Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00778168
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 |
A18 | 5-(2-CHLOROBENZYL)-2-FUROIC ACID | A | 2Q96 | 0.79 |  |
VXX | VANILLATE | A,B | 1WB6 | 0.7 | |
C17 | 7-[(3-CHLOROBENZYL)OXY]-2-OXO-2H- CHROMENE-4-CARBALDEHYDE | A,B | 2V60 | 0.73 | |
C2U | 3,5-dichloro-2-hydroxybenzoic acid | A | 3C3U | 0.73 | |
| C2U | 3,5-dichloro-2-hydroxybenzoic acid | A | 3CV7 | 0.73 | |
DBA | (2,6-DIMETHYL-PHENOXY)-ACETIC ACID | A,B | 1IDB | 0.71 | |
34C | (3-CHLORO-4-PROPOXY-PHENYL)-ACETIC ACID | A,B | 1HT8 | 0.82 | |
EAA | ETHACRYNIC ACID | A,B | 3DGQ | 0.88 | |
| EAA | ETHACRYNIC ACID | A,B | 11GS | 0.88 | |
| EAA | ETHACRYNIC ACID | A,B,C,D | 1GSF | 0.88 | |
| EAA | ETHACRYNIC ACID | A,B | 2GSS | 0.88 | |
| EAA | ETHACRYNIC ACID | A,B | 3GSS | 0.88 | |
| EAA | ETHACRYNIC ACID | A,B | 1GSE | 0.88 | |
FCD | 5-(2-CHLOROPHENYL)FURAN-2-CARBOXYLIC ACID | A | 1XNZ | 0.78 | |
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 | |
D1L | 2-[4-(2,4-DICHLOROPHENOXY)PHENOXY]PROPANOIC ACID | A,B | 1UYR | 0.75 | |
FC3 | 5-[2-(TRIFLUOROMETHYL)PHENYL]-2- FUROIC ACID | A | 2EVC | 0.7 | |
YRG | (2S)-2-(4-chlorophenoxy)-3-phenylpropanoic acid | A | 3CDP | 0.79 | |
IH5 | [4-(4-HYDROXY-3-ISOPROPYLPHENOXY)- 3,5-DIMETHYLPHENYL]ACETIC ACID | A | 1NAV | 0.74 | |
| IH5 | [4-(4-HYDROXY-3-ISOPROPYLPHENOXY)- 3,5-DIMETHYLPHENYL]ACETIC ACID | A | 1NAX | 0.74 | |
V55 | 4-hydroxy-3-methoxybenzaldehyde | B,D,E,F | 2VSS | 0.72 | |
| V55 | 4-hydroxy-3-methoxybenzaldehyde | A,B,D,E,F | 2VSU | 0.72 | |
CFA | (2,4-DICHLOROPHENOXY)ACETIC ACID | B,E | 2P1N | 0.79 | |
L1O | 4-(2-aminoethoxy)-3,5-dichlorobenzoic acid | A | 2VIO | 0.82 | |
FC2 | 5-(2,5-DICHLOROPHENYL)-2-FUROIC ACID | A | 2EVM | 0.79 | |
3C4 | (3-CHLORO-4-HYDROXYPHENYL)ACETIC ACID | A,B,C,D | 3E5U | 0.71 | |
| 3C4 | (3-CHLORO-4-HYDROXYPHENYL)ACETIC ACID | A,B | 3E6B | 0.71 | |
| 3C4 | (3-CHLORO-4-HYDROXYPHENYL)ACETIC ACID | A,B,C,D | 3E5X | 0.71 | |
| 3C4 | (3-CHLORO-4-HYDROXYPHENYL)ACETIC ACID | A,B | 2H6B | 0.71 | |
| 3C4 | (3-CHLORO-4-HYDROXYPHENYL)ACETIC ACID | C | 3E6C | 0.71 | |
AI7 | 3-(heptyloxy)benzoic acid | A,B | 2O3Z | 0.72 | |
VNL | 4-HYDROXY-3-METHOXYBENZOATE | A,B,C,D | 2AHC | 0.71 | |
| VNL | 4-HYDROXY-3-METHOXYBENZOATE | A | 1XLR | 0.71 | |
B21 | 5-(2-METHOXYPHENYL)-2-FUROIC ACID | A | 2Q93 | 0.71 | |
GRR | (2S)-2-(4-ethylphenoxy)-3-phenylpropanoic acid | A | 3CDS | 0.72 | |
CHB | 3-CHLORO-4-HYDROXYBENZOIC ACID | M,N,O,P,Q,R | 3PCH | 0.75 | |