Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00529100
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 |
4BB | 4-tert-butyl-N'-[(1E)-(3,5-dibromo- 2,4-dihydroxyphenyl)methylidene]benzohydrazide | A,B,C,D,E,F | 3DP3 | 0.78 |  |
YTT | (3S,6S)-3,6-bis(4-hydroxybenzyl)piperazine- 2,5-dione | A | 3G5H | 0.71 | |
OX5 | 4-HYDROXYBENZALDEHYDE O-(3,3-DIMETHYLBUTANOYL)OXIME | A,B,C | 2OOZ | 0.73 | |
DTY | D-TYROSINE | A | 1C4B | 0.71 | |
| DTY | D-TYROSINE | A,L | 1ZEA | 0.71 | |
| DTY | D-TYROSINE | A,B,C,D,E,F, G,H | 1OF6 | 0.71 | |
| DTY | D-TYROSINE | A,B | 1UNO | 0.71 | |
| DTY | D-TYROSINE | A | 2IGZ | 0.71 | |
| DTY | D-TYROSINE | A,B,C,H,K,L | 2R5D | 0.71 | |
| DTY | D-TYROSINE | A,B | 2Q33 | 0.71 | |
| DTY | D-TYROSINE | H,S | 2H9E | 0.71 | |
| DTY | D-TYROSINE | A,B,C,H,K,L | 2R5B | 0.71 | |
| DTY | D-TYROSINE | A | 2IH0 | 0.71 | |
| DTY | D-TYROSINE | A | 1D7T | 0.71 | |
| DTY | D-TYROSINE | A,B | 1XA0 | 0.71 | |
TYB | TYROSINAL | A,B | 1KDZ | 0.71 | |
| TYB | TYROSINAL | A | 1Q11 | 0.71 | |
| TYB | TYROSINAL | A,B | 2J5B | 0.71 | |
| TYB | TYROSINAL | A,I | 1GA4 | 0.71 | |
| TYB | TYROSINAL | A,B,C | 1NLU | 0.71 | |
| TYB | TYROSINAL | A,B | 1KE1 | 0.71 | |
| TYB | TYROSINAL | A,B | 1H3F | 0.71 | |
| TYB | TYROSINAL | A,B | 1H3E | 0.71 | |
2BC | N'-[(1E)-(3,5-dibromo-2,4-dihydroxyphenyl)methylidene]naphthalene- 2-carbohydrazide | A,B,C,D,E,F | 3DP0 | 0.73 | |
B3Y | (3S)-3-AMINO-4-(4-HYDROXYPHENYL)BUTANOIC ACID | A | 3HF0 | 0.7 | |
| B3Y | (3S)-3-AMINO-4-(4-HYDROXYPHENYL)BUTANOIC ACID | A | 2OXK | 0.7 | |
| B3Y | (3S)-3-AMINO-4-(4-HYDROXYPHENYL)BUTANOIC ACID | A,B,C | 2OXJ | 0.7 | |
AEH | 4-(2-aminoethyl)-2-ethylphenol | A | 3BUG | 0.72 | |
SGI | 3-(4-hydroxyphenyl)propanamide | A,B | 2R9K | 0.76 | |
555 | 4-(4-HYDROXYPHENYL)-1-NAPHTHALDEHYDE OXIME | A,B | 2NV7 | 0.7 | |
OX4 | 3-FLUORO-4-HYDROXYBENZALDEHYDE O- (CYCLOHEXYLCARBONYL)OXIME | A,B,C | 2OOW | 0.73 | |
3BE | 3-bromo-N'-[(1E)-(3,5-dibromo-2,4- dihydroxyphenyl)methylidene]benzohydrazide | A,B,C,D,E,F | 3DOZ | 0.74 | |
4BE | 4-bromo-N'-[(1E)-(3,5-dibromo-2,4- dihydroxyphenyl)methylidene]benzohydrazide | A,B,C,D,E,F | 3DP2 | 0.73 | |
1BA | 4-HYDROXY-N'-(4-ISOPROPYLBENZYL)BENZOHYDRAZIDE | A | 2GPP | 0.76 | |
NLT | N-DODECANOYL-L-TYROSINE | A,B,C,D,E,F, G,H | 2G0B | 0.7 | |
TYC | L-TYROSINAMIDE | A | 2BF9 | 0.75 | |
| TYC | L-TYROSINAMIDE | A | 2OCI | 0.75 | |
K05 | (E)-3,4-DIHYDROXY-N'-[(2-METHOXYNAPHTHALEN- 1-YL)METHYLENE]BENZOHYDRAZIDE | A,B | 2I5J | 0.73 | |
OX3 | 4-HYDROXYBENZALDEHYDE O-(CYCLOHEXYLCARBONYL)OXIME | A,B,C | 2OOH | 0.75 | |
166 | 6-CARBAMIMIDOYL-2-[2-HYDROXY-6- (4-HYDROXY-PHENYL)-INDAN-1-YL]- HEXANOIC ACID | B,I | 1QJ1 | 0.71 | |
AED | 4-(2-aminoethyl)-2-cyclohexylphenol | A | 3BUH | 0.73 | |
55E | 4-(4-hydroxy-3-methylphenyl)-6- phenylpyrimidin-2(5H)-one | A | 3DCV | 0.72 | |