Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02409039
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 |
INP | 4-[[N-[(PHENYLMETHOXY)CARBONYL]- /NL/N-LEUCYL]AMINO]-1[(2S)-2-[[[4- (PYRIDINYLMETHOXY)CARBONYL]AMINO]- 4-METHYLPENT/NYL]-3-PYRROLIDINONE/N | A | 1AU4 | 0.71 | |
GPI | (2S)-[3-PYRIDYL-1-PROPYL]-1-[3,3- DIMETHYL-1,2-DIOXOPENTYL]-2-PYRROLIDINECARBOXYLATE | A | 1F40 | 0.76 | |
NMN | BETA-NICOTINAMIDE RIBOSE MONOPHOSPHATE | A | 2QSZ | 0.83 | |
NMN | BETA-NICOTINAMIDE RIBOSE MONOPHOSPHATE | A | 1TA8 | 0.83 | |
NMN | BETA-NICOTINAMIDE RIBOSE MONOPHOSPHATE | A | 1HYB | 0.83 | |
NMN | BETA-NICOTINAMIDE RIBOSE MONOPHOSPHATE | A | 3BAA | 0.83 | |
NMN | BETA-NICOTINAMIDE RIBOSE MONOPHOSPHATE | A | 3BA9 | 0.83 | |
NMN | BETA-NICOTINAMIDE RIBOSE MONOPHOSPHATE | A,B | 1NUP | 0.83 | |
NMN | BETA-NICOTINAMIDE RIBOSE MONOPHOSPHATE | A,B | 1NUS | 0.83 | |
NMN | BETA-NICOTINAMIDE RIBOSE MONOPHOSPHATE | A,B | 1Y1P | 0.83 | |
NMN | BETA-NICOTINAMIDE RIBOSE MONOPHOSPHATE | A,B,C,D,E,F | 2GVG | 0.83 | |
NMN | BETA-NICOTINAMIDE RIBOSE MONOPHOSPHATE | A | 3BA8 | 0.83 | |
NMN | BETA-NICOTINAMIDE RIBOSE MONOPHOSPHATE | A | 3BAB | 0.83 | |
NMN | BETA-NICOTINAMIDE RIBOSE MONOPHOSPHATE | A,B | 3DZK | 0.83 | |
NMN | BETA-NICOTINAMIDE RIBOSE MONOPHOSPHATE | A,B,C | 1GZU | 0.83 | |
NMN | BETA-NICOTINAMIDE RIBOSE MONOPHOSPHATE | A,B | 2H3D | 0.83 | |
NMN | BETA-NICOTINAMIDE RIBOSE MONOPHOSPHATE | A,B | 2G96 | 0.83 | |
NMN | BETA-NICOTINAMIDE RIBOSE MONOPHOSPHATE | A | 2QG6 | 0.83 | |
NMN | BETA-NICOTINAMIDE RIBOSE MONOPHOSPHATE | A,B | 1ISJ | 0.83 | |
NMN | BETA-NICOTINAMIDE RIBOSE MONOPHOSPHATE | A,B | 3DZJ | 0.83 | |
NMN | BETA-NICOTINAMIDE RIBOSE MONOPHOSPHATE | A,B | 2HCT | 0.83 | |
FXV | METHYL-3-(4'-N-OXOPYRIDYLPHENOYL)- 3-METHYL-2-(M-AMIDINOBENZYL)-PROPIONATE | A | 1KSN | 0.73 | |
C80 | (2S,4S,5R,7R)-4-AMINO-8-(BUTYLAMINO)- 5-HYDROXY-2,7-DIMETHYL-8-OXOOCTYL 1- BENZYL-1H-INDOLE-3-CARBOXYLATE | C,O | 2V11 | 0.71 | |
PM2 | 1-[3-(1-{[5-(2-PHENYLETHYL)PYRIDIN- 3-YL]CARBONYL}PIPERIDIN-4-YL)PHENYL]METHANAMINE | A,B,C,D | 2BM2 | 0.7 | |
NCN | NICOTINATE MONONUCLEOTIDE | A,B | 2QTN | 0.78 | |
NCN | NICOTINATE MONONUCLEOTIDE | A | 1L4F | 0.78 | |
NCN | NICOTINATE MONONUCLEOTIDE | A | 1L4L | 0.78 | |
NCN | NICOTINATE MONONUCLEOTIDE | A,B,C,D | 1YUM | 0.78 | |
NCN | NICOTINATE MONONUCLEOTIDE | A | 1L4M | 0.78 | |
NCN | NICOTINATE MONONUCLEOTIDE | A,B,C,D,E,F | 1QPN | 0.78 | |
NCN | NICOTINATE MONONUCLEOTIDE | A,B,C | 2B7Q | 0.78 | |
NCN | NICOTINATE MONONUCLEOTIDE | A | 1L4K | 0.78 | |
NCN | NICOTINATE MONONUCLEOTIDE | A | 1L4G | 0.78 | |
NCN | NICOTINATE MONONUCLEOTIDE | A | 1YTK | 0.78 | |
NCN | NICOTINATE MONONUCLEOTIDE | A | 1L4H | 0.78 | |
NCN | NICOTINATE MONONUCLEOTIDE | A | 1L5O | 0.78 | |
NIO | NICOTINIC ACID | A | 1JHQ | 0.7 | |
NIO | NICOTINIC ACID | A | 1L5L | 0.7 | |
NIO | NICOTINIC ACID | A | 2F7F | 0.7 | |
NIO | NICOTINIC ACID | A | 1L5K | 0.7 | |
NIO | NICOTINIC ACID | A | 1JHY | 0.7 | |
NIO | NICOTINIC ACID | A,B | 1FSL | 0.7 | |
NIO | NICOTINIC ACID | A | 1L5M | 0.7 | |
NIO | NICOTINIC ACID | A | 1LH6 | 0.7 | |
NIO | NICOTINIC ACID | A | 1JHO | 0.7 | |
NIO | NICOTINIC ACID | A | 3CI8 | 0.7 | |
NIO | NICOTINIC ACID | A,B,C,D | 1ICU | 0.7 | |
NIO | NICOTINIC ACID | A,B,C,D,E,F, G,H | 3HRD | 0.7 | |
NIO | NICOTINIC ACID | A | 1JHA | 0.7 | |
NIO | NICOTINIC ACID | A | 1JHV | 0.7 | |
NIO | NICOTINIC ACID | A | 1L4N | 0.7 | |
NIO | NICOTINIC ACID | A | 2LH6 | 0.7 | |
NIO | NICOTINIC ACID | A | 1D0V | 0.7 | |
NIO | NICOTINIC ACID | A,B,C,D | 1ICV | 0.7 | |
NIO | NICOTINIC ACID | A,B | 1ICR | 0.7 | |
NIO | NICOTINIC ACID | A | 1JHR | 0.7 | |
NCA | NICOTINAMIDE | A,B | 2E5D | 0.72 | |
NCA | NICOTINAMIDE | A,B,C,D | 2Z77 | 0.72 | |
NCA | NICOTINAMIDE | A,B | 1DMA | 0.72 | |
NCA | NICOTINAMIDE | A,B | 1ISM | 0.72 | |
NCA | NICOTINAMIDE | A,B | 1YC5 | 0.72 | |
NCA | NICOTINAMIDE | A | 2ZB7 | 0.72 | |
NCA | NICOTINAMIDE | A,B,C,D,E,F, G,H | 1R15 | 0.72 | |
NCA | NICOTINAMIDE | A,B | 2QQG | 0.72 | |
NCA | NICOTINAMIDE | A | 2OTV | 0.72 | |
NCA | NICOTINAMIDE | A | 2QHF | 0.72 | |
NCA | NICOTINAMIDE | A,B,C,D | 2C8A | 0.72 | |
NCA | NICOTINAMIDE | A,B | 2HJH | 0.72 | |
NCA | NICOTINAMIDE | A | 2A15 | 0.72 | |
NCA | NICOTINAMIDE | A | 2R6V | 0.72 | |
NCA | NICOTINAMIDE | A,B | 1ISI | 0.72 | |
NCA | NICOTINAMIDE | A,D,E | 2R9J | 0.72 | |
NCA | NICOTINAMIDE | A | 2H4J | 0.72 | |
NCA | NICOTINAMIDE | A,B | 2OD9 | 0.72 | |
NCA | NICOTINAMIDE | A,B,C,D,E | 1YC2 | 0.72 | |
NCA | NICOTINAMIDE | A,B | 3DZG | 0.72 | |
NCA | NICOTINAMIDE | A | 1OJU | 0.72 | |
NA3 | (3S)-3-{[(5-BROMOPYRIDIN-3-YL)CARBONYL]AMINO}- 4-OXOBUTANOIC ACID | A | 1RE1 | 0.72 | |
K27 | 4-carbamoyl-1-(3-{4-[(E)-(hydroxyimino)methyl]pyridinium- 1-yl}propyl)pyridinium | A,B | 2WHR | 0.71 | |
NNR | Nicotinamide riboside | A | 2QT0 | 0.85 | |
NNR | Nicotinamide riboside | A | 2QT1 | 0.85 | |
PBO | 1-PYRIDIN-3-YLBUTAN-1-ONE | A | 1PYJ | 0.7 | |
HLO | 1-[({2,4-BIS[(E)-(HYDROXYIMINO)METHYL]PYRIDINIUM- 1-YL}METHOXY)METHYL]-4-CARBAMOYLPYRIDINIUM | A,B | 2JEY | 0.72 | |
HLO | 1-[({2,4-BIS[(E)-(HYDROXYIMINO)METHYL]PYRIDINIUM- 1-YL}METHOXY)METHYL]-4-CARBAMOYLPYRIDINIUM | A,B | 2JEZ | 0.72 | |
1IN | 1-[2-HYDROXY-4-(2-HYDROXY-5-METHYL- CYCLOPENTYLCARBAMOYL)5-PHENYL-PENTYL]- 4-(3-PYRIDIN-3-YL-PROPIONYL)-PIPERAZINE- 2-CARBOXYLIC ACID TERT-BUTYLAMIDE | B | 2BPV | 0.72 | |
1IN | 1-[2-HYDROXY-4-(2-HYDROXY-5-METHYL- CYCLOPENTYLCARBAMOYL)5-PHENYL-PENTYL]- 4-(3-PYRIDIN-3-YL-PROPIONYL)-PIPERAZINE- 2-CARBOXYLIC ACID TERT-BUTYLAMIDE | B | 2BPW | 0.72 | |
PRR | 3-(METHYL-PYRIDINIUM)ALANINE | H,I,J | 7KME | 0.72 | |
368 | (1R)-2-{[AMINO(IMINO)METHYL]AMINO}- 1-{4-[(4R)-4-(HYDROXYMETHYL)-1,3,2- DIOXABOROLAN-2-YL]PHENYL}ETHYL NICOTINATE | A | 1ZLR | 0.76 | |
HI6 | 4-(AMINOCARBONYL)-1-[({2-[(E)-(HYDROXYIMINO)METHYL]PYRIDINIUM- 1-YL}METHOXY)METHYL]PYRIDINIUM | A,B | 2WHQ | 0.71 | |
HI6 | 4-(AMINOCARBONYL)-1-[({2-[(E)-(HYDROXYIMINO)METHYL]PYRIDINIUM- 1-YL}METHOXY)METHYL]PYRIDINIUM | A,B | 2WHP | 0.71 | |
HI6 | 4-(AMINOCARBONYL)-1-[({2-[(E)-(HYDROXYIMINO)METHYL]PYRIDINIUM- 1-YL}METHOXY)METHYL]PYRIDINIUM | A,B | 2GYU | 0.71 | |
475 | N-[oxo(pyridin-2-ylamino)acetyl]- beta-D-glucopyranosylamine | A | 3CUV | 0.72 | |
DGB | N-[4-(1-BENZOYLPIPERIDIN-4-YL)BUTYL]- 3-PYRIDIN-3-YLPROPANAMIDE | A,B | 2G97 | 0.74 | |
DGB | N-[4-(1-BENZOYLPIPERIDIN-4-YL)BUTYL]- 3-PYRIDIN-3-YLPROPANAMIDE | A,B | 2GVJ | 0.74 | |
NA4 | 4-[5-(2-CARBOXY-1-FORMYL-ETHYLCARBAMOYL)- PYRIDIN-3-YL]-BENZOIC ACID | A,C | 1RHM | 0.71 |