Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02340979
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 |
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 | |
HLO | 1-[({2,4-BIS[(E)-(HYDROXYIMINO)METHYL]PYRIDINIUM- 1-YL}METHOXY)METHYL]-4-CARBAMOYLPYRIDINIUM | A,B | 2JEY | 0.71 | |
HLO | 1-[({2,4-BIS[(E)-(HYDROXYIMINO)METHYL]PYRIDINIUM- 1-YL}METHOXY)METHYL]-4-CARBAMOYLPYRIDINIUM | A,B | 2JEZ | 0.71 | |
NCA | NICOTINAMIDE | A,B | 2E5D | 0.73 | |
NCA | NICOTINAMIDE | A,B,C,D | 2Z77 | 0.73 | |
NCA | NICOTINAMIDE | A,B | 1DMA | 0.73 | |
NCA | NICOTINAMIDE | A,B | 1ISM | 0.73 | |
NCA | NICOTINAMIDE | A,B | 1YC5 | 0.73 | |
NCA | NICOTINAMIDE | A | 2ZB7 | 0.73 | |
NCA | NICOTINAMIDE | A,B,C,D,E,F, G,H | 1R15 | 0.73 | |
NCA | NICOTINAMIDE | A,B | 2QQG | 0.73 | |
NCA | NICOTINAMIDE | A | 2OTV | 0.73 | |
NCA | NICOTINAMIDE | A | 2QHF | 0.73 | |
NCA | NICOTINAMIDE | A,B,C,D | 2C8A | 0.73 | |
NCA | NICOTINAMIDE | A,B | 2HJH | 0.73 | |
NCA | NICOTINAMIDE | A | 2A15 | 0.73 | |
NCA | NICOTINAMIDE | A | 2R6V | 0.73 | |
NCA | NICOTINAMIDE | A,B | 1ISI | 0.73 | |
NCA | NICOTINAMIDE | A,D,E | 2R9J | 0.73 | |
NCA | NICOTINAMIDE | A | 2H4J | 0.73 | |
NCA | NICOTINAMIDE | A,B | 2OD9 | 0.73 | |
NCA | NICOTINAMIDE | A,B,C,D,E | 1YC2 | 0.73 | |
NCA | NICOTINAMIDE | A,B | 3DZG | 0.73 | |
NCA | NICOTINAMIDE | A | 1OJU | 0.73 | |
NCN | NICOTINATE MONONUCLEOTIDE | A,B | 2QTN | 0.85 | |
NCN | NICOTINATE MONONUCLEOTIDE | A | 1L4F | 0.85 | |
NCN | NICOTINATE MONONUCLEOTIDE | A | 1L4L | 0.85 | |
NCN | NICOTINATE MONONUCLEOTIDE | A,B,C,D | 1YUM | 0.85 | |
NCN | NICOTINATE MONONUCLEOTIDE | A | 1L4M | 0.85 | |
NCN | NICOTINATE MONONUCLEOTIDE | A,B,C,D,E,F | 1QPN | 0.85 | |
NCN | NICOTINATE MONONUCLEOTIDE | A,B,C | 2B7Q | 0.85 | |
NCN | NICOTINATE MONONUCLEOTIDE | A | 1L4K | 0.85 | |
NCN | NICOTINATE MONONUCLEOTIDE | A | 1L4G | 0.85 | |
NCN | NICOTINATE MONONUCLEOTIDE | A | 1YTK | 0.85 | |
NCN | NICOTINATE MONONUCLEOTIDE | A | 1L4H | 0.85 | |
NCN | NICOTINATE MONONUCLEOTIDE | A | 1L5O | 0.85 | |
PYF | 3-PYRIDINYLCARBINOL | A,B | 1R16 | 0.75 | |
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 | |
PY7 | PYRIDIN-4-YLMETHANOL | A | 2EUR | 0.7 | |
NNR | Nicotinamide riboside | A | 2QT0 | 0.82 | |
NNR | Nicotinamide riboside | A | 2QT1 | 0.82 | |
P10 | [1-(3-HYDROXY-2-OXO-1-PHENETHYL- PROPYLCARBAMOYL)2-PHENYL-ETHYL]- CARBAMIC ACID PYRIDIN-4-YLMETHYL ESTER | A | 1ME3 | 0.71 | |
DRP | 2-DEOXYRIBOFURANOSYL-PYRIDINE-5'- MONOPHOSPHATE | A,B | 1JES | 0.76 | |
NIO | NICOTINIC ACID | A | 1JHQ | 0.85 | |
NIO | NICOTINIC ACID | A | 1L5L | 0.85 | |
NIO | NICOTINIC ACID | A | 2F7F | 0.85 | |
NIO | NICOTINIC ACID | A | 1L5K | 0.85 | |
NIO | NICOTINIC ACID | A | 1JHY | 0.85 | |
NIO | NICOTINIC ACID | A,B | 1FSL | 0.85 | |
NIO | NICOTINIC ACID | A | 1L5M | 0.85 | |
NIO | NICOTINIC ACID | A | 1LH6 | 0.85 | |
NIO | NICOTINIC ACID | A | 1JHO | 0.85 | |
NIO | NICOTINIC ACID | A | 3CI8 | 0.85 | |
NIO | NICOTINIC ACID | A,B,C,D | 1ICU | 0.85 | |
NIO | NICOTINIC ACID | A,B,C,D,E,F, G,H | 3HRD | 0.85 | |
NIO | NICOTINIC ACID | A | 1JHA | 0.85 | |
NIO | NICOTINIC ACID | A | 1JHV | 0.85 | |
NIO | NICOTINIC ACID | A | 1L4N | 0.85 | |
NIO | NICOTINIC ACID | A | 2LH6 | 0.85 | |
NIO | NICOTINIC ACID | A | 1D0V | 0.85 | |
NIO | NICOTINIC ACID | A,B,C,D | 1ICV | 0.85 | |
NIO | NICOTINIC ACID | A,B | 1ICR | 0.85 | |
NIO | NICOTINIC ACID | A | 1JHR | 0.85 | |
PMC | 3-(PHOSPHONOMETHYL)PYRIDINE-2-CARBOXYLIC ACID | A,B,C,D,E,F, G,H,I,J,K,L | 1I43 | 0.72 | |
HI6 | 4-(AMINOCARBONYL)-1-[({2-[(E)-(HYDROXYIMINO)METHYL]PYRIDINIUM- 1-YL}METHOXY)METHYL]PYRIDINIUM | A,B | 2WHQ | 0.7 | |
HI6 | 4-(AMINOCARBONYL)-1-[({2-[(E)-(HYDROXYIMINO)METHYL]PYRIDINIUM- 1-YL}METHOXY)METHYL]PYRIDINIUM | A,B | 2WHP | 0.7 | |
HI6 | 4-(AMINOCARBONYL)-1-[({2-[(E)-(HYDROXYIMINO)METHYL]PYRIDINIUM- 1-YL}METHOXY)METHYL]PYRIDINIUM | A,B | 2GYU | 0.7 | |
3HM | 5-hydroxy-6-methylpyridine-3-carboxylic acid | A,B | 3GMC | 0.71 | |
DPY | A,B | 1JES | 0.71 | ||
D2G | N-METHYL(5-(PYRIDIN-3-YL)FURAN- 2-YL)METHANAMINE | A,B,C,D | 2FDV | 0.71 | |
NFL | 2-{[3-(TRIFLUOROMETHYL)PHENYL]AMINO}NICOTINIC ACID | A | 1TD7 | 0.74 | |
MYT | METYRAPONE | A | 1PHG | 0.73 | |
MYT | METYRAPONE | A | 1W0G | 0.73 | |
368 | (1R)-2-{[AMINO(IMINO)METHYL]AMINO}- 1-{4-[(4R)-4-(HYDROXYMETHYL)-1,3,2- DIOXABOROLAN-2-YL]PHENYL}ETHYL NICOTINATE | A | 1ZLR | 0.82 | |
NNO | 6-HYDROXYISONICOTINIC ACID N-OXIDE | M,N,O,P,Q,R | 3PCK | 0.79 | |
NNO | 6-HYDROXYISONICOTINIC ACID N-OXIDE | M,N,O,P,Q,R | 3PCM | 0.79 | |
D1G | N,N-DIMETHYL(5-(PYRIDIN-3-YL)FURAN- 2-YL)METHANAMINE | A,B,C,D | 2FDU | 0.72 | |
D3G | (5-(PYRIDIN-3-YL)FURAN-2-YL)METHANAMINE | A,B,C,D | 2FDW | 0.72 | |
INO | 2-HYDROXYISONICOTINIC ACID N-OXIDE | M,N,O,P,Q,R | 3PCL | 0.73 | |
INO | 2-HYDROXYISONICOTINIC ACID N-OXIDE | M,N,O,P,Q,R | 3PCJ | 0.73 | |
PBO | 1-PYRIDIN-3-YLBUTAN-1-ONE | A | 1PYJ | 0.74 | |
6PC | PYRIDINE-2-CARBOXYLIC ACID | A | 2OLN | 0.71 | |
6PC | PYRIDINE-2-CARBOXYLIC ACID | A | 2OLO | 0.71 | |
NTM | QUINOLINIC ACID | A | 3C2O | 0.77 | |
NTM | QUINOLINIC ACID | A,B | 1QAP | 0.77 | |
NTM | QUINOLINIC ACID | A,B,C,D,E,F | 1QPQ | 0.77 | |
NTM | QUINOLINIC ACID | A,B,C | 2B7N | 0.77 | |
NMN | BETA-NICOTINAMIDE RIBOSE MONOPHOSPHATE | A | 2QSZ | 0.78 | |
NMN | BETA-NICOTINAMIDE RIBOSE MONOPHOSPHATE | A | 1TA8 | 0.78 | |
NMN | BETA-NICOTINAMIDE RIBOSE MONOPHOSPHATE | A | 1HYB | 0.78 | |
NMN | BETA-NICOTINAMIDE RIBOSE MONOPHOSPHATE | A | 3BAA | 0.78 | |
NMN | BETA-NICOTINAMIDE RIBOSE MONOPHOSPHATE | A | 3BA9 | 0.78 | |
NMN | BETA-NICOTINAMIDE RIBOSE MONOPHOSPHATE | A,B | 1NUP | 0.78 | |
NMN | BETA-NICOTINAMIDE RIBOSE MONOPHOSPHATE | A,B | 1NUS | 0.78 | |
NMN | BETA-NICOTINAMIDE RIBOSE MONOPHOSPHATE | A,B | 1Y1P | 0.78 | |
NMN | BETA-NICOTINAMIDE RIBOSE MONOPHOSPHATE | A,B,C,D,E,F | 2GVG | 0.78 | |
NMN | BETA-NICOTINAMIDE RIBOSE MONOPHOSPHATE | A | 3BA8 | 0.78 | |
NMN | BETA-NICOTINAMIDE RIBOSE MONOPHOSPHATE | A | 3BAB | 0.78 | |
NMN | BETA-NICOTINAMIDE RIBOSE MONOPHOSPHATE | A,B | 3DZK | 0.78 | |
NMN | BETA-NICOTINAMIDE RIBOSE MONOPHOSPHATE | A,B,C | 1GZU | 0.78 | |
NMN | BETA-NICOTINAMIDE RIBOSE MONOPHOSPHATE | A,B | 2H3D | 0.78 | |
NMN | BETA-NICOTINAMIDE RIBOSE MONOPHOSPHATE | A,B | 2G96 | 0.78 | |
NMN | BETA-NICOTINAMIDE RIBOSE MONOPHOSPHATE | A | 2QG6 | 0.78 | |
NMN | BETA-NICOTINAMIDE RIBOSE MONOPHOSPHATE | A,B | 1ISJ | 0.78 | |
NMN | BETA-NICOTINAMIDE RIBOSE MONOPHOSPHATE | A,B | 3DZJ | 0.78 | |
NMN | BETA-NICOTINAMIDE RIBOSE MONOPHOSPHATE | A,B | 2HCT | 0.78 | |
NA4 | 4-[5-(2-CARBOXY-1-FORMYL-ETHYLCARBAMOYL)- PYRIDIN-3-YL]-BENZOIC ACID | A,C | 1RHM | 0.71 | |
PAA | (N-METHYLPYRIDYL)ACETIC ACID | I | 1HBT | 0.75 |