Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00227625
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 |
CT5 | 4-[4-(2,3-DIHYDRO-1,4-BENZODIOXIN- 6-YL)-3-METHYL-1H-PYRAZOL-5-YL]- 6-ETHYLBENZENE-1,3-DIOL | A | 2BRC | 0.71 |  |
| CT5 | 4-[4-(2,3-DIHYDRO-1,4-BENZODIOXIN- 6-YL)-3-METHYL-1H-PYRAZOL-5-YL]- 6-ETHYLBENZENE-1,3-DIOL | A,B | 2CDD | 0.71 | |
| CT5 | 4-[4-(2,3-DIHYDRO-1,4-BENZODIOXIN- 6-YL)-3-METHYL-1H-PYRAZOL-5-YL]- 6-ETHYLBENZENE-1,3-DIOL | A,B | 2BT0 | 0.71 | |
IMZ | CIS-[4,5-BIS-(4-BROMOPHENYL)-2- (2-ETHOXY-4-METHOXYPHENYL)-4,5- DIHYDROIMIDAZOL-1-YL]-[4-(2-HYDROXYETHYL)PIPERAZIN- 1-YL]METHANONE | A,B,C | 1RV1 | 0.71 | |
GNT | (-)-GALANTHAMINE | A | 1DX6 | 0.73 | |
| GNT | (-)-GALANTHAMINE | A | 1QTI | 0.73 | |
| GNT | (-)-GALANTHAMINE | A,B,C,D,E | 2PH9 | 0.73 | |
| GNT | (-)-GALANTHAMINE | A,B | 1W76 | 0.73 | |
| GNT | (-)-GALANTHAMINE | A | 1W6R | 0.73 | |
REN | (S)-reticuline | A | 3FWA | 0.73 | |
| REN | (S)-reticuline | A | 3D2D | 0.73 | |
DPD | A,B | 1QIW | 0.74 | | |
| DPD | A | 1QIV | 0.74 | | |
SLX | (13aS)-3,10-dimethoxy-5,8,13,13a- tetrahydro-6H-isoquino[3,2-a]isoquinoline- 2,9-diol | A | 3FW9 | 0.74 | |
IMY | 1-{[4,5-BIS(4-CHLOROPHENYL)-2-(2- ISOPROPOXY-4-METHOXYPHENYL)-4,5- DIHYDRO-1H-IMIDAZOL-1-YL]CARBONYL}PIPERAZINE | A | 1TTV | 0.7 | |