Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03003867
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 |
RSO | R-STYRENE OXIDE | A,B | 1PWZ | 0.74 |  |
SMN | (S)-MANDELIC ACID | A | 1MDL | 0.72 | |
IOB | 3-IODO-BENZYL ALCOHOL | A,B | 1QK0 | 0.79 | |
ETY | 4-ethylphenol | A,B,C,D | 2RA6 | 0.71 | |
2NA | naphthalen-2-ylmethanol | A,B,C | 3EE5 | 0.72 | |
MXN | (2R)-hydroxy(phenyl)ethanenitrile | A,B | 3GDN | 0.8 | |
PPP | 3-PHENYL-1,2-PROPANDIOL | A,B | 1HRN | 0.77 | |
12M | (2-ETHYLPHENYL)METHANOL | A,B | 2F62 | 0.8 | |
24B | (2,4-DIFLUOROPHENYL)METHANOL | A,B | 1QV6 | 0.84 | |
295 | (2S,3S)-3-(4-fluorophenyl)-2,3- dihydroxypropanoic acid | A,B | 2RJR | 0.71 | |
SS1 | 1-PHENYLETHANOL | H | 1UM5 | 0.84 | |
PHK | (2R,3S)-3-AMINO-1-CHLORO-4-PHENYL- BUTAN-2-OL | A | 1MU0 | 0.7 | |
| PHK | (2R,3S)-3-AMINO-1-CHLORO-4-PHENYL- BUTAN-2-OL | A | 1XRL | 0.7 | |
NDH | (1R, 2S)-CIS 1,2 DIHYDROXY-1,2- DIHYDRONAPHTHALENE | A,B | 1O7P | 0.77 | |
BGG | CARBONIC ACID MONOBENZYL ESTER | B,D | 1DLK | 0.7 | |
MNN | (S)-MANDELIC ACID NITRILE | A | 1YB6 | 0.8 | |
269 | (1R)-3-chloro-1-phenylpropan-1- ol | A | 2RBS | 0.89 | |
2LP | 2-ALLYLPHENOL | A | 1OV5 | 0.73 | |
4FA | 4-FLUOROPHENETHYL ALCOHOL | A | 1OWZ | 0.78 | |
LYL | 2-ALLYL-6-METHYL-PHENOL | A | 1OV7 | 0.71 | |
341 | (3,5-difluorophenyl)methanol | C | 3EON | 0.83 | |
DFB | 2,3-DIFLUOROBENZYL ALCOHOL | A,B | 1QV7 | 0.84 | |
| DFB | 2,3-DIFLUOROBENZYL ALCOHOL | A,B,C,D | 1MG0 | 0.84 | |
OBZ | O-benzylhydroxylamine | A,B | 3DTH | 0.72 | |
| OBZ | O-benzylhydroxylamine | A,B | 3DTG | 0.72 | |
BRB | PARA-BROMOBENZYL ALCOHOL | A,B | 1HLD | 0.73 | |
RMN | (R)-MANDELIC ACID | A | 1MDL | 0.72 | |
| RMN | (R)-MANDELIC ACID | A,B,C,D,E,F, G,H,I,J,K,L, M,N,O,P | 1MCZ | 0.72 | |
DHR | (2S)-HYDROXY(4-HYDROXYPHENYL)ETHANENITRILE | A,B | 1E55 | 0.71 | |
PEL | 2-PHENYL-ETHANOL | A,B | 1I0D | 0.77 | |
| PEL | 2-PHENYL-ETHANOL | D,H | 2I0T | 0.77 | |
| PEL | 2-PHENYL-ETHANOL | A,B | 1HZY | 0.77 | |
| PEL | 2-PHENYL-ETHANOL | A,B | 1I0B | 0.77 | |
| PEL | 2-PHENYL-ETHANOL | A | 1EYW | 0.77 | |
| PEL | 2-PHENYL-ETHANOL | A,B | 1JGM | 0.77 | |
SS2 | (1R)-1-PHENYLETHANOL | A | 1ZK0 | 0.84 | |
| SS2 | (1R)-1-PHENYLETHANOL | A | 1ZJZ | 0.84 | |
| SS2 | (1R)-1-PHENYLETHANOL | A | 1ZJY | 0.84 | |
FCR | ALPHA,ALPHA,ALPHA-TRIFLUORO-P-CRESOL | A,B | 1E0Y | 0.75 | |
| FCR | ALPHA,ALPHA,ALPHA-TRIFLUORO-P-CRESOL | A,B | 1E8G | 0.75 | |
EPT | HEPTANYL-P-PHENOL | A,B | 1AHZ | 0.71 | |
PFB | 2,3,4,5,6-PENTAFLUOROBENZYL ALCOHOL | A,B | 1MGO | 0.75 | |
| PFB | 2,3,4,5,6-PENTAFLUOROBENZYL ALCOHOL | A,B | 1HLD | 0.75 | |