Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs01397225
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 |
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 | 0.72 |  |
8MO | METHOXSALEN | A,B,C,D | 1Z11 | 0.76 | |
FC3 | 5-[2-(TRIFLUOROMETHYL)PHENYL]-2- FUROIC ACID | A | 2EVC | 0.73 | |
SYR | SYRINGATE | A,B | 1WB5 | 0.71 | |
KMP | 3,5,7-TRIHYDROXY-2-(4-HYDROXYPHENYL)- 4H-CHROMEN-4-ONE | A,B,C,D | 1H1M | 0.71 | |
| KMP | 3,5,7-TRIHYDROXY-2-(4-HYDROXYPHENYL)- 4H-CHROMEN-4-ONE | A | 2C1Z | 0.71 | |
ANN | 4-METHOXYBENZOIC ACID | A | 2B96 | 0.72 | |
| ANN | 4-METHOXYBENZOIC ACID | A | 2QUE | 0.72 | |
| ANN | 4-METHOXYBENZOIC ACID | A | 1SV3 | 0.72 | |
| ANN | 4-METHOXYBENZOIC ACID | A | 1O2E | 0.72 | |
| ANN | 4-METHOXYBENZOIC ACID | A,B,C,D | 3CBI | 0.72 | |
YRG | (2S)-2-(4-chlorophenoxy)-3-phenylpropanoic acid | A | 3CDP | 0.76 | |
A18 | 5-(2-CHLOROBENZYL)-2-FUROIC ACID | A | 2Q96 | 0.83 | |
VII | 2,5-DIPHENYLFURAN-3,4-DICARBOXYLIC ACID | A,B | 2GFK | 0.77 | |
AIN | 2-(ACETYLOXY)BENZOIC ACID | A | 3GCL | 0.74 | |
| AIN | 2-(ACETYLOXY)BENZOIC ACID | A | 2QQT | 0.74 | |
| AIN | 2-(ACETYLOXY)BENZOIC ACID | A | 1TGM | 0.74 | |
| AIN | 2-(ACETYLOXY)BENZOIC ACID | A | 2G5J | 0.74 | |
| AIN | 2-(ACETYLOXY)BENZOIC ACID | A | 1OXR | 0.74 | |
| AIN | 2-(ACETYLOXY)BENZOIC ACID | A | 3HWY | 0.74 | |
EAA | ETHACRYNIC ACID | A,B | 3DGQ | 0.75 | |
| EAA | ETHACRYNIC ACID | A,B | 11GS | 0.75 | |
| EAA | ETHACRYNIC ACID | A,B,C,D | 1GSF | 0.75 | |
| EAA | ETHACRYNIC ACID | A,B | 2GSS | 0.75 | |
| EAA | ETHACRYNIC ACID | A,B | 3GSS | 0.75 | |
| EAA | ETHACRYNIC ACID | A,B | 1GSE | 0.75 | |
VXX | VANILLATE | A,B | 1WB6 | 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 | 0.71 | |
FC2 | 5-(2,5-DICHLOROPHENYL)-2-FUROIC ACID | A | 2EVM | 0.8 | |
FCD | 5-(2-CHLOROPHENYL)FURAN-2-CARBOXYLIC ACID | A | 1XNZ | 0.81 | |
L41 | {4-[3-(4-acetyl-3-hydroxy-2-propylphenoxy)propoxy]phenoxy}acetic acid | A,B | 3D5F | 0.76 | |
AI7 | 3-(heptyloxy)benzoic acid | A,B | 2O3Z | 0.72 | |
MOF | MOMETASONE FUROATE | A,B | 1SR7 | 0.7 | |
KWT | (1S,6BR,9AS,11R,11BR)-9A,11B-DIMETHYL- 1-[(METHYLOXY)METHYL]-3,6,9-TRIOXO- 1,6,6B,7,8,9,9A,10,11,11B-DECAHYDRO- 3H-FURO[4,3,2-DE]INDENO[4,5-H][2]BENZOPYRAN- 11-YL ACETATE | A | 3D5X | 0.72 | |
| KWT | (1S,6BR,9AS,11R,11BR)-9A,11B-DIMETHYL- 1-[(METHYLOXY)METHYL]-3,6,9-TRIOXO- 1,6,6B,7,8,9,9A,10,11,11B-DECAHYDRO- 3H-FURO[4,3,2-DE]INDENO[4,5-H][2]BENZOPYRAN- 11-YL ACETATE | A | 1E7U | 0.72 | |
A04 | 5-[2-(TRIFLUOROMETHOXY)PHENYL]- 2-FUROIC ACID | A | 2Q94 | 0.77 | |
DBF | DIBENZOFURAN-4,6-DICARBOXYLIC ACID | B | 1DVU | 0.7 | |
PSO | 4'-HYDROXYMETHYL-4,5',8-TRIMETHYLPSORALEN | A,B | 1FHY | 0.72 | |
| PSO | 4'-HYDROXYMETHYL-4,5',8-TRIMETHYLPSORALEN | B | 204D | 0.72 | |
| PSO | 4'-HYDROXYMETHYL-4,5',8-TRIMETHYLPSORALEN | A,B | 2B2B | 0.72 | |
| PSO | 4'-HYDROXYMETHYL-4,5',8-TRIMETHYLPSORALEN | B | 1FHZ | 0.72 | |
| PSO | 4'-HYDROXYMETHYL-4,5',8-TRIMETHYLPSORALEN | A | 203D | 0.72 | |
C17 | 7-[(3-CHLOROBENZYL)OXY]-2-OXO-2H- CHROMENE-4-CARBALDEHYDE | A,B | 2V60 | 0.76 | |
B21 | 5-(2-METHOXYPHENYL)-2-FUROIC ACID | A | 2Q93 | 0.81 | |
34C | (3-CHLORO-4-PROPOXY-PHENYL)-ACETIC ACID | A,B | 1HT8 | 0.72 | |
C1F | 3-CARBOXY-4-METHYL-5-PROPYL-2-FURANPROPIONIC | A,B | 2BXA | 0.71 | |