Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00006894
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 |
1MR![]() | N-METHYLANILINE | X | 2OTZ | 0.74 | ![]() |
4NC![]() | 4-NITROCATECHOL | A | 1NO3 | 0.72 | ![]() |
4NC![]() | 4-NITROCATECHOL | B | 2BUU | 0.72 | ![]() |
4NC![]() | 4-NITROCATECHOL | B | 2BUZ | 0.72 | ![]() |
4NC![]() | 4-NITROCATECHOL | B | 1EOC | 0.72 | ![]() |
A48![]() | 4-[(DIMESITYLBORYL)(2,2,2-TRIFLUOROETHYL)AMINO]PHENOL | A,B | 2Q6J | 0.77 | ![]() |
EDR![]() | EDROPHONIUM ION | A | 1AX9 | 0.84 | ![]() |
EDR![]() | EDROPHONIUM ION | A | 2ACK | 0.84 | ![]() |
3GV![]() | (3S)-1-(2-hydroxyphenyl)-5-oxopyrrolidine- 3-carboxylic acid | A,B | 3GVB | 0.71 | ![]() |
4NP![]() | 4-NITROPHENYL PHOSPHATE | A,B | 1D1Q | 0.71 | ![]() |
4NP![]() | 4-NITROPHENYL PHOSPHATE | A,B | 1VE7 | 0.71 | ![]() |
4NP![]() | 4-NITROPHENYL PHOSPHATE | A | 2I6P | 0.71 | ![]() |
2AF![]() | 2-AMINOPHENOL | A | 1L4N | 0.83 | ![]() |
NAF![]() | M-(N,N,N-TRIMETHYLAMMONIO)-2,2,2- TRIFLUORO-1,1-DIHYDROXYETHYLBENZENE | A | 1AMN | 0.74 | ![]() |
NAF![]() | M-(N,N,N-TRIMETHYLAMMONIO)-2,2,2- TRIFLUORO-1,1-DIHYDROXYETHYLBENZENE | A,B | 2H9Y | 0.74 | ![]() |
TYL![]() | N-(4-HYDROXYPHENYL)ACETAMIDE (TYLENOL) | B,C,D | 1TYM | 0.9 | ![]() |
TYL![]() | N-(4-HYDROXYPHENYL)ACETAMIDE (TYLENOL) | B,C,D | 1TYL | 0.9 | ![]() |
TYL![]() | N-(4-HYDROXYPHENYL)ACETAMIDE (TYLENOL) | A | 2OCU | 0.9 | ![]() |
TYL![]() | N-(4-HYDROXYPHENYL)ACETAMIDE (TYLENOL) | A,B,C,D,F | 3DJI | 0.9 | ![]() |
TYL![]() | N-(4-HYDROXYPHENYL)ACETAMIDE (TYLENOL) | A | 2DPZ | 0.9 | ![]() |
NYL![]() | N-ALLYL-ANILINE | A | 1OVK | 0.71 | ![]() |
2AC![]() | 2-AMINO-P-CRESOL | H,I | 1A2C | 0.79 | ![]() |
2AC![]() | 2-AMINO-P-CRESOL | A | 1L4M | 0.79 | ![]() |
PNP![]() | METHYL-PHOSPHONIC ACID MONO-(4- NITRO-PHENYL) ESTER | A,B,D,F | 1KNO | 0.72 | ![]() |
PNP![]() | METHYL-PHOSPHONIC ACID MONO-(4- NITRO-PHENYL) ESTER | A | 1ZED | 0.72 | ![]() |
OPB![]() | 4-BUTYL-1-(4-HYDROXYPHENYL)-2-PHENYLPYRAZOLIDINE- 3,5-DIONE | A | 1Q7A | 0.71 | ![]() |
OPB![]() | 4-BUTYL-1-(4-HYDROXYPHENYL)-2-PHENYLPYRAZOLIDINE- 3,5-DIONE | A,B | 2BXB | 0.71 | ![]() |
OPB![]() | 4-BUTYL-1-(4-HYDROXYPHENYL)-2-PHENYLPYRAZOLIDINE- 3,5-DIONE | A | 2BXO | 0.71 | ![]() |
N4E![]() | N-(4-ethoxyphenyl)acetamide | A,B,C,D | 3EBS | 0.77 | ![]() |
HPF![]() | 1-[(2-HYDROXYLPHENYL)AMINO]3-GLYCEROLPHOSPHATE | A,B | 1TJP | 0.78 | ![]() |
TCC![]() | 2-(2,4-DICHLORO-PHENYLAMINO)-PHENOL | A,B | 1NHW | 0.76 | ![]() |
DNF![]() | 2,4-DINITROPHENOL | A,B | 2B16 | 0.72 | ![]() |
DNF![]() | 2,4-DINITROPHENOL | H,J,L,N | 1OAU | 0.72 | ![]() |
DNF![]() | 2,4-DINITROPHENOL | A | 1GVO | 0.72 | ![]() |
DNF![]() | 2,4-DINITROPHENOL | A,B | 2B15 | 0.72 | ![]() |
DNF![]() | 2,4-DINITROPHENOL | A,B | 2B14 | 0.72 | ![]() |
AEG![]() | 4-[(2R)-2-aminopropyl]phenol | A | 3BUF | 0.7 | ![]() |
DMC![]() | 3-(4-DIETHYLAMINO-2-HYDROXY-PHENYL)- 2-METHYL-PROPIONIC ACID | G | 4GCH | 0.72 | ![]() |
4NS![]() | 4-nitrophenyl sulfate | X | 2ZYU | 0.72 | ![]() |
4NL![]() | 4-AMINOPHENOL | A | 2ORL | 0.88 | ![]() |
SAF![]() | 3-[(1S)-1-(DIMETHYLAMINO)ETHYL]PHENOL | A | 1GQR | 0.72 | ![]() |
SAF![]() | 3-[(1S)-1-(DIMETHYLAMINO)ETHYL]PHENOL | A | 1GQS | 0.72 | ![]() |
NPO![]() | P-NITROPHENOL | A,B | 1Z44 | 0.79 | ![]() |
NPO![]() | P-NITROPHENOL | X | 2ZYW | 0.79 | ![]() |
NPO![]() | P-NITROPHENOL | H,L | 1YEK | 0.79 | ![]() |
NPO![]() | P-NITROPHENOL | A,C,E,G | 43CA | 0.79 | ![]() |
NPO![]() | P-NITROPHENOL | A | 1LS6 | 0.79 | ![]() |
NPO![]() | P-NITROPHENOL | X | 2ZVP | 0.79 | ![]() |
NPO![]() | P-NITROPHENOL | A,B | 2I10 | 0.79 | ![]() |
NPO![]() | P-NITROPHENOL | A | 1VAH | 0.79 | ![]() |
NPO![]() | P-NITROPHENOL | A,B | 3ETT | 0.79 | ![]() |
NPO![]() | P-NITROPHENOL | A,B | 2D20 | 0.79 | ![]() |
NPO![]() | P-NITROPHENOL | X | 2ZYV | 0.79 | ![]() |
FEN![]() | N-(4-HYDROXYPHENYL)ALL-TRANS RETINAMIDE | A | 1FEL | 0.78 | ![]() |
44B![]() | 1,1,1,3,3,3-HEXAFLUORO-2-{4-[(2,2,2- TRIFLUOROETHYL)AMINO]PHENYL}PROPAN- 2-OL | A,B,C,D | 1PQ9 | 0.73 | ![]() |
SOA![]() | ISATOIC ANHYDRIDE | A | 1BIO | 0.7 | ![]() |