Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00811599
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 |
NPC![]() | 4-HYDROXY-3-NITROPHENYLACETYL-EPSILON- AMINOCAPROIC ACID ANION | H,I,J | 1A6V | 0.78 | ![]() |
TYL![]() | N-(4-HYDROXYPHENYL)ACETAMIDE (TYLENOL) | B,C,D | 1TYM | 0.78 | ![]() |
TYL![]() | N-(4-HYDROXYPHENYL)ACETAMIDE (TYLENOL) | B,C,D | 1TYL | 0.78 | ![]() |
TYL![]() | N-(4-HYDROXYPHENYL)ACETAMIDE (TYLENOL) | A | 2OCU | 0.78 | ![]() |
TYL![]() | N-(4-HYDROXYPHENYL)ACETAMIDE (TYLENOL) | A,B,C,D,F | 3DJI | 0.78 | ![]() |
TYL![]() | N-(4-HYDROXYPHENYL)ACETAMIDE (TYLENOL) | A | 2DPZ | 0.78 | ![]() |
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 | ![]() |
PNF![]() | 6-{4-[HYDROXY-(4-NITRO-PHENOXY)- PHOSPHORYL]-BUTYRYLAMINO}-HEXANOIC ACID | L | 1YEJ | 0.77 | ![]() |
PGG![]() | PARA-NITROPHENYLPHOSPHONOBUTANOYL- GLYCINE | L | 1YEI | 0.77 | ![]() |
PNE![]() | PARA-NITROPHENYL PHOSPHONOBUTANOYL L- ALANINE | L | 1KN2 | 0.76 | ![]() |
PDE![]() | PARA-NITROPHENYL PHOSPHONOBUTANOYL D- ALANINE | L | 1KN4 | 0.76 | ![]() |
ST1![]() | 4-(ACETYLAMINO)-3-HYDROXY-5-NITROBENZOIC ACID | A,B | 1IVD | 0.76 | ![]() |
ST1![]() | 4-(ACETYLAMINO)-3-HYDROXY-5-NITROBENZOIC ACID | A | 1IVB | 0.76 | ![]() |
NIP![]() | 4-HYDROXY-5-IODO-3-NITROPHENYLACETYL- EPSILON-AMINOCAPROIC ACID ANION | H | 1A6W | 0.75 | ![]() |
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 | ![]() |
3GV![]() | (3S)-1-(2-hydroxyphenyl)-5-oxopyrrolidine- 3-carboxylic acid | A,B | 3GVB | 0.75 | ![]() |
NIY![]() | META-NITRO-TYROSINE | A | 2ADP | 0.74 | ![]() |
NIY![]() | META-NITRO-TYROSINE | A | 3DIV | 0.74 | ![]() |
NIY![]() | META-NITRO-TYROSINE | A | 2H5U | 0.74 | ![]() |
NIY![]() | META-NITRO-TYROSINE | A | 1K4Q | 0.74 | ![]() |
NIY![]() | META-NITRO-TYROSINE | B,G,O,Y | 1SDA | 0.74 | ![]() |
NPE![]() | 5-(PARA-NITROPHENYL PHOSPHONATE)- PENTANOIC ACID | H | 1GAF | 0.74 | ![]() |
NPE![]() | 5-(PARA-NITROPHENYL PHOSPHONATE)- PENTANOIC ACID | H | 1AJ7 | 0.74 | ![]() |
NPA![]() | 2-(4-HYDROXY-3-NITROPHENYL)ACETIC ACID | H | 1NGP | 0.73 | ![]() |
DNC![]() | 3,5-DINITROCATECHOL | A | 3BWY | 0.73 | ![]() |
DNC![]() | 3,5-DINITROCATECHOL | A | 3BWM | 0.73 | ![]() |
DNC![]() | 3,5-DINITROCATECHOL | A | 1VID | 0.73 | ![]() |
NPO![]() | P-NITROPHENOL | A,B | 1Z44 | 0.72 | ![]() |
NPO![]() | P-NITROPHENOL | X | 2ZYW | 0.72 | ![]() |
NPO![]() | P-NITROPHENOL | H,L | 1YEK | 0.72 | ![]() |
NPO![]() | P-NITROPHENOL | A,C,E,G | 43CA | 0.72 | ![]() |
NPO![]() | P-NITROPHENOL | A | 1LS6 | 0.72 | ![]() |
NPO![]() | P-NITROPHENOL | X | 2ZVP | 0.72 | ![]() |
NPO![]() | P-NITROPHENOL | A,B | 2I10 | 0.72 | ![]() |
NPO![]() | P-NITROPHENOL | A | 1VAH | 0.72 | ![]() |
NPO![]() | P-NITROPHENOL | A,B | 3ETT | 0.72 | ![]() |
NPO![]() | P-NITROPHENOL | A,B | 2D20 | 0.72 | ![]() |
NPO![]() | P-NITROPHENOL | X | 2ZYV | 0.72 | ![]() |
ANX![]() | 2,5-DINITROPHENOL | A,B,C,D,E,F, G,H | 2BFG | 0.72 | ![]() |
ST2![]() | 4-(ACETYLAMINO)-5-AMINO-3-HYDROXYBENZOIC ACID | A,B | 1IVC | 0.72 | ![]() |
EPY![]() | 1-HYDROXY-2-S-GLUTATHIONYL-3-PARA- NITROPHENOXY-PROPANE | A,B,C,D | 1C72 | 0.71 | ![]() |
4BQ![]() | (2S)-2-amino-5-oxo-5-[(4-phenylmethoxyphenyl)amino]pentanoic acid | A | 3CHQ | 0.71 | ![]() |
P28![]() | 3',5'-DINITRO-N-ACETYL-L-THYRONINE | A,B | 2ROY | 0.7 | ![]() |