Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00007080
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 |
DMC | 3-(4-DIETHYLAMINO-2-HYDROXY-PHENYL)- 2-METHYL-PROPIONIC ACID | G | 4GCH | 0.82 |  |
TYL | N-(4-HYDROXYPHENYL)ACETAMIDE (TYLENOL) | B,C,D | 1TYM | 0.81 | |
| TYL | N-(4-HYDROXYPHENYL)ACETAMIDE (TYLENOL) | B,C,D | 1TYL | 0.81 | |
| TYL | N-(4-HYDROXYPHENYL)ACETAMIDE (TYLENOL) | A | 2OCU | 0.81 | |
| TYL | N-(4-HYDROXYPHENYL)ACETAMIDE (TYLENOL) | A,B,C,D,F | 3DJI | 0.81 | |
| TYL | N-(4-HYDROXYPHENYL)ACETAMIDE (TYLENOL) | A | 2DPZ | 0.81 | |
CSN | N,4-DIHYDROXY-N-OXO-3-(SULFOOXY)BENZENAMINIUM | P | 1E2S | 0.73 | |
| CSN | N,4-DIHYDROXY-N-OXO-3-(SULFOOXY)BENZENAMINIUM | A | 1PA9 | 0.73 | |
NPO | P-NITROPHENOL | A,B | 1Z44 | 0.75 | |
| NPO | P-NITROPHENOL | X | 2ZYW | 0.75 | |
| NPO | P-NITROPHENOL | H,L | 1YEK | 0.75 | |
| NPO | P-NITROPHENOL | A,C,E,G | 43CA | 0.75 | |
| NPO | P-NITROPHENOL | A | 1LS6 | 0.75 | |
| NPO | P-NITROPHENOL | X | 2ZVP | 0.75 | |
| NPO | P-NITROPHENOL | A,B | 2I10 | 0.75 | |
| NPO | P-NITROPHENOL | A | 1VAH | 0.75 | |
| NPO | P-NITROPHENOL | A,B | 3ETT | 0.75 | |
| NPO | P-NITROPHENOL | A,B | 2D20 | 0.75 | |
| NPO | P-NITROPHENOL | X | 2ZYV | 0.75 | |
44B | 1,1,1,3,3,3-HEXAFLUORO-2-{4-[(2,2,2- TRIFLUOROETHYL)AMINO]PHENYL}PROPAN- 2-OL | A,B,C,D | 1PQ9 | 0.71 | |
EDR | EDROPHONIUM ION | A | 1AX9 | 0.97 | |
| EDR | EDROPHONIUM ION | A | 2ACK | 0.97 | |
A48 | 4-[(DIMESITYLBORYL)(2,2,2-TRIFLUOROETHYL)AMINO]PHENOL | A,B | 2Q6J | 0.75 | |
4NC | 4-NITROCATECHOL | A | 1NO3 | 0.75 | |
| 4NC | 4-NITROCATECHOL | B | 2BUU | 0.75 | |
| 4NC | 4-NITROCATECHOL | B | 2BUZ | 0.75 | |
| 4NC | 4-NITROCATECHOL | B | 1EOC | 0.75 | |
NAF | M-(N,N,N-TRIMETHYLAMMONIO)-2,2,2- TRIFLUORO-1,1-DIHYDROXYETHYLBENZENE | A | 1AMN | 0.75 | |
| NAF | M-(N,N,N-TRIMETHYLAMMONIO)-2,2,2- TRIFLUORO-1,1-DIHYDROXYETHYLBENZENE | A,B | 2H9Y | 0.75 | |
FEN | N-(4-HYDROXYPHENYL)ALL-TRANS RETINAMIDE | A | 1FEL | 0.71 | |
SAF | 3-[(1S)-1-(DIMETHYLAMINO)ETHYL]PHENOL | A | 1GQR | 0.73 | |
| SAF | 3-[(1S)-1-(DIMETHYLAMINO)ETHYL]PHENOL | A | 1GQS | 0.73 | |
TCC | 2-(2,4-DICHLORO-PHENYLAMINO)-PHENOL | A,B | 1NHW | 0.71 | |
2AF | 2-AMINOPHENOL | A | 1L4N | 0.78 | |
2AC | 2-AMINO-P-CRESOL | H,I | 1A2C | 0.74 | |
| 2AC | 2-AMINO-P-CRESOL | A | 1L4M | 0.74 | |
4NL | 4-AMINOPHENOL | A | 2ORL | 0.79 | |
HPF | 1-[(2-HYDROXYLPHENYL)AMINO]3-GLYCEROLPHOSPHATE | A,B | 1TJP | 0.74 | |
ANX | 2,5-DINITROPHENOL | A,B,C,D,E,F, G,H | 2BFG | 0.75 | |
3GV | (3S)-1-(2-hydroxyphenyl)-5-oxopyrrolidine- 3-carboxylic acid | A,B | 3GVB | 0.73 | |