Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02818204
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 |
BMS | A,B | 1DKF | 0.73 | ||
HQU | 3-HYDROXYQUINALDIC ACID | C,D | 193D | 0.73 | |
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 | |
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 | 0.77 | |
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 | |
PT1 | PTEROIC ACID | A,B | 1TX0 | 0.72 | |
PT1 | PTEROIC ACID | A | 1BR6 | 0.72 | |
PT1 | PTEROIC ACID | A,B | 1HWP | 0.72 | |
PXG | 3-[O-PHOSPHONOPYRIDOXYL]--AMINO- BENZOIC ACID | A | 1B9I | 0.73 | |
D2G | N-METHYL(5-(PYRIDIN-3-YL)FURAN- 2-YL)METHANAMINE | A,B,C,D | 2FDV | 0.71 | |
NA4 | 4-[5-(2-CARBOXY-1-FORMYL-ETHYLCARBAMOYL)- PYRIDIN-3-YL]-BENZOIC ACID | A,C | 1RHM | 0.7 | |
PXL | 3-HYDROXY-5-(HYDROXYMETHYL)-2-METHYLISONICOTINALDEHYDE | A,B | 3FHX | 0.71 | |
PXL | 3-HYDROXY-5-(HYDROXYMETHYL)-2-METHYLISONICOTINALDEHYDE | A,B | 2DDW | 0.71 | |
PXL | 3-HYDROXY-5-(HYDROXYMETHYL)-2-METHYLISONICOTINALDEHYDE | A,B | 2Z9W | 0.71 | |
PXL | 3-HYDROXY-5-(HYDROXYMETHYL)-2-METHYLISONICOTINALDEHYDE | A,B | 2Z9X | 0.71 | |
PXL | 3-HYDROXY-5-(HYDROXYMETHYL)-2-METHYLISONICOTINALDEHYDE | A,B | 1TD2 | 0.71 | |
HQA | 3-(8-hydroxyquinolin-3-yl)-L-alanine | A,B | 3FCA | 0.73 | |
OAI | 6-(OXALYL-AMINO)-1H-INDOLE-5-CARBOXYLIC ACID | A | 1C83 | 0.71 | |
NPV | 4-[8-(3-nitrophenyl)-1,7-naphthyridin- 6-yl]benzoic acid | A,B | 2QYN | 0.73 | |
NPV | 4-[8-(3-nitrophenyl)-1,7-naphthyridin- 6-yl]benzoic acid | A,B | 2QYK | 0.73 | |
NPV | 4-[8-(3-nitrophenyl)-1,7-naphthyridin- 6-yl]benzoic acid | A | 2QYL | 0.73 | |
NTM | QUINOLINIC ACID | A | 3C2O | 0.74 | |
NTM | QUINOLINIC ACID | A,B | 1QAP | 0.74 | |
NTM | QUINOLINIC ACID | A,B,C,D,E,F | 1QPQ | 0.74 | |
NTM | QUINOLINIC ACID | A,B,C | 2B7N | 0.74 | |
3HM | 5-hydroxy-6-methylpyridine-3-carboxylic acid | A,B | 3GMC | 0.75 | |
368 | (1R)-2-{[AMINO(IMINO)METHYL]AMINO}- 1-{4-[(4R)-4-(HYDROXYMETHYL)-1,3,2- DIOXABOROLAN-2-YL]PHENYL}ETHYL NICOTINATE | A | 1ZLR | 0.71 | |
D1G | N,N-DIMETHYL(5-(PYRIDIN-3-YL)FURAN- 2-YL)METHANAMINE | A,B,C,D | 2FDU | 0.72 | |
APT | 2-AMINO-6-[(4-CARBOXY-PHENYLAMINO)- METHYL]-4-HYDROXY-PTERIDIN-1-IUM | A,B | 1QCJ | 0.71 | |
D3G | (5-(PYRIDIN-3-YL)FURAN-2-YL)METHANAMINE | A,B,C,D | 2FDW | 0.72 | |
4HG | N-[(4-HYDROXY-8-IODOISOQUINOLIN- 3-YL)CARBONYL]GLYCINE | A | 2G19 | 0.71 | |
4HG | N-[(4-HYDROXY-8-IODOISOQUINOLIN- 3-YL)CARBONYL]GLYCINE | A | 2G1M | 0.71 | |
QND | QUINALDIC ACID | A,B | 1IDA | 0.7 | |
859 | 2-({2-[(3-HYDROXYPHENYL)AMINO]PYRIMIDIN- 4-YL}AMINO)BENZAMIDE | A,B | 2NO3 | 0.7 | |
1IQ | 2-(4-ISOPROPYL-4-METHYL-5-OXO-4,5- DIHYDRO-1H-IMIDAZOL-2-YL)QUINOLINE- 3-CARBOXYLIC ACID | A | 1Z8N | 0.7 |