Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00362642
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 |
24X | H,L | 2EC9 | 0.76 | ||
DZF | 5-DEAZAFOLIC ACID | A,B | 2DHF | 0.71 | |
DZF | 5-DEAZAFOLIC ACID | A,B | 1DYH | 0.71 | |
DZF | 5-DEAZAFOLIC ACID | A,B,C,D | 1CDE | 0.71 | |
NNO | 6-HYDROXYISONICOTINIC ACID N-OXIDE | M,N,O,P,Q,R | 3PCK | 0.74 | |
NNO | 6-HYDROXYISONICOTINIC ACID N-OXIDE | M,N,O,P,Q,R | 3PCM | 0.74 | |
S91 | [4-({5-(AMINOCARBONYL)-4-[(3-METHYLPHENYL)AMINO]PYRIMIDIN- 2-YL}AMINO)PHENYL]ACETIC ACID | A | 2Z8C | 0.73 | |
S91 | [4-({5-(AMINOCARBONYL)-4-[(3-METHYLPHENYL)AMINO]PYRIMIDIN- 2-YL}AMINO)PHENYL]ACETIC ACID | A | 2Z7L | 0.73 | |
MMG | 4-(5-phenyl-1H-pyrrolo[2,3-b]pyridin- 3-yl)benzoic acid | A | 3HDM | 0.72 | |
NA4 | 4-[5-(2-CARBOXY-1-FORMYL-ETHYLCARBAMOYL)- PYRIDIN-3-YL]-BENZOIC ACID | A,C | 1RHM | 0.72 | |
AXD | 2-[4-({2-[(2S,5R)-2-(AMINOMETHYL)- 5-ETHYNYLPYRROLIDIN-1-YL]-2-OXOETHYL}AMINO)- 4-METHYLPIPERIDIN-1-YL]ISONICOTINIC ACID | B | 2I03 | 0.71 | |
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 | 0.74 | |
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 | |
BFU | 1-(5-BROMO-PYRIDIN-2-YL)-3-[2-(6- FLUORO-2-HYDROXY-3-PROPIONYL-PHENYL)- CYCLOPROPYL]-UREA | A | 1EET | 0.7 | |
NFL | 2-{[3-(TRIFLUOROMETHYL)PHENYL]AMINO}NICOTINIC ACID | A | 1TD7 | 0.89 | |
859 | 2-({2-[(3-HYDROXYPHENYL)AMINO]PYRIMIDIN- 4-YL}AMINO)BENZAMIDE | A,B | 2NO3 | 0.74 | |
PAA | (N-METHYLPYRIDYL)ACETIC ACID | I | 1HBT | 0.72 | |
NTM | QUINOLINIC ACID | A | 3C2O | 0.75 | |
NTM | QUINOLINIC ACID | A,B | 1QAP | 0.75 | |
NTM | QUINOLINIC ACID | A,B,C,D,E,F | 1QPQ | 0.75 | |
NTM | QUINOLINIC ACID | A,B,C | 2B7N | 0.75 | |
4RB | 4-(6-{[(1R)-1-(hydroxymethyl)propyl]amino}imidazo[1,2- b]pyridazin-3-yl)benzoic acid | A | 3BQR | 0.72 | |
PBO | 1-PYRIDIN-3-YLBUTAN-1-ONE | A | 1PYJ | 0.7 | |
PD8 | PHOSPHORYLATED DIHYDROPTEROATE | A | 1W78 | 0.71 | |
BDE | N'-[(1E)-(3,5-DIBROMO-2,4-DIHYDROXYPHENYL)METHYLENE]NICOTINOHYDRAZIDE | A,B,C,D,E,F | 2GLP | 0.72 | |
PAQ | 2-OXY-4-HYDROXY-5-(2-HYDRAZINOPYRIDINE)PHENYLALANINE | A,B,C,D | 2C11 | 0.75 | |
PAQ | 2-OXY-4-HYDROXY-5-(2-HYDRAZINOPYRIDINE)PHENYLALANINE | A,B | 1SPU | 0.75 | |
NIX | NALIDIXIC ACID | A,B | 2BQ2 | 0.73 | |
NIO | NICOTINIC ACID | A | 1JHQ | 0.81 | |
NIO | NICOTINIC ACID | A | 1L5L | 0.81 | |
NIO | NICOTINIC ACID | A | 2F7F | 0.81 | |
NIO | NICOTINIC ACID | A | 1L5K | 0.81 | |
NIO | NICOTINIC ACID | A | 1JHY | 0.81 | |
NIO | NICOTINIC ACID | A,B | 1FSL | 0.81 | |
NIO | NICOTINIC ACID | A | 1L5M | 0.81 | |
NIO | NICOTINIC ACID | A | 1LH6 | 0.81 | |
NIO | NICOTINIC ACID | A | 1JHO | 0.81 | |
NIO | NICOTINIC ACID | A | 3CI8 | 0.81 | |
NIO | NICOTINIC ACID | A,B,C,D | 1ICU | 0.81 | |
NIO | NICOTINIC ACID | A,B,C,D,E,F, G,H | 3HRD | 0.81 | |
NIO | NICOTINIC ACID | A | 1JHA | 0.81 | |
NIO | NICOTINIC ACID | A | 1JHV | 0.81 | |
NIO | NICOTINIC ACID | A | 1L4N | 0.81 | |
NIO | NICOTINIC ACID | A | 2LH6 | 0.81 | |
NIO | NICOTINIC ACID | A | 1D0V | 0.81 | |
NIO | NICOTINIC ACID | A,B,C,D | 1ICV | 0.81 | |
NIO | NICOTINIC ACID | A,B | 1ICR | 0.81 | |
NIO | NICOTINIC ACID | A | 1JHR | 0.81 |