Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02395764
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 |
CQA![]() | 4-[(7-CHLOROQUINOLIN-4-YL)AMINO]- 2-[(DIETHYLAMINO)METHYL]PHENOL | A,B | 2AOU | 0.72 | ![]() |
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 | 0.72 | ![]() |
NNO![]() | 6-HYDROXYISONICOTINIC ACID N-OXIDE | M,N,O,P,Q,R | 3PCK | 0.77 | ![]() |
NNO![]() | 6-HYDROXYISONICOTINIC ACID N-OXIDE | M,N,O,P,Q,R | 3PCM | 0.77 | ![]() |
D1G![]() | N,N-DIMETHYL(5-(PYRIDIN-3-YL)FURAN- 2-YL)METHANAMINE | A,B,C,D | 2FDU | 0.71 | ![]() |
D3G![]() | (5-(PYRIDIN-3-YL)FURAN-2-YL)METHANAMINE | A,B,C,D | 2FDW | 0.71 | ![]() |
859![]() | 2-({2-[(3-HYDROXYPHENYL)AMINO]PYRIMIDIN- 4-YL}AMINO)BENZAMIDE | A,B | 2NO3 | 0.71 | ![]() |
D3E![]() | N-cyclopropyl-N-(trans-4-pyridin- 3-ylcyclohexyl)-4-[(1S)-2,2,2-trifluoro- 1-hydroxy-1-methylethyl]benzamide | A,B,C,D | 3D3E | 0.71 | ![]() |
MYT![]() | METYRAPONE | A | 1PHG | 0.71 | ![]() |
MYT![]() | METYRAPONE | A | 1W0G | 0.71 | ![]() |
PYU![]() | 2-(1H-pyrrol-1-ylcarbonyl)benzene- 1,3,5-triol | A,B | 3EKO | 0.75 | ![]() |
DK1![]() | 5,7-DICHLORO-4-HYDROXYQUINOLINE- 2-CARBOXYLIC ACID | A,B | 1PBQ | 0.71 | ![]() |
8ST![]() | N-(4-chlorophenyl)-2-[(pyridin- 4-ylmethyl)amino]benzamide | A | 3HNG | 0.7 | ![]() |
3HM![]() | 5-hydroxy-6-methylpyridine-3-carboxylic acid | A,B | 3GMC | 0.74 | ![]() |
BDE![]() | N'-[(1E)-(3,5-DIBROMO-2,4-DIHYDROXYPHENYL)METHYLENE]NICOTINOHYDRAZIDE | A,B,C,D,E,F | 2GLP | 0.77 | ![]() |
8PC![]() | 2-(2,4-DICHLOROPHENOXY)-5-(PYRIDIN- 2-YLMETHYL)PHENOL | A,B | 2OP1 | 0.7 | ![]() |
8PC![]() | 2-(2,4-DICHLOROPHENOXY)-5-(PYRIDIN- 2-YLMETHYL)PHENOL | A,B,C,D | 3FNE | 0.7 | ![]() |
PBO![]() | 1-PYRIDIN-3-YLBUTAN-1-ONE | A | 1PYJ | 0.74 | ![]() |
NFL![]() | 2-{[3-(TRIFLUOROMETHYL)PHENYL]AMINO}NICOTINIC ACID | A | 1TD7 | 0.7 | ![]() |
NTM![]() | QUINOLINIC ACID | A | 3C2O | 0.72 | ![]() |
NTM![]() | QUINOLINIC ACID | A,B | 1QAP | 0.72 | ![]() |
NTM![]() | QUINOLINIC ACID | A,B,C,D,E,F | 1QPQ | 0.72 | ![]() |
NTM![]() | QUINOLINIC ACID | A,B,C | 2B7N | 0.72 | ![]() |
NIO![]() | NICOTINIC ACID | A | 1JHQ | 0.76 | ![]() |
NIO![]() | NICOTINIC ACID | A | 1L5L | 0.76 | ![]() |
NIO![]() | NICOTINIC ACID | A | 2F7F | 0.76 | ![]() |
NIO![]() | NICOTINIC ACID | A | 1L5K | 0.76 | ![]() |
NIO![]() | NICOTINIC ACID | A | 1JHY | 0.76 | ![]() |
NIO![]() | NICOTINIC ACID | A,B | 1FSL | 0.76 | ![]() |
NIO![]() | NICOTINIC ACID | A | 1L5M | 0.76 | ![]() |
NIO![]() | NICOTINIC ACID | A | 1LH6 | 0.76 | ![]() |
NIO![]() | NICOTINIC ACID | A | 1JHO | 0.76 | ![]() |
NIO![]() | NICOTINIC ACID | A | 3CI8 | 0.76 | ![]() |
NIO![]() | NICOTINIC ACID | A,B,C,D | 1ICU | 0.76 | ![]() |
NIO![]() | NICOTINIC ACID | A,B,C,D,E,F, G,H | 3HRD | 0.76 | ![]() |
NIO![]() | NICOTINIC ACID | A | 1JHA | 0.76 | ![]() |
NIO![]() | NICOTINIC ACID | A | 1JHV | 0.76 | ![]() |
NIO![]() | NICOTINIC ACID | A | 1L4N | 0.76 | ![]() |
NIO![]() | NICOTINIC ACID | A | 2LH6 | 0.76 | ![]() |
NIO![]() | NICOTINIC ACID | A | 1D0V | 0.76 | ![]() |
NIO![]() | NICOTINIC ACID | A,B,C,D | 1ICV | 0.76 | ![]() |
NIO![]() | NICOTINIC ACID | A,B | 1ICR | 0.76 | ![]() |
NIO![]() | NICOTINIC ACID | A | 1JHR | 0.76 | ![]() |
48B![]() | 2-chloro-N-[4-({5-fluoro-2-[(4- hydroxyphenyl)amino]pyrimidin-4- yl}amino)phenyl]benzamide | A | 3H0Y | 0.71 | ![]() |
R69![]() | N-[4-({4-[5-(DIMETHYLAMINO)-2-HYDROXYBENZOYL]BENZOYL}AMINO)AZEPAN- 3-YL]ISONICOTINAMIDE | A | 1XH4 | 0.71 | ![]() |
R69![]() | N-[4-({4-[5-(DIMETHYLAMINO)-2-HYDROXYBENZOYL]BENZOYL}AMINO)AZEPAN- 3-YL]ISONICOTINAMIDE | A | 1XH9 | 0.71 | ![]() |
INO![]() | 2-HYDROXYISONICOTINIC ACID N-OXIDE | M,N,O,P,Q,R | 3PCL | 0.74 | ![]() |
INO![]() | 2-HYDROXYISONICOTINIC ACID N-OXIDE | M,N,O,P,Q,R | 3PCJ | 0.74 | ![]() |