Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00023588
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 |
TRT | FRAGMENT OF TRITON X-100 | A,E | 2I0U | 0.72 | |
TRT | FRAGMENT OF TRITON X-100 | A,B | 1OIZ | 0.72 | |
261 | 2-ethoxyphenol | X | 2RB1 | 0.77 | |
INK | (RP,SP)-O-(2R)-(1-PHENOXYBUT-2- YL)-METHYLPHOSPHONIC ACID CHLORIDE | A | 1HQD | 0.78 | |
LJ4 | 2,6-dibromo-4-phenoxyphenol | A,B | 3CN3 | 0.81 | |
4BR | 2-(4-METHYLPHENOXY)ETHYLPHOSPHINATE | A | 1PE7 | 0.75 | |
440 | 3-{[4-(but-2-yn-1-yloxy)phenyl]sulfonyl}propane- 1-thiol | A | 3B92 | 0.71 | |
TBP | 2,4,6-TRIBROMOPHENOL | L | 1E5A | 0.71 | |
WRB | 1-[3-(4-BROMO-PHENOXY)-PROPOXY]- 6,6-DIMETHYL-1.6-DIHYDRO-[1,3,5]TRIAZINE- 2,4-DIAMINE | A | 1DG7 | 0.78 | |
2BR | 2-BROMOPHENOL | A,B,C,D | 2A9W | 0.75 | |
POT | (1S)-1-(PHENOXYMETHYL)PROPYL METHYLPHOSPHONOCHLORIDOATE | A | 2NW6 | 0.78 | |
EPL | DIETHYL 4-METHOXYPHENYL PHOSPHATE | A | 2R1N | 0.77 | |
MSB | 1-METHYLOXY-4-SULFONE-BENZENE | A | 1EUB | 0.72 | |
MSB | 1-METHYLOXY-4-SULFONE-BENZENE | A | 1BM6 | 0.72 | |
BOP | 1-BROMO-4-METHOXYBENZENE | C,F | 1RHQ | 0.92 | |
BML | 4-BROMOPHENOL | A,B,E | 3DHH | 0.77 | |
BML | 4-BROMOPHENOL | A,B | 1XU3 | 0.77 | |
BML | 4-BROMOPHENOL | A,B | 1T0S | 0.77 | |
268 | 2-phenoxyethanol | A | 2RBR | 0.8 | |
258 | (2-chloroethoxy)benzene | X | 2RAY | 0.81 | |
TON | 2-{2-[4-(1,1,3,3-TETRAMETHYLBUTYL)PHENOXY]ETHOXY}ETHANOL | A,B | 1SEZ | 0.71 |