Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02310896
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 |
8PP | 2-[(2E,6E,10E,14E,18E,22E,26E)- 3,7,11,15,19,23,27,31-OCTAMETHYLDOTRIACONTA- 2,6,10,14,18,22,26,30-OCTAENYL]PHENOL | A,B,C,D | 1Y0G | 0.7 |  |
SS1 | 1-PHENYLETHANOL | H | 1UM5 | 0.77 | |
NE2 | 3,3',4',5-TETRACHLOROBIPHENYL-4- OL | A,B | 2GAB | 0.72 | |
NE1 | 2',3,3',4',5-PENTACHLOROBIPHENYL- 4-OL | A,B | 2G9K | 0.71 | |
PCQ | 3,5,3',5'-TETRACHLORO-BIPHENYL- 4,4'-DIOL | A,B | 1G3M | 0.73 | |
| PCQ | 3,5,3',5'-TETRACHLORO-BIPHENYL- 4,4'-DIOL | A,B | 2G5U | 0.73 | |
EPT | HEPTANYL-P-PHENOL | A,B | 1AHZ | 0.73 | |
269 | (1R)-3-chloro-1-phenylpropan-1- ol | A | 2RBS | 0.82 | |
FCR | ALPHA,ALPHA,ALPHA-TRIFLUORO-P-CRESOL | A,B | 1E0Y | 0.76 | |
| FCR | ALPHA,ALPHA,ALPHA-TRIFLUORO-P-CRESOL | A,B | 1E8G | 0.76 | |
NDH | (1R, 2S)-CIS 1,2 DIHYDROXY-1,2- DIHYDRONAPHTHALENE | A,B | 1O7P | 0.72 | |
341 | (3,5-difluorophenyl)methanol | C | 3EON | 0.78 | |
IPB | 5-METHYL-2-(1-METHYLETHYL)PHENOL | A,B | 1E06 | 0.72 | |
LYL | 2-ALLYL-6-METHYL-PHENOL | A | 1OV7 | 0.74 | |
DFB | 2,3-DIFLUOROBENZYL ALCOHOL | A,B | 1QV7 | 0.79 | |
| DFB | 2,3-DIFLUOROBENZYL ALCOHOL | A,B,C,D | 1MG0 | 0.79 | |
MXN | (2R)-hydroxy(phenyl)ethanenitrile | A,B | 3GDN | 0.74 | |
PFB | 2,3,4,5,6-PENTAFLUOROBENZYL ALCOHOL | A,B | 1MGO | 0.72 | |
| PFB | 2,3,4,5,6-PENTAFLUOROBENZYL ALCOHOL | A,B | 1HLD | 0.72 | |
PFL | 2,6-BIS(1-METHYLETHYL)PHENOL | A,B | 1E7A | 0.73 | |
SS2 | (1R)-1-PHENYLETHANOL | A | 1ZK0 | 0.77 | |
| SS2 | (1R)-1-PHENYLETHANOL | A | 1ZJZ | 0.77 | |
| SS2 | (1R)-1-PHENYLETHANOL | A | 1ZJY | 0.77 | |
2NA | naphthalen-2-ylmethanol | A,B,C | 3EE5 | 0.71 | |
ETY | 4-ethylphenol | A,B,C,D | 2RA6 | 0.72 | |
2LP | 2-ALLYLPHENOL | A | 1OV5 | 0.74 | |
2MP | 3,4-DIMETHYLPHENOL | A | 1L5O | 0.71 | |
IOB | 3-IODO-BENZYL ALCOHOL | A,B | 1QK0 | 0.74 | |
PEL | 2-PHENYL-ETHANOL | A,B | 1I0D | 0.72 | |
| PEL | 2-PHENYL-ETHANOL | D,H | 2I0T | 0.72 | |
| PEL | 2-PHENYL-ETHANOL | A,B | 1HZY | 0.72 | |
| PEL | 2-PHENYL-ETHANOL | A,B | 1I0B | 0.72 | |
| PEL | 2-PHENYL-ETHANOL | A | 1EYW | 0.72 | |
| PEL | 2-PHENYL-ETHANOL | A,B | 1JGM | 0.72 | |
MNN | (S)-MANDELIC ACID NITRILE | A | 1YB6 | 0.74 | |
APG | ATROLACTIC ACID (2-PHENYL-LACTIC ACID) | A | 1MRA | 0.71 | |
| APG | ATROLACTIC ACID (2-PHENYL-LACTIC ACID) | A | 1MNS | 0.71 | |
| APG | ATROLACTIC ACID (2-PHENYL-LACTIC ACID) | A | 1DTN | 0.71 | |
| APG | ATROLACTIC ACID (2-PHENYL-LACTIC ACID) | A | 1MDR | 0.71 | |
12M | (2-ETHYLPHENYL)METHANOL | A,B | 2F62 | 0.77 | |
4FA | 4-FLUOROPHENETHYL ALCOHOL | A | 1OWZ | 0.73 | |
43M | 4-CHLORO-3-METHYLPHENOL | A | 2P7A | 0.71 | |
24B | (2,4-DIFLUOROPHENYL)METHANOL | A,B | 1QV6 | 0.79 | |