Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00772434
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 |
TOM | 4-(2-METHOXYPHENYL)-2-OXOBUT-3- ENOIC ACID | A | 2IMF | 0.7 | |
FUX | 5-HYDROXYMETHYL-FURFURAL | A,B,C,D | 1QXE | 0.71 | |
694 | 4-BROMO-3-(CARBOXYMETHOXY)-5-(4- HYDROXYPHENYL)THIOPHENE-2-CARBOXYLIC ACID | A | 2H4G | 0.75 | |
FCD | 5-(2-CHLOROPHENYL)FURAN-2-CARBOXYLIC ACID | A | 1XNZ | 0.75 | |
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 | |
FL9 | A,B | 1THC | 0.72 | ||
509 | 4-BROMO-3-(CARBOXYMETHOXY)-5-PHENYLTHIOPHENE- 2-CARBOXYLIC ACID | A | 2H4K | 0.75 | |
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 | |
FC2 | 5-(2,5-DICHLOROPHENYL)-2-FUROIC ACID | A | 2EVM | 0.73 | |
FC3 | 5-[2-(TRIFLUOROMETHYL)PHENYL]-2- FUROIC ACID | A | 2EVC | 0.77 | |
B21 | 5-(2-METHOXYPHENYL)-2-FUROIC ACID | A | 2Q93 | 0.77 | |
DBA | (2,6-DIMETHYL-PHENOXY)-ACETIC ACID | A,B | 1IDB | 0.72 | |
U01 | 3-[1-(4-BROMO-PHENYL)-2-METHYL- PROPYL]-4-HYDROXY-CHROMEN-2-ONE | A | 1UPJ | 0.71 | |
A04 | 5-[2-(TRIFLUOROMETHOXY)PHENYL]- 2-FUROIC ACID | A | 2Q94 | 0.74 | |
8MO | METHOXSALEN | A,B,C,D | 1Z11 | 0.72 | |
AI7 | 3-(heptyloxy)benzoic acid | A,B | 2O3Z | 0.73 | |
A18 | 5-(2-CHLOROBENZYL)-2-FUROIC ACID | A | 2Q96 | 0.77 | |
R71 | [4-({6-[ALLYL(METHYL)AMINO]HEXYL}OXY)- 2-FLUOROPHENYL](4-BROMOPHENYL)METHANONE | A | 1W6J | 0.71 | |
R71 | [4-({6-[ALLYL(METHYL)AMINO]HEXYL}OXY)- 2-FLUOROPHENYL](4-BROMOPHENYL)METHANONE | A,B,C | 1GSZ | 0.71 | |
R88 | (4-BROMOPHENYL)[4-({(2E)-4-[CYCLOPROPYL(METHYL)AMINO]BUT- 2-ENYL}OXY)PHENYL]METHANONE | A,B,C | 1H36 | 0.72 | |
AIN | 2-(ACETYLOXY)BENZOIC ACID | A | 3GCL | 0.7 | |
AIN | 2-(ACETYLOXY)BENZOIC ACID | A | 2QQT | 0.7 | |
AIN | 2-(ACETYLOXY)BENZOIC ACID | A | 1TGM | 0.7 | |
AIN | 2-(ACETYLOXY)BENZOIC ACID | A | 2G5J | 0.7 | |
AIN | 2-(ACETYLOXY)BENZOIC ACID | A | 1OXR | 0.7 | |
AIN | 2-(ACETYLOXY)BENZOIC ACID | A | 3HWY | 0.7 | |
GRR | (2S)-2-(4-ethylphenoxy)-3-phenylpropanoic acid | A | 3CDS | 0.72 | |
BZF | BENZOFURAN | A | 182L | 0.74 | |
FU2 | FURFURAL | A,B,C,D | 1QXD | 0.72 |