Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs01731081
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 |
C1F | 3-CARBOXY-4-METHYL-5-PROPYL-2-FURANPROPIONIC | A,B | 2BXA | 0.84 |  |
FUX | 5-HYDROXYMETHYL-FURFURAL | A,B,C,D | 1QXE | 0.71 | |
AIN | 2-(ACETYLOXY)BENZOIC ACID | A | 3GCL | 0.82 | |
| AIN | 2-(ACETYLOXY)BENZOIC ACID | A | 2QQT | 0.82 | |
| AIN | 2-(ACETYLOXY)BENZOIC ACID | A | 1TGM | 0.82 | |
| AIN | 2-(ACETYLOXY)BENZOIC ACID | A | 2G5J | 0.82 | |
| AIN | 2-(ACETYLOXY)BENZOIC ACID | A | 1OXR | 0.82 | |
| AIN | 2-(ACETYLOXY)BENZOIC ACID | A | 3HWY | 0.82 | |
FOA | 2-FUROIC ACID | A,B | 2GF3 | 0.75 | |
| FOA | 2-FUROIC ACID | A,B,D | 2GAG | 0.75 | |
| FOA | 2-FUROIC ACID | A,B,C,D | 2GAH | 0.75 | |
SYR | SYRINGATE | A,B | 1WB5 | 0.71 | |
HMY | (1aR,8S,13S,14S,15aR)-5,13,14-trihydroxy- 3-methoxy-8-methyl-8,9,13,14,15,15a- hexahydro-6H-oxireno[k][2]benzoxacyclotetradecine- 6,12(1aH)-dione | A,B | 3C9W | 0.7 | |
ANN | 4-METHOXYBENZOIC ACID | A | 2B96 | 0.73 | |
| ANN | 4-METHOXYBENZOIC ACID | A | 2QUE | 0.73 | |
| ANN | 4-METHOXYBENZOIC ACID | A | 1SV3 | 0.73 | |
| ANN | 4-METHOXYBENZOIC ACID | A | 1O2E | 0.73 | |
| ANN | 4-METHOXYBENZOIC ACID | A,B,C,D | 3CBI | 0.73 | |
L41 | {4-[3-(4-acetyl-3-hydroxy-2-propylphenoxy)propoxy]phenoxy}acetic acid | A,B | 3D5F | 0.7 | |
AI7 | 3-(heptyloxy)benzoic acid | A,B | 2O3Z | 0.79 | |
B21 | 5-(2-METHOXYPHENYL)-2-FUROIC ACID | A | 2Q93 | 0.77 | |
HOM | 7-HYDROXY-4-METHYL-3-(2-HYDROXY- ETHYL)COUMARIN | C,D | 1CJF | 0.73 | |
4HC | 4-HYDROXY-2H-CHROMEN-2-ONE | A,B | 1V5Y | 0.7 | |
TOM | 4-(2-METHOXYPHENYL)-2-OXOBUT-3- ENOIC ACID | A | 2IMF | 0.71 | |
PSO | 4'-HYDROXYMETHYL-4,5',8-TRIMETHYLPSORALEN | A,B | 1FHY | 0.75 | |
| PSO | 4'-HYDROXYMETHYL-4,5',8-TRIMETHYLPSORALEN | B | 204D | 0.75 | |
| PSO | 4'-HYDROXYMETHYL-4,5',8-TRIMETHYLPSORALEN | A,B | 2B2B | 0.75 | |
| PSO | 4'-HYDROXYMETHYL-4,5',8-TRIMETHYLPSORALEN | B | 1FHZ | 0.75 | |
| PSO | 4'-HYDROXYMETHYL-4,5',8-TRIMETHYLPSORALEN | A | 203D | 0.75 | |
DBF | DIBENZOFURAN-4,6-DICARBOXYLIC ACID | B | 1DVU | 0.75 | |
FRR | (3R,5Z,8S,9S,11E)-8,9,16-TRIHYDROXY- 14-METHOXY-3-METHYL-3,4,9,10-TETRAHYDRO- 1H-2-BENZOXACYCLOTETRADECINE-1,7(8H)- DIONE | A | 2E14 | 0.71 | |
A04 | 5-[2-(TRIFLUOROMETHOXY)PHENYL]- 2-FUROIC ACID | A | 2Q94 | 0.73 | |
VII | 2,5-DIPHENYLFURAN-3,4-DICARBOXYLIC ACID | A,B | 2GFK | 0.82 | |
FU2 | FURFURAL | A,B,C,D | 1QXD | 0.7 | |
YZ9 | 7-HYDROXY-2-OXO-CHROMENE-3-CARBOXYLIC ACID ETHYL ESTER | A,B,C | 1GCZ | 0.74 | |
MOA | MYCOPHENOLIC ACID | A | 1ME7 | 0.71 | |
| MOA | MYCOPHENOLIC ACID | A,B | 1JR1 | 0.71 | |
| MOA | MYCOPHENOLIC ACID | A | 1MEI | 0.71 | |
| MOA | MYCOPHENOLIC ACID | A | 1MEH | 0.71 | |