Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03216113
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 | ![]() |
4NL![]() | 4-AMINOPHENOL | A | 2ORL | 0.74 | ![]() |
LI6![]() | 3,4-DIHYDROXY-1-METHYLQUINOLIN- 2(1H)-ONE | A | 1YXV | 0.75 | ![]() |
NPA![]() | 2-(4-HYDROXY-3-NITROPHENYL)ACETIC ACID | H | 1NGP | 0.72 | ![]() |
TY2![]() | 3-AMINO-L-TYROSINE | A,B | 2VH3 | 0.77 | ![]() |
3GV![]() | (3S)-1-(2-hydroxyphenyl)-5-oxopyrrolidine- 3-carboxylic acid | A,B | 3GVB | 0.76 | ![]() |
790![]() | 1,2,3,4-TETRAHYDROQUINOLIN-8-YL DIHYDROGEN PHOSPHATE | A | 1O4F | 0.73 | ![]() |
2AC![]() | 2-AMINO-P-CRESOL | H,I | 1A2C | 0.88 | ![]() |
2AC![]() | 2-AMINO-P-CRESOL | A | 1L4M | 0.88 | ![]() |
NIY![]() | META-NITRO-TYROSINE | A | 2ADP | 0.72 | ![]() |
NIY![]() | META-NITRO-TYROSINE | A | 3DIV | 0.72 | ![]() |
NIY![]() | META-NITRO-TYROSINE | A | 2H5U | 0.72 | ![]() |
NIY![]() | META-NITRO-TYROSINE | A | 1K4Q | 0.72 | ![]() |
NIY![]() | META-NITRO-TYROSINE | B,G,O,Y | 1SDA | 0.72 | ![]() |
DMC![]() | 3-(4-DIETHYLAMINO-2-HYDROXY-PHENYL)- 2-METHYL-PROPIONIC ACID | G | 4GCH | 0.79 | ![]() |
NCR![]() | 2-NITRO-P-CRESOL | A,B | 1AHV | 0.82 | ![]() |
NPC![]() | 4-HYDROXY-3-NITROPHENYLACETYL-EPSILON- AMINOCAPROIC ACID ANION | H,I,J | 1A6V | 0.7 | ![]() |
NPO![]() | P-NITROPHENOL | A,B | 1Z44 | 0.7 | ![]() |
NPO![]() | P-NITROPHENOL | X | 2ZYW | 0.7 | ![]() |
NPO![]() | P-NITROPHENOL | H,L | 1YEK | 0.7 | ![]() |
NPO![]() | P-NITROPHENOL | A,C,E,G | 43CA | 0.7 | ![]() |
NPO![]() | P-NITROPHENOL | A | 1LS6 | 0.7 | ![]() |
NPO![]() | P-NITROPHENOL | X | 2ZVP | 0.7 | ![]() |
NPO![]() | P-NITROPHENOL | A,B | 2I10 | 0.7 | ![]() |
NPO![]() | P-NITROPHENOL | A | 1VAH | 0.7 | ![]() |
NPO![]() | P-NITROPHENOL | A,B | 3ETT | 0.7 | ![]() |
NPO![]() | P-NITROPHENOL | A,B | 2D20 | 0.7 | ![]() |
NPO![]() | P-NITROPHENOL | X | 2ZYV | 0.7 | ![]() |
TCC![]() | 2-(2,4-DICHLORO-PHENYLAMINO)-PHENOL | A,B | 1NHW | 0.74 | ![]() |
AEF![]() | 4-(2-aminoethyl)phenol | A | 3BRA | 0.71 | ![]() |
AZY![]() | 3-AZIDO-L-TYROSINE | A | 2YXN | 0.76 | ![]() |
XP1![]() | 4-(DIMETHYLAMINO)BENZOIC ACID | A,B | 2VJ1 | 0.71 | ![]() |
XP1![]() | 4-(DIMETHYLAMINO)BENZOIC ACID | A | 2V6N | 0.71 | ![]() |
C00![]() | 2-(4-hydroxybiphenyl-3-yl)-4-methyl- 1H-isoindole-1,3(2H)-dione | A | 3BYX | 0.72 | ![]() |
C00![]() | 2-(4-hydroxybiphenyl-3-yl)-4-methyl- 1H-isoindole-1,3(2H)-dione | A | 3BZ0 | 0.72 | ![]() |
FEN![]() | N-(4-HYDROXYPHENYL)ALL-TRANS RETINAMIDE | A | 1FEL | 0.74 | ![]() |
44B![]() | 1,1,1,3,3,3-HEXAFLUORO-2-{4-[(2,2,2- TRIFLUOROETHYL)AMINO]PHENYL}PROPAN- 2-OL | A,B,C,D | 1PQ9 | 0.72 | ![]() |
2AF![]() | 2-AMINOPHENOL | A | 1L4N | 0.78 | ![]() |
NAF![]() | M-(N,N,N-TRIMETHYLAMMONIO)-2,2,2- TRIFLUORO-1,1-DIHYDROXYETHYLBENZENE | A | 1AMN | 0.81 | ![]() |
NAF![]() | M-(N,N,N-TRIMETHYLAMMONIO)-2,2,2- TRIFLUORO-1,1-DIHYDROXYETHYLBENZENE | A,B | 2H9Y | 0.81 | ![]() |
A48![]() | 4-[(DIMESITYLBORYL)(2,2,2-TRIFLUOROETHYL)AMINO]PHENOL | A,B | 2Q6J | 0.8 | ![]() |
CZM![]() | 'N,N'-BIS-(2-HYDROXY-3-METHYL-BENZYLIDENE)- BENZENE-1,2-DIAMINE' | A | 1J3F | 0.71 | ![]() |
CZM![]() | 'N,N'-BIS-(2-HYDROXY-3-METHYL-BENZYLIDENE)- BENZENE-1,2-DIAMINE' | A | 1UFJ | 0.71 | ![]() |
CZM![]() | 'N,N'-BIS-(2-HYDROXY-3-METHYL-BENZYLIDENE)- BENZENE-1,2-DIAMINE' | A | 1V9Q | 0.71 | ![]() |
DNT![]() | 2-[1-METHYLHEXYL]-4,6-DINITROPHENOL | A,B,C | 1NEN | 0.73 | ![]() |
EDR![]() | EDROPHONIUM ION | A | 1AX9 | 0.81 | ![]() |
EDR![]() | EDROPHONIUM ION | A | 2ACK | 0.81 | ![]() |
HPF![]() | 1-[(2-HYDROXYLPHENYL)AMINO]3-GLYCEROLPHOSPHATE | A,B | 1TJP | 0.74 | ![]() |
SAF![]() | 3-[(1S)-1-(DIMETHYLAMINO)ETHYL]PHENOL | A | 1GQR | 0.78 | ![]() |
SAF![]() | 3-[(1S)-1-(DIMETHYLAMINO)ETHYL]PHENOL | A | 1GQS | 0.78 | ![]() |
MA0![]() | (1R)-6-HYDROXY-N-METHYL-N-[(1Z)- PROP-2-EN-1-YLIDENE]INDAN-1-AMINIUM | A,B | 2C64 | 0.71 | ![]() |
AEJ![]() | (1S)-1-{4-[(9AR)-OCTAHYDRO-2H-PYRIDO[1,2- A]PYRAZIN-2-YL]PHENYL}-2-PHENYL- 1,2,3,4-TETRAHYDROISOQUINOLIN-6- OL | A,B,C,D | 1XQC | 0.71 | ![]() |
DNF![]() | 2,4-DINITROPHENOL | A,B | 2B16 | 0.7 | ![]() |
DNF![]() | 2,4-DINITROPHENOL | H,J,L,N | 1OAU | 0.7 | ![]() |
DNF![]() | 2,4-DINITROPHENOL | A | 1GVO | 0.7 | ![]() |
DNF![]() | 2,4-DINITROPHENOL | A,B | 2B15 | 0.7 | ![]() |
DNF![]() | 2,4-DINITROPHENOL | A,B | 2B14 | 0.7 | ![]() |
AEG![]() | 4-[(2R)-2-aminopropyl]phenol | A | 3BUF | 0.72 | ![]() |
SOA![]() | ISATOIC ANHYDRIDE | A | 1BIO | 0.7 | ![]() |