Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02672829
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 |
TYL![]() | N-(4-HYDROXYPHENYL)ACETAMIDE (TYLENOL) | B,C,D | 1TYM | 0.76 | ![]() |
TYL![]() | N-(4-HYDROXYPHENYL)ACETAMIDE (TYLENOL) | B,C,D | 1TYL | 0.76 | ![]() |
TYL![]() | N-(4-HYDROXYPHENYL)ACETAMIDE (TYLENOL) | A | 2OCU | 0.76 | ![]() |
TYL![]() | N-(4-HYDROXYPHENYL)ACETAMIDE (TYLENOL) | A,B,C,D,F | 3DJI | 0.76 | ![]() |
TYL![]() | N-(4-HYDROXYPHENYL)ACETAMIDE (TYLENOL) | A | 2DPZ | 0.76 | ![]() |
CSN![]() | N,4-DIHYDROXY-N-OXO-3-(SULFOOXY)BENZENAMINIUM | P | 1E2S | 0.75 | ![]() |
CSN![]() | N,4-DIHYDROXY-N-OXO-3-(SULFOOXY)BENZENAMINIUM | A | 1PA9 | 0.75 | ![]() |
4NC![]() | 4-NITROCATECHOL | A | 1NO3 | 0.77 | ![]() |
4NC![]() | 4-NITROCATECHOL | B | 2BUU | 0.77 | ![]() |
4NC![]() | 4-NITROCATECHOL | B | 2BUZ | 0.77 | ![]() |
4NC![]() | 4-NITROCATECHOL | B | 1EOC | 0.77 | ![]() |
ANX![]() | 2,5-DINITROPHENOL | A,B,C,D,E,F, G,H | 2BFG | 0.87 | ![]() |
4A3![]() | 4-AMINO-3-HYDROXYBENZOIC ACID | A,B | 2HDR | 0.72 | ![]() |
NPO![]() | P-NITROPHENOL | A,B | 1Z44 | 0.77 | ![]() |
NPO![]() | P-NITROPHENOL | X | 2ZYW | 0.77 | ![]() |
NPO![]() | P-NITROPHENOL | H,L | 1YEK | 0.77 | ![]() |
NPO![]() | P-NITROPHENOL | A,C,E,G | 43CA | 0.77 | ![]() |
NPO![]() | P-NITROPHENOL | A | 1LS6 | 0.77 | ![]() |
NPO![]() | P-NITROPHENOL | X | 2ZVP | 0.77 | ![]() |
NPO![]() | P-NITROPHENOL | A,B | 2I10 | 0.77 | ![]() |
NPO![]() | P-NITROPHENOL | A | 1VAH | 0.77 | ![]() |
NPO![]() | P-NITROPHENOL | A,B | 3ETT | 0.77 | ![]() |
NPO![]() | P-NITROPHENOL | A,B | 2D20 | 0.77 | ![]() |
NPO![]() | P-NITROPHENOL | X | 2ZYV | 0.77 | ![]() |
TCC![]() | 2-(2,4-DICHLORO-PHENYLAMINO)-PHENOL | A,B | 1NHW | 0.73 | ![]() |
TY2![]() | 3-AMINO-L-TYROSINE | A,B | 2VH3 | 0.74 | ![]() |
2AC![]() | 2-AMINO-P-CRESOL | H,I | 1A2C | 0.85 | ![]() |
2AC![]() | 2-AMINO-P-CRESOL | A | 1L4M | 0.85 | ![]() |
SOA![]() | ISATOIC ANHYDRIDE | A | 1BIO | 0.73 | ![]() |
AZY![]() | 3-AZIDO-L-TYROSINE | A | 2YXN | 0.73 | ![]() |
2AF![]() | 2-AMINOPHENOL | A | 1L4N | 0.92 | ![]() |
DNC![]() | 3,5-DINITROCATECHOL | A | 3BWY | 0.78 | ![]() |
DNC![]() | 3,5-DINITROCATECHOL | A | 3BWM | 0.78 | ![]() |
DNC![]() | 3,5-DINITROCATECHOL | A | 1VID | 0.78 | ![]() |
4NS![]() | 4-nitrophenyl sulfate | X | 2ZYU | 0.7 | ![]() |
NCR![]() | 2-NITRO-P-CRESOL | A,B | 1AHV | 0.75 | ![]() |
EDR![]() | EDROPHONIUM ION | A | 1AX9 | 0.79 | ![]() |
EDR![]() | EDROPHONIUM ION | A | 2ACK | 0.79 | ![]() |
4NL![]() | 4-AMINOPHENOL | A | 2ORL | 0.87 | ![]() |
NIM![]() | 4-NITRO-2-PHENOXYMETHANESULFONANILIDE | A | 1ZWP | 0.71 | ![]() |
NIM![]() | 4-NITRO-2-PHENOXYMETHANESULFONANILIDE | A | 3E9X | 0.71 | ![]() |
NIM![]() | 4-NITRO-2-PHENOXYMETHANESULFONANILIDE | A | 2OTH | 0.71 | ![]() |
DNF![]() | 2,4-DINITROPHENOL | A,B | 2B16 | 0.78 | ![]() |
DNF![]() | 2,4-DINITROPHENOL | H,J,L,N | 1OAU | 0.78 | ![]() |
DNF![]() | 2,4-DINITROPHENOL | A | 1GVO | 0.78 | ![]() |
DNF![]() | 2,4-DINITROPHENOL | A,B | 2B15 | 0.78 | ![]() |
DNF![]() | 2,4-DINITROPHENOL | A,B | 2B14 | 0.78 | ![]() |
TNF![]() | PICRIC ACID | A | 1GVS | 0.75 | ![]() |
TNF![]() | PICRIC ACID | X | 1VYP | 0.75 | ![]() |
TNF![]() | PICRIC ACID | A | 1VYR | 0.75 | ![]() |
TNF![]() | PICRIC ACID | X | 1VYS | 0.75 | ![]() |
HPF![]() | 1-[(2-HYDROXYLPHENYL)AMINO]3-GLYCEROLPHOSPHATE | A,B | 1TJP | 0.73 | ![]() |