Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs01747940
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 |
K27![]() | 4-carbamoyl-1-(3-{4-[(E)-(hydroxyimino)methyl]pyridinium- 1-yl}propyl)pyridinium | A,B | 2WHR | 0.7 | ![]() |
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 | ![]() |
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 | ![]() |
NCN![]() | NICOTINATE MONONUCLEOTIDE | A,B | 2QTN | 0.7 | ![]() |
NCN![]() | NICOTINATE MONONUCLEOTIDE | A | 1L4F | 0.7 | ![]() |
NCN![]() | NICOTINATE MONONUCLEOTIDE | A | 1L4L | 0.7 | ![]() |
NCN![]() | NICOTINATE MONONUCLEOTIDE | A,B,C,D | 1YUM | 0.7 | ![]() |
NCN![]() | NICOTINATE MONONUCLEOTIDE | A | 1L4M | 0.7 | ![]() |
NCN![]() | NICOTINATE MONONUCLEOTIDE | A,B,C,D,E,F | 1QPN | 0.7 | ![]() |
NCN![]() | NICOTINATE MONONUCLEOTIDE | A,B,C | 2B7Q | 0.7 | ![]() |
NCN![]() | NICOTINATE MONONUCLEOTIDE | A | 1L4K | 0.7 | ![]() |
NCN![]() | NICOTINATE MONONUCLEOTIDE | A | 1L4G | 0.7 | ![]() |
NCN![]() | NICOTINATE MONONUCLEOTIDE | A | 1YTK | 0.7 | ![]() |
NCN![]() | NICOTINATE MONONUCLEOTIDE | A | 1L4H | 0.7 | ![]() |
NCN![]() | NICOTINATE MONONUCLEOTIDE | A | 1L5O | 0.7 | ![]() |
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 | ![]() |
NNR![]() | Nicotinamide riboside | A | 2QT0 | 0.79 | ![]() |
NNR![]() | Nicotinamide riboside | A | 2QT1 | 0.79 | ![]() |
IHZ![]() | 5-[(2-methyl-5-{[3-(trifluoromethyl)phenyl]carbamoyl}phenyl)amino]pyridine- 3-carboxamide | A | 3DKO | 0.71 | ![]() |
NCA![]() | NICOTINAMIDE | A,B | 2E5D | 0.77 | ![]() |
NCA![]() | NICOTINAMIDE | A,B,C,D | 2Z77 | 0.77 | ![]() |
NCA![]() | NICOTINAMIDE | A,B | 1DMA | 0.77 | ![]() |
NCA![]() | NICOTINAMIDE | A,B | 1ISM | 0.77 | ![]() |
NCA![]() | NICOTINAMIDE | A,B | 1YC5 | 0.77 | ![]() |
NCA![]() | NICOTINAMIDE | A | 2ZB7 | 0.77 | ![]() |
NCA![]() | NICOTINAMIDE | A,B,C,D,E,F, G,H | 1R15 | 0.77 | ![]() |
NCA![]() | NICOTINAMIDE | A,B | 2QQG | 0.77 | ![]() |
NCA![]() | NICOTINAMIDE | A | 2OTV | 0.77 | ![]() |
NCA![]() | NICOTINAMIDE | A | 2QHF | 0.77 | ![]() |
NCA![]() | NICOTINAMIDE | A,B,C,D | 2C8A | 0.77 | ![]() |
NCA![]() | NICOTINAMIDE | A,B | 2HJH | 0.77 | ![]() |
NCA![]() | NICOTINAMIDE | A | 2A15 | 0.77 | ![]() |
NCA![]() | NICOTINAMIDE | A | 2R6V | 0.77 | ![]() |
NCA![]() | NICOTINAMIDE | A,B | 1ISI | 0.77 | ![]() |
NCA![]() | NICOTINAMIDE | A,D,E | 2R9J | 0.77 | ![]() |
NCA![]() | NICOTINAMIDE | A | 2H4J | 0.77 | ![]() |
NCA![]() | NICOTINAMIDE | A,B | 2OD9 | 0.77 | ![]() |
NCA![]() | NICOTINAMIDE | A,B,C,D,E | 1YC2 | 0.77 | ![]() |
NCA![]() | NICOTINAMIDE | A,B | 3DZG | 0.77 | ![]() |
NCA![]() | NICOTINAMIDE | A | 1OJU | 0.77 | ![]() |
ISZ![]() | 4-(DIAZENYLCARBONYL)PYRIDINE | A,B,C,D | 1W6F | 0.7 | ![]() |
ISZ![]() | 4-(DIAZENYLCARBONYL)PYRIDINE | A | 2V2E | 0.7 | ![]() |
ISZ![]() | 4-(DIAZENYLCARBONYL)PYRIDINE | X | 2VCF | 0.7 | ![]() |
ISZ![]() | 4-(DIAZENYLCARBONYL)PYRIDINE | A | 2VCS | 0.7 | ![]() |
ISZ![]() | 4-(DIAZENYLCARBONYL)PYRIDINE | A | 2VCN | 0.7 | ![]() |
ISZ![]() | 4-(DIAZENYLCARBONYL)PYRIDINE | A,B | 1XR3 | 0.7 | ![]() |
NMN![]() | BETA-NICOTINAMIDE RIBOSE MONOPHOSPHATE | A | 2QSZ | 0.75 | ![]() |
NMN![]() | BETA-NICOTINAMIDE RIBOSE MONOPHOSPHATE | A | 1TA8 | 0.75 | ![]() |
NMN![]() | BETA-NICOTINAMIDE RIBOSE MONOPHOSPHATE | A | 1HYB | 0.75 | ![]() |
NMN![]() | BETA-NICOTINAMIDE RIBOSE MONOPHOSPHATE | A | 3BAA | 0.75 | ![]() |
NMN![]() | BETA-NICOTINAMIDE RIBOSE MONOPHOSPHATE | A | 3BA9 | 0.75 | ![]() |
NMN![]() | BETA-NICOTINAMIDE RIBOSE MONOPHOSPHATE | A,B | 1NUP | 0.75 | ![]() |
NMN![]() | BETA-NICOTINAMIDE RIBOSE MONOPHOSPHATE | A,B | 1NUS | 0.75 | ![]() |
NMN![]() | BETA-NICOTINAMIDE RIBOSE MONOPHOSPHATE | A,B | 1Y1P | 0.75 | ![]() |
NMN![]() | BETA-NICOTINAMIDE RIBOSE MONOPHOSPHATE | A,B,C,D,E,F | 2GVG | 0.75 | ![]() |
NMN![]() | BETA-NICOTINAMIDE RIBOSE MONOPHOSPHATE | A | 3BA8 | 0.75 | ![]() |
NMN![]() | BETA-NICOTINAMIDE RIBOSE MONOPHOSPHATE | A | 3BAB | 0.75 | ![]() |
NMN![]() | BETA-NICOTINAMIDE RIBOSE MONOPHOSPHATE | A,B | 3DZK | 0.75 | ![]() |
NMN![]() | BETA-NICOTINAMIDE RIBOSE MONOPHOSPHATE | A,B,C | 1GZU | 0.75 | ![]() |
NMN![]() | BETA-NICOTINAMIDE RIBOSE MONOPHOSPHATE | A,B | 2H3D | 0.75 | ![]() |
NMN![]() | BETA-NICOTINAMIDE RIBOSE MONOPHOSPHATE | A,B | 2G96 | 0.75 | ![]() |
NMN![]() | BETA-NICOTINAMIDE RIBOSE MONOPHOSPHATE | A | 2QG6 | 0.75 | ![]() |
NMN![]() | BETA-NICOTINAMIDE RIBOSE MONOPHOSPHATE | A,B | 1ISJ | 0.75 | ![]() |
NMN![]() | BETA-NICOTINAMIDE RIBOSE MONOPHOSPHATE | A,B | 3DZJ | 0.75 | ![]() |
NMN![]() | BETA-NICOTINAMIDE RIBOSE MONOPHOSPHATE | A,B | 2HCT | 0.75 | ![]() |
PAA![]() | (N-METHYLPYRIDYL)ACETIC ACID | I | 1HBT | 0.7 | ![]() |
MYT![]() | METYRAPONE | A | 1PHG | 0.72 | ![]() |
MYT![]() | METYRAPONE | A | 1W0G | 0.72 | ![]() |
PBO![]() | 1-PYRIDIN-3-YLBUTAN-1-ONE | A | 1PYJ | 0.75 | ![]() |
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 | 0.7 | ![]() |