Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00005823
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 |
ZZA![]() | 1-PHENYL-1H-PYRAZOLE-4-CARBOXYLIC ACID | A,B,D | 2VCW | 0.73 | ![]() |
PD2![]() | PYRIDINE-2,4-DICARBOXYLIC ACID | A,B,C | 2W2I | 0.72 | ![]() |
PD2![]() | PYRIDINE-2,4-DICARBOXYLIC ACID | A | 2GKL | 0.72 | ![]() |
PD2![]() | PYRIDINE-2,4-DICARBOXYLIC ACID | A,B | 2VD7 | 0.72 | ![]() |
PD2![]() | PYRIDINE-2,4-DICARBOXYLIC ACID | A,B | 2JIG | 0.72 | ![]() |
QYT![]() | (5E)-5-(QUINOXALIN-6-YLMETHYLENE)- 1,3-THIAZOLIDINE-2,4-DIONE | A | 2A5U | 0.71 | ![]() |
DPT![]() | 4,7-DIMETHYL-[1,10]PHENANTHROLINE | A,B | 1I53 | 0.7 | ![]() |
34Q![]() | (3R,4R)-4-(pyrrolidin-1-ylcarbonyl)- 1-(quinoxalin-2-ylcarbonyl)pyrrolidin- 3-amine | A | 2RIP | 0.76 | ![]() |
QUI![]() | 2-CARBOXYQUINOXALINE | A | 1PFE | 1 | ![]() |
QUI![]() | 2-CARBOXYQUINOXALINE | A,B | 2DA8 | 1 | ![]() |
QUI![]() | 2-CARBOXYQUINOXALINE | A,C,E,G | 2ADW | 1 | ![]() |
QUI![]() | 2-CARBOXYQUINOXALINE | A | 1VS2 | 1 | ![]() |
QUI![]() | 2-CARBOXYQUINOXALINE | A | 1XVN | 1 | ![]() |
QUI![]() | 2-CARBOXYQUINOXALINE | A,B | 185D | 1 | ![]() |
QUI![]() | 2-CARBOXYQUINOXALINE | A | 1XVK | 1 | ![]() |
QUI![]() | 2-CARBOXYQUINOXALINE | A,C | 1XVR | 1 | ![]() |
QUI![]() | 2-CARBOXYQUINOXALINE | A,B | 3GO3 | 1 | ![]() |
NTM![]() | QUINOLINIC ACID | A | 3C2O | 0.75 | ![]() |
NTM![]() | QUINOLINIC ACID | A,B | 1QAP | 0.75 | ![]() |
NTM![]() | QUINOLINIC ACID | A,B,C,D,E,F | 1QPQ | 0.75 | ![]() |
NTM![]() | QUINOLINIC ACID | A,B,C | 2B7N | 0.75 | ![]() |
PYA![]() | 3-(1,10-PHENANTHROL-2-YL)-L-ALANINE | A | 1HCW | 0.73 | ![]() |
NPV![]() | 4-[8-(3-nitrophenyl)-1,7-naphthyridin- 6-yl]benzoic acid | A,B | 2QYN | 0.7 | ![]() |
NPV![]() | 4-[8-(3-nitrophenyl)-1,7-naphthyridin- 6-yl]benzoic acid | A,B | 2QYK | 0.7 | ![]() |
NPV![]() | 4-[8-(3-nitrophenyl)-1,7-naphthyridin- 6-yl]benzoic acid | A | 2QYL | 0.7 | ![]() |
6PC![]() | PYRIDINE-2-CARBOXYLIC ACID | A | 2OLN | 0.79 | ![]() |
6PC![]() | PYRIDINE-2-CARBOXYLIC ACID | A | 2OLO | 0.79 | ![]() |
QND![]() | QUINALDIC ACID | A,B | 1IDA | 0.72 | ![]() |
G14![]() | 2-phenyl-1H-imidazole-4-carboxylic acid | A,B | 3GRJ | 0.73 | ![]() |
PHN![]() | 1,10-PHENANTHROLINE | A | 1LIH | 0.71 | ![]() |
PHN![]() | 1,10-PHENANTHROLINE | A | 2LIG | 0.71 | ![]() |
PHN![]() | 1,10-PHENANTHROLINE | A,B | 2FU7 | 0.71 | ![]() |
PF7![]() | 4-(quinolin-3-ylmethyl)piperidine- 1-carboxylic acid | A,B | 2VYA | 0.7 | ![]() |
PDC![]() | PYRIDINE-2,6-DICARBOXYLIC ACID | A | 2PC2 | 0.7 | ![]() |
PDC![]() | PYRIDINE-2,6-DICARBOXYLIC ACID | A,B,C,D | 1ARZ | 0.7 | ![]() |
PDC![]() | PYRIDINE-2,6-DICARBOXYLIC ACID | A | 2PE7 | 0.7 | ![]() |
PDC![]() | PYRIDINE-2,6-DICARBOXYLIC ACID | A | 2PES | 0.7 | ![]() |
PDC![]() | PYRIDINE-2,6-DICARBOXYLIC ACID | A,B | 1C3V | 0.7 | ![]() |
PDC![]() | PYRIDINE-2,6-DICARBOXYLIC ACID | A,B | 1P9L | 0.7 | ![]() |
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 | ![]() |
PYB![]() | 4-AMINO-(1-METHYLPYRROLE)-2-CARBOXYLIC ACID | A,D,E,G,I,J | 1S32 | 0.72 | ![]() |
PYB![]() | 4-AMINO-(1-METHYLPYRROLE)-2-CARBOXYLIC ACID | D,I,J | 1M18 | 0.72 | ![]() |
PYB![]() | 4-AMINO-(1-METHYLPYRROLE)-2-CARBOXYLIC ACID | E,I,J | 1M1A | 0.72 | ![]() |
PYB![]() | 4-AMINO-(1-METHYLPYRROLE)-2-CARBOXYLIC ACID | E,I,J | 1M19 | 0.72 | ![]() |
P6C![]() | 2-AMINO-4-ISOPROPYL-PTERIDINE-6- CARBOXYLIC ACID | A,B | 1TFM | 0.7 | ![]() |
P6C![]() | 2-AMINO-4-ISOPROPYL-PTERIDINE-6- CARBOXYLIC ACID | A,B | 1YF8 | 0.7 | ![]() |
PMC![]() | 3-(PHOSPHONOMETHYL)PYRIDINE-2-CARBOXYLIC ACID | A,B,C,D,E,F, G,H,I,J,K,L | 1I43 | 0.71 | ![]() |