Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00740027
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 |
JPL | 5-(cyclohexa-1,5-dien-1-ylmethyl)- 2-(2,4-dichlorophenoxy)phenol | A | 3FNG | 0.8 |  |
TCL | TRICLOSAN | A,B,C,D | 2PD3 | 0.87 | |
| TCL | TRICLOSAN | A,B | 1P45 | 0.87 | |
| TCL | TRICLOSAN | A,B,C,D,E,F | 2B35 | 0.87 | |
| TCL | TRICLOSAN | A,B | 1D8A | 0.87 | |
| TCL | TRICLOSAN | A,B | 1C14 | 0.87 | |
| TCL | TRICLOSAN | A,B,C,D | 2QIO | 0.87 | |
| TCL | TRICLOSAN | A,B | 1NHG | 0.87 | |
| TCL | TRICLOSAN | A | 1D7O | 0.87 | |
| TCL | TRICLOSAN | A,B,C,D | 2O2Y | 0.87 | |
| TCL | TRICLOSAN | A,B | 1UH5 | 0.87 | |
| TCL | TRICLOSAN | A,B | 2O2S | 0.87 | |
| TCL | TRICLOSAN | A,B,C,D | 1QG6 | 0.87 | |
| TCL | TRICLOSAN | A,B,C,D,E,F, G,H | 1QSG | 0.87 | |
INK | (RP,SP)-O-(2R)-(1-PHENOXYBUT-2- YL)-METHYLPHOSPHONIC ACID CHLORIDE | A | 1HQD | 0.73 | |
JPN | 2-(2,4-DICHLOROPHENOXY)-5-(3-PHENYLPROPYL)PHENOL | A,B | 2OL4 | 0.79 | |
JPJ | 2-(2,4-DICHLOROPHENOXY)-5-(2-PHENYLETHYL)PHENOL | A,B | 2OOS | 0.79 | |
| JPJ | 2-(2,4-DICHLOROPHENOXY)-5-(2-PHENYLETHYL)PHENOL | A | 3FNH | 0.79 | |
TN5 | 2-(4-AMINO-2-CHLOROPHENOXY)-5-CHLOROPHENOL | A,B | 1ZW1 | 0.71 | |
WRA | 6,6-DIMETHYL-1-[3-(2,4,5-TRICHLOROPHENOXY)PROPOXY]- 1,6-DIHYDRO-1,3,5-TRIAZINE-2,4- DIAMINE | A,B,C,D | 1J3K | 0.71 | |
| WRA | 6,6-DIMETHYL-1-[3-(2,4,5-TRICHLOROPHENOXY)PROPOXY]- 1,6-DIHYDRO-1,3,5-TRIAZINE-2,4- DIAMINE | A,B,C,D | 1J3I | 0.71 | |
258 | (2-chloroethoxy)benzene | X | 2RAY | 0.75 | |
MLG | N-[3-(2,4-DICHLOROPHENOXY)PROPYL]- N-METHYL-N-PROP-2-YNYLAMINE | A,B | 2BXR | 0.79 | |
| MLG | N-[3-(2,4-DICHLOROPHENOXY)PROPYL]- N-METHYL-N-PROP-2-YNYLAMINE | A,B | 2BXS | 0.79 | |
| MLG | N-[3-(2,4-DICHLOROPHENOXY)PROPYL]- N-METHYL-N-PROP-2-YNYLAMINE | A,B,C,D | 1O5W | 0.79 | |
JPM | 5-benzyl-2-(2,4-dichlorophenoxy)phenol | A,B,C,D | 3FNF | 0.78 | |
JPA | 4-(2,4-DICHLOROPHENOXY)-2'-METHYLBIPHENYL- 3-OL | A,B | 2FOI | 0.78 | |
268 | 2-phenoxyethanol | A | 2RBR | 0.73 | |
261 | 2-ethoxyphenol | X | 2RB1 | 0.75 | |
DCN | DICLOSAN | A,B,C,D | 2PD4 | 0.83 | |
CFA | (2,4-DICHLOROPHENOXY)ACETIC ACID | B,E | 2P1N | 0.81 | |
TCT | 6-(4-CHLORO-2-HYDROXY-PHENOXY)- NAPHTHALEN-2-OL | A,B | 1NNU | 0.71 | |
34C | (3-CHLORO-4-PROPOXY-PHENYL)-ACETIC ACID | A,B | 1HT8 | 0.7 | |
D1L | 2-[4-(2,4-DICHLOROPHENOXY)PHENOXY]PROPANOIC ACID | A,B | 1UYR | 0.83 | |
YRG | (2S)-2-(4-chlorophenoxy)-3-phenylpropanoic acid | A | 3CDP | 0.7 | |
SC4 | 1[2-CHLORO-4-METHOXY-PHENYL-OXYMETHYL]- 4-[2,6-DICHLORO-PHENYL-OXYMETHYL]- BENZENE | 1,4 | 1EAH | 0.83 | |
| SC4 | 1[2-CHLORO-4-METHOXY-PHENYL-OXYMETHYL]- 4-[2,6-DICHLORO-PHENYL-OXYMETHYL]- BENZENE | 1,4 | 3EPF | 0.83 | |
POT | (1S)-1-(PHENOXYMETHYL)PROPYL METHYLPHOSPHONOCHLORIDOATE | A | 2NW6 | 0.73 | |