Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02900618
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 |
PIX![]() | 4-(3-{[5-(trifluoromethyl)pyridin- 2-yl]oxy}benzyl)piperidine-1-carboxylic acid | A,B | 2WAP | 0.78 | ![]() |
TCD![]() | 3,5-DICHLORO-2-{4-[(3,5-DICHLOROPYRIDIN- 2-YL)OXY]PHENOXY}PYRIDINE | A,B,C,D,E,F, G,H | 1XLS | 0.73 | ![]() |
282![]() | 3-methoxypyridine | X | 2RBZ | 0.81 | ![]() |
NNO![]() | 6-HYDROXYISONICOTINIC ACID N-OXIDE | M,N,O,P,Q,R | 3PCK | 0.7 | ![]() |
NNO![]() | 6-HYDROXYISONICOTINIC ACID N-OXIDE | M,N,O,P,Q,R | 3PCM | 0.7 | ![]() |
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 | ![]() |
KIN![]() | 1-[4-(PYRIDIN-4-YLOXY)PHENYL]-3- [3-(TRIFLUOROMETHYL)PHENYL]UREA | A | 2HZN | 0.72 | ![]() |
722![]() | 1-(2,2-diphosphonoethyl)-3-(heptyloxy)pyridinium | A,B | 3EGT | 0.74 | ![]() |
B71![]() | 3-(DECYLOXY)-1-(2,2-DIPHOSPHONOETHYL)PYRIDINIUM | A,B | 2ZEU | 0.72 | ![]() |
B71![]() | 3-(DECYLOXY)-1-(2,2-DIPHOSPHONOETHYL)PYRIDINIUM | A,B | 2ZEV | 0.72 | ![]() |
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 | ![]() |
H1L![]() | (2S)-2-(4-{[3-CHLORO-5-(TRIFLUOROMETHYL)PYRIDIN- 2-YL]OXY}PHENOXY)PROPANOIC ACID | A,B,C | 1UYS | 0.73 | ![]() |
714![]() | 1-(2,2-diphosphonoethyl)-3-(octyloxy)pyridinium | A,B | 3EFQ | 0.73 | ![]() |
PYF![]() | 3-PYRIDINYLCARBINOL | A,B | 1R16 | 0.71 | ![]() |
721![]() | 3-butoxy-1-(2,2-diphosphonoethyl)pyridinium | A,B | 3DYH | 0.75 | ![]() |