Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02162657
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 |
NZA | 5-CHLORO-1-(4-CHLOROBENZYL)-3-(PHENYLTHIO)- 1H-INDOLE-2-CARBOXYLIC ACID | A,B | 2Q5S | 0.7 | |
SF1 | 1-BENZYL-5-CHLORO-3-(PHENYLTHIO)- 1H-INDOLE-2-CARBOXYLIC ACID | A,B | 2Q61 | 0.71 | |
ICO | 1H-INDOLE-3-CARBOXYLIC ACID | L | 2PIP | 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 | |
TFG | 2,2,2-TRIFLUORO-1-{5-[(3-PHENYL- 5,6-DIHYDROIMIDAZO[1,2-A]PYRAZIN- 7(8H)-YL)CARBONYL]THIOPHEN-2-YL}ETHANE- 1,1-DIOL | A,B | 2VQQ | 0.72 | |
TFG | 2,2,2-TRIFLUORO-1-{5-[(3-PHENYL- 5,6-DIHYDROIMIDAZO[1,2-A]PYRAZIN- 7(8H)-YL)CARBONYL]THIOPHEN-2-YL}ETHANE- 1,1-DIOL | A,B | 2VQO | 0.72 | |
TFG | 2,2,2-TRIFLUORO-1-{5-[(3-PHENYL- 5,6-DIHYDROIMIDAZO[1,2-A]PYRAZIN- 7(8H)-YL)CARBONYL]THIOPHEN-2-YL}ETHANE- 1,1-DIOL | A | 2VQJ | 0.72 | |
AR2 | ARGINYL-BENZOTHIAZOLE-6-CARBOXYLIC ACID | A,B,I | 1DOJ | 0.75 | |
PAA | (N-METHYLPYRIDYL)ACETIC ACID | I | 1HBT | 0.71 | |
PSZ | 4-[({3-HYDROXY-2-METHYL-5-[(PHOSPHONOOXY)METHYL]PYRIDIN- 4-YL}METHYL)AMINO]THIOPHENE-2-CARBOXYLIC ACID | A | 2QB3 | 0.71 | |
PSZ | 4-[({3-HYDROXY-2-METHYL-5-[(PHOSPHONOOXY)METHYL]PYRIDIN- 4-YL}METHYL)AMINO]THIOPHENE-2-CARBOXYLIC ACID | A | 2QB2 | 0.71 | |
PSZ | 4-[({3-HYDROXY-2-METHYL-5-[(PHOSPHONOOXY)METHYL]PYRIDIN- 4-YL}METHYL)AMINO]THIOPHENE-2-CARBOXYLIC ACID | A | 2QBT | 0.71 | |
PSZ | 4-[({3-HYDROXY-2-METHYL-5-[(PHOSPHONOOXY)METHYL]PYRIDIN- 4-YL}METHYL)AMINO]THIOPHENE-2-CARBOXYLIC ACID | A | 2QA3 | 0.71 | |
PSZ | 4-[({3-HYDROXY-2-METHYL-5-[(PHOSPHONOOXY)METHYL]PYRIDIN- 4-YL}METHYL)AMINO]THIOPHENE-2-CARBOXYLIC ACID | A | 2Q7W | 0.71 | |
NIO | NICOTINIC ACID | A | 1JHQ | 0.77 | |
NIO | NICOTINIC ACID | A | 1L5L | 0.77 | |
NIO | NICOTINIC ACID | A | 2F7F | 0.77 | |
NIO | NICOTINIC ACID | A | 1L5K | 0.77 | |
NIO | NICOTINIC ACID | A | 1JHY | 0.77 | |
NIO | NICOTINIC ACID | A,B | 1FSL | 0.77 | |
NIO | NICOTINIC ACID | A | 1L5M | 0.77 | |
NIO | NICOTINIC ACID | A | 1LH6 | 0.77 | |
NIO | NICOTINIC ACID | A | 1JHO | 0.77 | |
NIO | NICOTINIC ACID | A | 3CI8 | 0.77 | |
NIO | NICOTINIC ACID | A,B,C,D | 1ICU | 0.77 | |
NIO | NICOTINIC ACID | A,B,C,D,E,F, G,H | 3HRD | 0.77 | |
NIO | NICOTINIC ACID | A | 1JHA | 0.77 | |
NIO | NICOTINIC ACID | A | 1JHV | 0.77 | |
NIO | NICOTINIC ACID | A | 1L4N | 0.77 | |
NIO | NICOTINIC ACID | A | 2LH6 | 0.77 | |
NIO | NICOTINIC ACID | A | 1D0V | 0.77 | |
NIO | NICOTINIC ACID | A,B,C,D | 1ICV | 0.77 | |
NIO | NICOTINIC ACID | A,B | 1ICR | 0.77 | |
NIO | NICOTINIC ACID | A | 1JHR | 0.77 | |
NHB | N-HYDROXY-4-(METHYL{[5-(2-PYRIDINYL)- 2-THIENYL]SULFONYL}AMINO)BENZAMIDE | A,B | 1W22 | 0.7 | |
PRR | 3-(METHYL-PYRIDINIUM)ALANINE | H,I,J | 7KME | 0.7 | |
982 | 3-(CARBOXYMETHOXY)THIENO[2,3-B]PYRIDINE- 2-CARBOXYLIC ACID | A | 2AZR | 0.81 | |
NTM | QUINOLINIC ACID | A | 3C2O | 0.73 | |
NTM | QUINOLINIC ACID | A,B | 1QAP | 0.73 | |
NTM | QUINOLINIC ACID | A,B,C,D,E,F | 1QPQ | 0.73 | |
NTM | QUINOLINIC ACID | A,B,C | 2B7N | 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 | 0.71 | |
32T | (S)-2-AMINO-3-(4H-THIENO[3,2-B]- PYRROL-6-YL)-PROPIONIC ACID | A | 1RMO | 0.71 | |
PF3 | (2R)-3-({[4-[(PYRIDIN-4-YL)PHENYL]- THIEN-2-YL}CARBOXAMIDO)(PHENYL)PROPANOIC ACID | A,B | 1UTZ | 0.75 | |
6PC | PYRIDINE-2-CARBOXYLIC ACID | A | 2OLN | 0.71 | |
6PC | PYRIDINE-2-CARBOXYLIC ACID | A | 2OLO | 0.71 | |
NNO | 6-HYDROXYISONICOTINIC ACID N-OXIDE | M,N,O,P,Q,R | 3PCK | 0.71 | |
NNO | 6-HYDROXYISONICOTINIC ACID N-OXIDE | M,N,O,P,Q,R | 3PCM | 0.71 | |
ESP | THIENO[2,3-B]PYRIDINE-2-CARBOXAMIDINE | B | 1C5Y | 0.74 | |
ESP | THIENO[2,3-B]PYRIDINE-2-CARBOXAMIDINE | A | 1C5U | 0.74 | |
ESP | THIENO[2,3-B]PYRIDINE-2-CARBOXAMIDINE | A | 1C5T | 0.74 | |
PMC | 3-(PHOSPHONOMETHYL)PYRIDINE-2-CARBOXYLIC ACID | A,B,C,D,E,F, G,H,I,J,K,L | 1I43 | 0.71 |