Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00584558
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 |
BZM![]() | BENZOIC ACID PHENYLMETHYLESTER | A,B | 1DZM | 0.83 | ![]() |
1NH![]() | (2E,6E)-8-[(3-BENZOYLBENZYL)OXY]- 3,7-DIMETHYLOCTA-2,6-DIENYL TRIHYDROGEN DIPHOSPHATE | B | 1O1S | 0.82 | ![]() |
BM6![]() | 4-[2-(5,5,8,8-TETRAMETHYL-5,6,7,8- TETRAHYDRO-NAPHTHALEN-2-YL)-[1,3]DIOXOLAN- 2-YL]-BENZOIC ACID | A | 1MVC | 0.81 | ![]() |
BM6![]() | 4-[2-(5,5,8,8-TETRAMETHYL-5,6,7,8- TETRAHYDRO-NAPHTHALEN-2-YL)-[1,3]DIOXOLAN- 2-YL]-BENZOIC ACID | A,C,E,G | 1MZN | 0.81 | ![]() |
OST![]() | METHYL (2Z)-3-METHOXY-2-{2-[(E)- 2-PHENYLVINYL]PHENYL}ACRYLATE | C,D,E | 1SQQ | 0.79 | ![]() |
TTB![]() | 4-[(1E)-2-(5,5,8,8-TETRAMETHYL- 5,6,7,8-TETRAHYDRONAPHTHALEN-2- YL)PROP-1-ENYL]BENZOIC ACID | A | 1XAP | 0.78 | ![]() |
156![]() | 4-[3-OXO-3-(5,5,8,8-TETRAMETHYL- 5,6,7,8-TETRAHYDRO-NAPHTHALEN-2- YL)-PROPENYL]-BENZOIC ACID | A | 1FCZ | 0.77 | ![]() |
NDD![]() | 2,6-DICARBOXYNAPHTHALENE | A | 1U4O | 0.76 | ![]() |
NDD![]() | 2,6-DICARBOXYNAPHTHALENE | A,B,C,D | 1HAC | 0.76 | ![]() |
4FC![]() | A | 1YSG | 0.76 | ![]() | |
184![]() | 6-[HYDROXY-(5,5,8,8-TETRAMETHYL- 5,6,7,8-TETRAHYDRO-NAPHTALEN-2- YL)-METHYL]-NAPHTALENE-2-CARBOXYLIC ACID | A | 1FCX | 0.75 | ![]() |
26C![]() | A,B | 2F7I | 0.75 | ![]() | |
FBC![]() | A,B | 2B9A | 0.75 | ![]() | |
FL2![]() | FLURBIPROFEN METHYL ESTER | A,B | 1HT5 | 0.74 | ![]() |
564![]() | 6-(5,5,8,8-TETRAMETHYL-5,6,7,8- TETRAHYDRO-NAPHTALENE-2-CARBONYL)- NAPHTALENE-2-CARBOXYLIC ACID | A | 1FCY | 0.74 | ![]() |
4MA![]() | 4-METHYLBENZOIC ACID | A,H | 2HRG | 0.73 | ![]() |
PMA![]() | PYROMELLITIC ACID | A,B | 1FUP | 0.72 | ![]() |
DIC![]() | 3,4-DICHLOROISOCOUMARIN | A | 1DIC | 0.72 | ![]() |
OSB![]() | 2-SUCCINYLBENZOATE | A | 1FHV | 0.72 | ![]() |
OSB![]() | 2-SUCCINYLBENZOATE | A,B,C,D | 1SJB | 0.72 | ![]() |
OSB![]() | 2-SUCCINYLBENZOATE | A,B | 2QVH | 0.72 | ![]() |
CIN![]() | 4-CARBOXYCINNAMIC ACID | A,B,C,D | 1HAB | 0.72 | ![]() |
CIN![]() | 4-CARBOXYCINNAMIC ACID | A,B | 1T6J | 0.72 | ![]() |
BP4![]() | BIPHENYL-4-YL-ACETALDEHYDE | A,B,E,F,G,H | 1MHW | 0.71 | ![]() |
BFL![]() | A,B | 1Q4G | 0.71 | ![]() | |
NPS![]() | (2S)-2-(6-methoxynaphthalen-2-yl)propanoic acid | A | 2VDB | 0.71 | ![]() |
BHF![]() | 2-PHENYL-4H-BENZO[H]CHROMEN-4-ONE | A | 2HI4 | 0.71 | ![]() |
TMM![]() | 1,3,5-BENZENETRICARBOXYLIC ACID | A,B,C,D | 1SDL | 0.71 | ![]() |
TMM![]() | 1,3,5-BENZENETRICARBOXYLIC ACID | A,B,C,D | 1SDK | 0.71 | ![]() |
PHQ![]() | FORMIC ACID BENZYL ESTER | A,I | 2F4O | 0.7 | ![]() |
PHQ![]() | FORMIC ACID BENZYL ESTER | A | 1KJO | 0.7 | ![]() |
PHQ![]() | FORMIC ACID BENZYL ESTER | I | 2CDR | 0.7 | ![]() |
PHQ![]() | FORMIC ACID BENZYL ESTER | I | 2C1E | 0.7 | ![]() |
PHQ![]() | FORMIC ACID BENZYL ESTER | I | 5PAD | 0.7 | ![]() |
PHQ![]() | FORMIC ACID BENZYL ESTER | E,F | 1JXQ | 0.7 | ![]() |
PHQ![]() | FORMIC ACID BENZYL ESTER | A | 2CNO | 0.7 | ![]() |
PHQ![]() | FORMIC ACID BENZYL ESTER | A,B | 1CGL | 0.7 | ![]() |
PHQ![]() | FORMIC ACID BENZYL ESTER | I | 2AZ9 | 0.7 | ![]() |
PHQ![]() | FORMIC ACID BENZYL ESTER | I | 2C2K | 0.7 | ![]() |
PHQ![]() | FORMIC ACID BENZYL ESTER | A,I | 2CNL | 0.7 | ![]() |
PHQ![]() | FORMIC ACID BENZYL ESTER | A | 1KJP | 0.7 | ![]() |
PHQ![]() | FORMIC ACID BENZYL ESTER | I | 2C2M | 0.7 | ![]() |
PHQ![]() | FORMIC ACID BENZYL ESTER | I | 2AZB | 0.7 | ![]() |
PHQ![]() | FORMIC ACID BENZYL ESTER | A | 9HVP | 0.7 | ![]() |
PHQ![]() | FORMIC ACID BENZYL ESTER | A | 1ESB | 0.7 | ![]() |
PHQ![]() | FORMIC ACID BENZYL ESTER | E,F | 1DY8 | 0.7 | ![]() |
PHQ![]() | FORMIC ACID BENZYL ESTER | E,I | 1PPM | 0.7 | ![]() |
PHQ![]() | FORMIC ACID BENZYL ESTER | I | 1GEC | 0.7 | ![]() |
PHQ![]() | FORMIC ACID BENZYL ESTER | A | 1KS7 | 0.7 | ![]() |
PHQ![]() | FORMIC ACID BENZYL ESTER | C | 1A8G | 0.7 | ![]() |
PHQ![]() | FORMIC ACID BENZYL ESTER | A | 1KKK | 0.7 | ![]() |
PHQ![]() | FORMIC ACID BENZYL ESTER | T,U,V,W,X,Y | 1QDU | 0.7 | ![]() |
PHQ![]() | FORMIC ACID BENZYL ESTER | E,I | 4TMN | 0.7 | ![]() |
PHQ![]() | FORMIC ACID BENZYL ESTER | E,I | 5TMN | 0.7 | ![]() |
PHQ![]() | FORMIC ACID BENZYL ESTER | A | 1KTO | 0.7 | ![]() |
PHQ![]() | FORMIC ACID BENZYL ESTER | A,C | 1TG1 | 0.7 | ![]() |
PHQ![]() | FORMIC ACID BENZYL ESTER | I | 2AZ8 | 0.7 | ![]() |
PHQ![]() | FORMIC ACID BENZYL ESTER | A,B | 2G58 | 0.7 | ![]() |
PHQ![]() | FORMIC ACID BENZYL ESTER | Q,R,S,T,U,V | 1F9E | 0.7 | ![]() |
PHQ![]() | FORMIC ACID BENZYL ESTER | I | 2CJY | 0.7 | ![]() |
PHQ![]() | FORMIC ACID BENZYL ESTER | A,I | 1E8M | 0.7 | ![]() |
PHQ![]() | FORMIC ACID BENZYL ESTER | A | 1KR6 | 0.7 | ![]() |
PHQ![]() | FORMIC ACID BENZYL ESTER | E,I | 6TMN | 0.7 | ![]() |
PHQ![]() | FORMIC ACID BENZYL ESTER | A | 1KRO | 0.7 | ![]() |
PHQ![]() | FORMIC ACID BENZYL ESTER | I | 2CNN | 0.7 | ![]() |
PHQ![]() | FORMIC ACID BENZYL ESTER | I | 2C2O | 0.7 | ![]() |
PHQ![]() | FORMIC ACID BENZYL ESTER | A,B | 1SQZ | 0.7 | ![]() |
PHQ![]() | FORMIC ACID BENZYL ESTER | A,B | 1THE | 0.7 | ![]() |
PHQ![]() | FORMIC ACID BENZYL ESTER | I,J | 2AZC | 0.7 | ![]() |
PHQ![]() | FORMIC ACID BENZYL ESTER | E,I | 5EST | 0.7 | ![]() |
PHQ![]() | FORMIC ACID BENZYL ESTER | I | 2CNK | 0.7 | ![]() |
PHQ![]() | FORMIC ACID BENZYL ESTER | A | 1KL6 | 0.7 | ![]() |
PHQ![]() | FORMIC ACID BENZYL ESTER | I | 6PAD | 0.7 | ![]() |
PHQ![]() | FORMIC ACID BENZYL ESTER | B,I | 2C2Z | 0.7 | ![]() |
UIN![]() | 5,6,7,8,9,10-HEXAHYDRO-4-HYDROXY- 3-(1-PHENYLPROPYL)CYCLOOCTA[B]PYRAN- 2-ONE | B | 5UPJ | 0.7 | ![]() |
NIU![]() | 6,7,8,9-TETRAHYDRO-4-HYDROXY-3- (1-PHENYLPROPYL)CYCLOHEPTA[B]PYRAN- 2-ONE | A | 6UPJ | 0.7 | ![]() |
DBE![]() | bis(4-hydroxyphenyl)methanone | A | 2VKU | 0.7 | ![]() |
NLA![]() | NAPHTHALEN-1-YL-ACETIC ACID | A,B,C,D | 1LRH | 0.7 | ![]() |
NLA![]() | NAPHTHALEN-1-YL-ACETIC ACID | B | 2P1O | 0.7 | ![]() |
PIC![]() | 6-(DIFLUORO-PHOSPHONO-METHYL)-NAPHTHALENE- 2-CARBOXYLIC ACID | A | 1BZJ | 0.7 | ![]() |