Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs01720400
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 |
NFL | 2-{[3-(TRIFLUOROMETHYL)PHENYL]AMINO}NICOTINIC ACID | A | 1TD7 | 0.82 | |
NIO | NICOTINIC ACID | A | 1JHQ | 0.72 | |
NIO | NICOTINIC ACID | A | 1L5L | 0.72 | |
NIO | NICOTINIC ACID | A | 2F7F | 0.72 | |
NIO | NICOTINIC ACID | A | 1L5K | 0.72 | |
NIO | NICOTINIC ACID | A | 1JHY | 0.72 | |
NIO | NICOTINIC ACID | A,B | 1FSL | 0.72 | |
NIO | NICOTINIC ACID | A | 1L5M | 0.72 | |
NIO | NICOTINIC ACID | A | 1LH6 | 0.72 | |
NIO | NICOTINIC ACID | A | 1JHO | 0.72 | |
NIO | NICOTINIC ACID | A | 3CI8 | 0.72 | |
NIO | NICOTINIC ACID | A,B,C,D | 1ICU | 0.72 | |
NIO | NICOTINIC ACID | A,B,C,D,E,F, G,H | 3HRD | 0.72 | |
NIO | NICOTINIC ACID | A | 1JHA | 0.72 | |
NIO | NICOTINIC ACID | A | 1JHV | 0.72 | |
NIO | NICOTINIC ACID | A | 1L4N | 0.72 | |
NIO | NICOTINIC ACID | A | 2LH6 | 0.72 | |
NIO | NICOTINIC ACID | A | 1D0V | 0.72 | |
NIO | NICOTINIC ACID | A,B,C,D | 1ICV | 0.72 | |
NIO | NICOTINIC ACID | A,B | 1ICR | 0.72 | |
NIO | NICOTINIC ACID | A | 1JHR | 0.72 | |
368 | (1R)-2-{[AMINO(IMINO)METHYL]AMINO}- 1-{4-[(4R)-4-(HYDROXYMETHYL)-1,3,2- DIOXABOROLAN-2-YL]PHENYL}ETHYL NICOTINATE | A | 1ZLR | 0.75 | |
2SM | methyl 2-{[(4-methylpyrimidin-2- yl)carbamoyl]sulfamoyl}benzoate | A | 3EA4 | 0.72 | |
7CS | (3-ENDO)-8-METHYL-8-AZABICYCLO[3.2.1]OCT- 3-YL 1H-PYRROLO[2,3-B]PYRIDINE- 3-CARBOXYLATE | A | 2QHM | 0.7 |