Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02997039
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 |
B76 | A,B | 2E9D | 0.74 |  | |
EUG | 2-METHOXY-4-VINYL-PHENOL | A | 2QU9 | 0.74 | |
| EUG | 2-METHOXY-4-VINYL-PHENOL | A,B | 1QLU | 0.74 | |
| EUG | 2-METHOXY-4-VINYL-PHENOL | A,B | 1W1J | 0.74 | |
| EUG | 2-METHOXY-4-VINYL-PHENOL | A,B | 2VAO | 0.74 | |
| EUG | 2-METHOXY-4-VINYL-PHENOL | A,B | 1W1K | 0.74 | |
| EUG | 2-METHOXY-4-VINYL-PHENOL | A,B | 1DZN | 0.74 | |
| EUG | 2-METHOXY-4-VINYL-PHENOL | A,B | 1W1L | 0.74 | |
| EUG | 2-METHOXY-4-VINYL-PHENOL | A,B | 1W1M | 0.74 | |
BOP | 1-BROMO-4-METHOXYBENZENE | C,F | 1RHQ | 0.71 | |
261 | 2-ethoxyphenol | X | 2RB1 | 0.86 | |
EPL | DIETHYL 4-METHOXYPHENYL PHOSPHATE | A | 2R1N | 0.79 | |
4HY | [4-(4-HYDROXY-3-IODO-PHENOXY)-3,5- DIIODO-PHENYL]-ACETIC ACID | A | 2PIT | 0.71 | |
| 4HY | [4-(4-HYDROXY-3-IODO-PHENOXY)-3,5- DIIODO-PHENYL]-ACETIC ACID | A | 1NQ1 | 0.71 | |
| 4HY | [4-(4-HYDROXY-3-IODO-PHENOXY)-3,5- DIIODO-PHENYL]-ACETIC ACID | A | 2PIU | 0.71 | |
| 4HY | [4-(4-HYDROXY-3-IODO-PHENOXY)-3,5- DIIODO-PHENYL]-ACETIC ACID | A | 2PKL | 0.71 | |
| 4HY | [4-(4-HYDROXY-3-IODO-PHENOXY)-3,5- DIIODO-PHENYL]-ACETIC ACID | A,B | 3D57 | 0.71 | |
| 4HY | [4-(4-HYDROXY-3-IODO-PHENOXY)-3,5- DIIODO-PHENYL]-ACETIC ACID | A | 1NQ2 | 0.71 | |
| 4HY | [4-(4-HYDROXY-3-IODO-PHENOXY)-3,5- DIIODO-PHENYL]-ACETIC ACID | A | 2QPY | 0.71 | |
| 4HY | [4-(4-HYDROXY-3-IODO-PHENOXY)-3,5- DIIODO-PHENYL]-ACETIC ACID | A | 1NQ0 | 0.71 | |
| 4HY | [4-(4-HYDROXY-3-IODO-PHENOXY)-3,5- DIIODO-PHENYL]-ACETIC ACID | A | 1NUO | 0.71 | |
| 4HY | [4-(4-HYDROXY-3-IODO-PHENOXY)-3,5- DIIODO-PHENYL]-ACETIC ACID | A,B | 2PIN | 0.71 | |
TRT | FRAGMENT OF TRITON X-100 | A,E | 2I0U | 0.74 | |
| TRT | FRAGMENT OF TRITON X-100 | A,B | 1OIZ | 0.74 | |
H53 | 2-(2,5-DIHYDROXYPHENYL)-6-(HYDROXYMETHYL)OXANE- 3,4,5-TRIOL | A | 2FF5 | 0.72 | |
| H53 | 2-(2,5-DIHYDROXYPHENYL)-6-(HYDROXYMETHYL)OXANE- 3,4,5-TRIOL | A | 2FET | 0.72 | |
4HM | 4-HYDROPEROXY-2-METHOXY-PHENOL | A | 1HU9 | 0.76 | |
LRG | (2S)-2-(biphenyl-4-yloxy)-3-phenylpropanoic acid | A | 3B3K | 0.71 | |
| LRG | (2S)-2-(biphenyl-4-yloxy)-3-phenylpropanoic acid | A | 3D6D | 0.71 | |
CAQ | CATECHOL | B | 2BUY | 0.71 | |
| CAQ | CATECHOL | A | 1KND | 0.71 | |
| CAQ | CATECHOL | B | 2BUQ | 0.71 | |
| CAQ | CATECHOL | A,B | 1DLT | 0.71 | |
| CAQ | CATECHOL | A | 1XEP | 0.71 | |
| CAQ | CATECHOL | A | 2PUM | 0.71 | |
CFA | (2,4-DICHLOROPHENOXY)ACETIC ACID | B,E | 2P1N | 0.73 | |
D1L | 2-[4-(2,4-DICHLOROPHENOXY)PHENOXY]PROPANOIC ACID | A,B | 1UYR | 0.75 | |
LJ4 | 2,6-dibromo-4-phenoxyphenol | A,B | 3CN3 | 0.79 | |
4BR | 2-(4-METHYLPHENOXY)ETHYLPHOSPHINATE | A | 1PE7 | 0.75 | |
DCN | DICLOSAN | A,B,C,D | 2PD4 | 0.78 | |
POT | (1S)-1-(PHENOXYMETHYL)PROPYL METHYLPHOSPHONOCHLORIDOATE | A | 2NW6 | 0.8 | |
OA5 | 6-(2-phenoxyethoxy)-1,3,5-triazine- 2,4-diamine | A,B | 2W6Q | 0.71 | |
OXN | OXTOXYNOL-10 | A | 1IKT | 0.76 | |
| OXN | OXTOXYNOL-10 | A,B | 2Q32 | 0.76 | |
| OXN | OXTOXYNOL-10 | A,B | 1UEH | 0.76 | |
| OXN | OXTOXYNOL-10 | A,B | 2D4Q | 0.76 | |
TF5 | 2-[(2',3',4'-TRIFLUOROBIPHENYL- 2-YL)OXY]ETHANOL | A,B | 2OP3 | 0.83 | |
TTO | (3,4-DIHYDROXY-PHENYL)-TRIPHENYL- ARSONIUM | A | 1HYZ | 0.7 | |
INK | (RP,SP)-O-(2R)-(1-PHENOXYBUT-2- YL)-METHYLPHOSPHONIC ACID CHLORIDE | A | 1HQD | 0.8 | |
YR3 | (2S)-3-{4-[1-ethyl-1-(4-{[(2R)- 2-hydroxy-3,3-dimethylbutyl]oxy}- 3-methylphenyl)propyl]-2-methylphenoxy}propane- 1,2-diol | A | 2ZFX | 0.77 | |
GRR | (2S)-2-(4-ethylphenoxy)-3-phenylpropanoic acid | A | 3CDS | 0.74 | |
EGT | 2-(3,4,5-TRIHYDROXY-PHENYL)-CHROMAN- 3,5,7-TRIOL | A | 1JNQ | 0.72 | |
268 | 2-phenoxyethanol | A | 2RBR | 0.94 | |
MSB | 1-METHYLOXY-4-SULFONE-BENZENE | A | 1EUB | 0.72 | |
| MSB | 1-METHYLOXY-4-SULFONE-BENZENE | A | 1BM6 | 0.72 | |
5PP | 5-PENTYL-2-PHENOXYPHENOL | A,B,C,D,E,F | 2B36 | 0.75 | |
NOA | NAPHTHYLOXYACETIC ACID | A,B,I | 1HIV | 0.75 | |
| NOA | NAPHTHYLOXYACETIC ACID | I | 1IVP | 0.75 | |
CMZ | (2S)-1-(2,5-dimethylphenoxy)-3- morpholin-4-ylpropan-2-ol | A | 2OF0 | 0.71 | |
TON | 2-{2-[4-(1,1,3,3-TETRAMETHYLBUTYL)PHENOXY]ETHOXY}ETHANOL | A,B | 1SEZ | 0.79 | |
DR6 | ALPHA-[4-(1,1,3,3 - TETRAMETHYLBUTYL)PHENYL]- OMEGA-HYDROXY-POLY(OXY-1,2-ETHANEDIYL) | C,I,T | 1YTZ | 0.75 | |
8PS | 5-OCTYL-2-PHENOXYPHENOL | A,B,C,D,E,F | 2B37 | 0.75 | |
YRG | (2S)-2-(4-chlorophenoxy)-3-phenylpropanoic acid | A | 3CDP | 0.7 | |
258 | (2-chloroethoxy)benzene | X | 2RAY | 0.81 | |
2C2 | (2S)-2-HYDROXY-2H-CHROMENE-2-CARBOXYLIC ACID | A | 2IME | 0.72 | |
| 2C2 | (2S)-2-HYDROXY-2H-CHROMENE-2-CARBOXYLIC ACID | A | 2IMD | 0.72 | |
TCL | TRICLOSAN | A,B,C,D | 2PD3 | 0.74 | |
| TCL | TRICLOSAN | A,B | 1P45 | 0.74 | |
| TCL | TRICLOSAN | A,B,C,D,E,F | 2B35 | 0.74 | |
| TCL | TRICLOSAN | A,B | 1D8A | 0.74 | |
| TCL | TRICLOSAN | A,B | 1C14 | 0.74 | |
| TCL | TRICLOSAN | A,B,C,D | 2QIO | 0.74 | |
| TCL | TRICLOSAN | A,B | 1NHG | 0.74 | |
| TCL | TRICLOSAN | A | 1D7O | 0.74 | |
| TCL | TRICLOSAN | A,B,C,D | 2O2Y | 0.74 | |
| TCL | TRICLOSAN | A,B | 1UH5 | 0.74 | |
| TCL | TRICLOSAN | A,B | 2O2S | 0.74 | |
| TCL | TRICLOSAN | A,B,C,D | 1QG6 | 0.74 | |
| TCL | TRICLOSAN | A,B,C,D,E,F, G,H | 1QSG | 0.74 | |
DBA | (2,6-DIMETHYL-PHENOXY)-ACETIC ACID | A,B | 1IDB | 0.75 | |
EGC | 2-(2-{2-[2-(2-{2-[2-(2-{2-[4-(1,1,3,3- TETRAMETHYL-BUTYL)-PHENOXY]-ETHOXY}- ETHOXY)-ETHOXY]-ETHOXY}-ETHOXY)- ETHOXY]-ETHOXY}-ETHOXY)-ETHANOL | A,B | 1JP3 | 0.76 | |
| EGC | 2-(2-{2-[2-(2-{2-[2-(2-{2-[4-(1,1,3,3- TETRAMETHYL-BUTYL)-PHENOXY]-ETHOXY}- ETHOXY)-ETHOXY]-ETHOXY}-ETHOXY)- ETHOXY]-ETHOXY}-ETHOXY)-ETHANOL | A | 2W22 | 0.76 | |