Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03783062
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 |
4FE | (2E)-3-(3-hydroxy-4-methoxyphenyl)prop- 2-enoic acid | A | 3CBG | 0.79 |  |
DHC | CAFFEIC ACID | A,B,C,D,E,F, G,H | 2O7D | 0.79 | |
| DHC | CAFFEIC ACID | A | 1KOU | 0.79 | |
DHB | 3,4-DIHYDROXYBENZOIC ACID | B | 2BV0 | 0.78 | |
| DHB | 3,4-DIHYDROXYBENZOIC ACID | A,B,D,F,H,J,L | 1YKP | 0.78 | |
| DHB | 3,4-DIHYDROXYBENZOIC ACID | A | 1N8Q | 0.78 | |
| DHB | 3,4-DIHYDROXYBENZOIC ACID | A,B | 2BSL | 0.78 | |
| DHB | 3,4-DIHYDROXYBENZOIC ACID | B,D,F,H,J,L | 1YKL | 0.78 | |
| DHB | 3,4-DIHYDROXYBENZOIC ACID | B,D | 1B4U | 0.78 | |
| DHB | 3,4-DIHYDROXYBENZOIC ACID | A | 3DX5 | 0.78 | |
| DHB | 3,4-DIHYDROXYBENZOIC ACID | M,N,O,P,Q,R | 3PCA | 0.78 | |
| DHB | 3,4-DIHYDROXYBENZOIC ACID | B,D,F,H,J,L | 1YKN | 0.78 | |
| DHB | 3,4-DIHYDROXYBENZOIC ACID | B | 1EOB | 0.78 | |
| DHB | 3,4-DIHYDROXYBENZOIC ACID | A | 1PHH | 0.78 | |
| DHB | 3,4-DIHYDROXYBENZOIC ACID | B | 2BUV | 0.78 | |
DBH | 2,3-DIHYDROXY-BENZOIC ACID | A,B,C | 3CMP | 0.78 | |
| DBH | 2,3-DIHYDROXY-BENZOIC ACID | A | 1MD9 | 0.78 | |
| DBH | 2,3-DIHYDROXY-BENZOIC ACID | A | 1MDB | 0.78 | |
| DBH | 2,3-DIHYDROXY-BENZOIC ACID | A,B,C | 1L6M | 0.78 | |
| DBH | 2,3-DIHYDROXY-BENZOIC ACID | A,B,C | 3BY0 | 0.78 | |
EMF | ethyl (1S,2S)-2-(4-hydroxy-3-methoxyphenyl)cyclopropanecarboxylate | A,B | 2QZZ | 0.76 | |
| EMF | ethyl (1S,2S)-2-(4-hydroxy-3-methoxyphenyl)cyclopropanecarboxylate | A,B | 2R2G | 0.76 | |
DHY | 2-(3,4-DIHYDROXYPHENYL)ACETIC ACID | M,N,O,P,Q,R | 3PCN | 0.76 | |
| DHY | 2-(3,4-DIHYDROXYPHENYL)ACETIC ACID | B | 1AI4 | 0.76 | |
| DHY | 2-(3,4-DIHYDROXYPHENYL)ACETIC ACID | A,B,C,D | 1Q0C | 0.76 | |
| DHY | 2-(3,4-DIHYDROXYPHENYL)ACETIC ACID | A,B | 1F1V | 0.76 | |
23A | 2,3-DIHYDROXYBENZALDEHYDE | A,B,C,D | 2DVX | 0.74 | |
B21 | 5-(2-METHOXYPHENYL)-2-FUROIC ACID | A | 2Q93 | 0.73 | |
AI7 | 3-(heptyloxy)benzoic acid | A,B | 2O3Z | 0.73 | |
3HB | 3-HYDROXYBENZOIC ACID | M,N,O,P,Q,R | 3PCB | 0.72 | |
| 3HB | 3-HYDROXYBENZOIC ACID | A | 2DKH | 0.72 | |
34D | 3,5-DIHYDROXYBENZOATE | A,B | 2BX7 | 0.72 | |
8CM | 8-HYDROXYCOUMARIN | A | 2H8Z | 0.72 | |
DH2 | (2S,3S)-2-(3,4-DIHYDROXYPHENYL)- 3,5,7-TRIHYDROXY-2,3-DIHYDRO-4H- CHROMEN-4-ONE | A | 1GP5 | 0.72 | |
| DH2 | (2S,3S)-2-(3,4-DIHYDROXYPHENYL)- 3,5,7-TRIHYDROXY-2,3-DIHYDRO-4H- CHROMEN-4-ONE | A | 1GP6 | 0.72 | |
DQH | (2R,3R)-2-(3,4-DIHYDROXYPHENYL)- 3,5,7-TRIHYDROXY-2,3-DIHYDRO-4H- CHROMEN-4-ONE | A | 1GP5 | 0.72 | |
| DQH | (2R,3R)-2-(3,4-DIHYDROXYPHENYL)- 3,5,7-TRIHYDROXY-2,3-DIHYDRO-4H- CHROMEN-4-ONE | D,F | 2C29 | 0.72 | |
CA2 | (1S,3R,4R,5S)-1,3,4-TRIHYDROXY- 5-(3-PHENOXYPROPYL)CYCLOHEXANECARBOXYLIC ACID | A,B,C,D,E,F, G,H,I,J,K,L | 2BT4 | 0.72 | |
3HP | 3-HYDROXYPHENYLACETATE | M,N,O,P,Q,R | 3PCE | 0.71 | |
DOB | 2,4-DIHYDROXYBENZOIC ACID | A | 1DOD | 0.71 | |
| DOB | 2,4-DIHYDROXYBENZOIC ACID | A | 1DOE | 0.71 | |
| DOB | 2,4-DIHYDROXYBENZOIC ACID | A | 1PBB | 0.71 | |
ANN | 4-METHOXYBENZOIC ACID | A | 2B96 | 0.7 | |
| ANN | 4-METHOXYBENZOIC ACID | A | 2QUE | 0.7 | |
| ANN | 4-METHOXYBENZOIC ACID | A | 1SV3 | 0.7 | |
| ANN | 4-METHOXYBENZOIC ACID | A | 1O2E | 0.7 | |
| ANN | 4-METHOXYBENZOIC ACID | A,B,C,D | 3CBI | 0.7 | |
A04 | 5-[2-(TRIFLUOROMETHOXY)PHENYL]- 2-FUROIC ACID | A | 2Q94 | 0.7 | |
2HC | (2E)-3-(2-HYDROXYPHENYL)ACRYLIC ACID | A,B | 1V5Z | 0.7 | |