Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02544209
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 |
EAA![]() | ETHACRYNIC ACID | A,B | 3DGQ | 0.8 | ![]() |
EAA![]() | ETHACRYNIC ACID | A,B | 11GS | 0.8 | ![]() |
EAA![]() | ETHACRYNIC ACID | A,B,C,D | 1GSF | 0.8 | ![]() |
EAA![]() | ETHACRYNIC ACID | A,B | 2GSS | 0.8 | ![]() |
EAA![]() | ETHACRYNIC ACID | A,B | 3GSS | 0.8 | ![]() |
EAA![]() | ETHACRYNIC ACID | A,B | 1GSE | 0.8 | ![]() |
FCD![]() | 5-(2-CHLOROPHENYL)FURAN-2-CARBOXYLIC ACID | A | 1XNZ | 0.85 | ![]() |
A18![]() | 5-(2-CHLOROBENZYL)-2-FUROIC ACID | A | 2Q96 | 0.87 | ![]() |
D1L![]() | 2-[4-(2,4-DICHLOROPHENOXY)PHENOXY]PROPANOIC ACID | A,B | 1UYR | 0.7 | ![]() |
ANN![]() | 4-METHOXYBENZOIC ACID | A | 2B96 | 0.75 | ![]() |
ANN![]() | 4-METHOXYBENZOIC ACID | A | 2QUE | 0.75 | ![]() |
ANN![]() | 4-METHOXYBENZOIC ACID | A | 1SV3 | 0.75 | ![]() |
ANN![]() | 4-METHOXYBENZOIC ACID | A | 1O2E | 0.75 | ![]() |
ANN![]() | 4-METHOXYBENZOIC ACID | A,B,C,D | 3CBI | 0.75 | ![]() |
CHB![]() | 3-CHLORO-4-HYDROXYBENZOIC ACID | M,N,O,P,Q,R | 3PCH | 0.71 | ![]() |
34C![]() | (3-CHLORO-4-PROPOXY-PHENYL)-ACETIC ACID | A,B | 1HT8 | 0.76 | ![]() |
FC3![]() | 5-[2-(TRIFLUOROMETHYL)PHENYL]-2- FUROIC ACID | A | 2EVC | 0.77 | ![]() |
C17![]() | 7-[(3-CHLOROBENZYL)OXY]-2-OXO-2H- CHROMENE-4-CARBALDEHYDE | A,B | 2V60 | 0.77 | ![]() |
FC2![]() | 5-(2,5-DICHLOROPHENYL)-2-FUROIC ACID | A | 2EVM | 0.85 | ![]() |
DBA![]() | (2,6-DIMETHYL-PHENOXY)-ACETIC ACID | A,B | 1IDB | 0.72 | ![]() |
B21![]() | 5-(2-METHOXYPHENYL)-2-FUROIC ACID | A | 2Q93 | 0.82 | ![]() |
DTC![]() | BISHYDROXY[2H-1-BENZOPYRAN-2-ONE,1,2- BENZOPYRONE] | A | 2Z9C | 0.71 | ![]() |
DTC![]() | BISHYDROXY[2H-1-BENZOPYRAN-2-ONE,1,2- BENZOPYRONE] | A,B | 1OOQ | 0.71 | ![]() |
DTC![]() | BISHYDROXY[2H-1-BENZOPYRAN-2-ONE,1,2- BENZOPYRONE] | A,B,C,D,E,F, G,H | 2F1O | 0.71 | ![]() |
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 | ![]() |
AI7![]() | 3-(heptyloxy)benzoic acid | A,B | 2O3Z | 0.73 | ![]() |
8MO![]() | METHOXSALEN | A,B,C,D | 1Z11 | 0.75 | ![]() |
AIN![]() | 2-(ACETYLOXY)BENZOIC ACID | A | 3GCL | 0.72 | ![]() |
AIN![]() | 2-(ACETYLOXY)BENZOIC ACID | A | 2QQT | 0.72 | ![]() |
AIN![]() | 2-(ACETYLOXY)BENZOIC ACID | A | 1TGM | 0.72 | ![]() |
AIN![]() | 2-(ACETYLOXY)BENZOIC ACID | A | 2G5J | 0.72 | ![]() |
AIN![]() | 2-(ACETYLOXY)BENZOIC ACID | A | 1OXR | 0.72 | ![]() |
AIN![]() | 2-(ACETYLOXY)BENZOIC ACID | A | 3HWY | 0.72 | ![]() |
A04![]() | 5-[2-(TRIFLUOROMETHOXY)PHENYL]- 2-FUROIC ACID | A | 2Q94 | 0.77 | ![]() |
BZF![]() | BENZOFURAN | A | 182L | 0.73 | ![]() |
FOA![]() | 2-FUROIC ACID | A,B | 2GF3 | 0.71 | ![]() |
FOA![]() | 2-FUROIC ACID | A,B,D | 2GAG | 0.71 | ![]() |
FOA![]() | 2-FUROIC ACID | A,B,C,D | 2GAH | 0.71 | ![]() |