Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs01205518
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 |
LZ7![]() | 4-(acetylamino)-N-(4-fluorophenyl)- 1H-pyrazole-3-carboxamide | A | 2VTN | 0.71 | ![]() |
7DE![]() | 3,5-DIMETHYL-1-(3-NITROPHENYL)- 1H-PYRAZOLE-4-CARBOXYLIC ACID ETHYL ESTER | A,B | 1Y2J | 0.81 | ![]() |
7DE![]() | 3,5-DIMETHYL-1-(3-NITROPHENYL)- 1H-PYRAZOLE-4-CARBOXYLIC ACID ETHYL ESTER | A,B | 1Y2K | 0.81 | ![]() |
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 | ![]() |
LZ5![]() | N-phenyl-1H-pyrazole-3-carboxamide | A | 2VTL | 0.72 | ![]() |
YSH![]() | 1-[3-CYANO-4-(NEOPENTYLOXY)PHENYL]- 1H-PYRAZOLE-4-CARBOXYLIC ACID | A,B | 1VDV | 0.72 | ![]() |
ZZA![]() | 1-PHENYL-1H-PYRAZOLE-4-CARBOXYLIC ACID | A,B,D | 2VCW | 0.86 | ![]() |
3DE![]() | 3,5-DIMETHYL-1-PHENYL-1H-PYRAZOLE- 4-CARBOXYLIC ACID ETHYL ESTER | A,B | 1Y2C | 0.81 | ![]() |
LZ9![]() | {[(2,6-difluorophenyl)carbonyl]amino}- N-(4-fluorophenyl)-1H-pyrazole- 3-carboxamide | A | 2VTP | 0.7 | ![]() |
5DE![]() | 1-(4-AMINOPHENYL)-3,5-DIMETHYL- 1H-PYRAZOLE-4-CARBOXYLIC ACID ETHYL ESTER | A,B | 1Y2E | 0.83 | ![]() |
6DE![]() | 1-(2-CHLOROPHENYL)-3,5-DIMETHYL- 1H-PYRAZOLE-4-CARBOXYLIC ACID ETHYL ESTER | A,B | 1Y2H | 0.8 | ![]() |
LZ8![]() | (4E)-N-(4-fluorophenyl)-4-[(phenylcarbonyl)imino]- 4H-pyrazole-3-carboxamide | A | 2VTO | 0.7 | ![]() |
4DE![]() | 1-(4-METHOXYPHENYL)-3,5-DIMETHYL- 1H-PYRAZOLE-4-CARBOXYLIC ACID ETHYL ESTER | A,B | 1Y2D | 0.77 | ![]() |