1SVE | 0.7 | ![]() |
AKP![]() | N-(PYRAZIN-2-YLCARBONYL)LEUCYLISOLEUCYL- N~1~-{1-[2-({1-CARBOXY-2-[4-(PHOSPHONOOXY)PHENYL]ETHYL}AMINO)- 1,1-DIHYDROXY-2-OXOETHYL]BUT-3- ENYL}-3-CYCLOHEXYLALANINAMIDE | A,B | 1RGQ | 0.75 | ![]() |
NTM![]() | QUINOLINIC ACID | A | 3C2O | 0.77 | ![]() |
NTM![]() | QUINOLINIC ACID | A,B | 1QAP | 0.77 | ![]() |
NTM![]() | QUINOLINIC ACID | A,B,C,D,E,F | 1QPQ | 0.77 | ![]() |
NTM![]() | QUINOLINIC ACID | A,B,C | 2B7N | 0.77 | ![]() |
HQA![]() | 3-(8-hydroxyquinolin-3-yl)-L-alanine | A,B | 3FCA | 0.72 | ![]() |
R55![]() | N-[4-({4-[5-(4,4-DIMETHYLPIPERIDIN- 1-YL)-2-HYDROXYBENZOYL]BENZOYL}AMINO)AZEPAN- 3-YL]ISONICOTINAMIDE | A | 1XH8 | 0.7 | ![]() |