Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00002697
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 |
3HP | 3-HYDROXYPHENYLACETATE | M,N,O,P,Q,R | 3PCE | 0.71 | |
505 | (2R)-1-(2,6-dimethylphenoxy)propan- 2-amine | A | 2VIN | 0.7 | |
4NL | 4-AMINOPHENOL | A | 2ORL | 0.73 | |
2AF | 2-AMINOPHENOL | A | 1L4N | 0.71 | |
AC6 | P-HYDROXYACETOPHENONE | A | 2GQ8 | 0.72 | |
AC6 | P-HYDROXYACETOPHENONE | X | 2O48 | 0.72 | |
4HL | 4-(HYDRAZINOMETHYL)PHENOL | A,B | 2E2U | 0.86 | |
AED | 4-(2-aminoethyl)-2-cyclohexylphenol | A | 3BUH | 0.91 | |
247 | (3R)-3-amino-2,2-difluoro-3-(4- hydroxyphenyl)propanoic acid | A,B | 2QVE | 0.78 | |
4HP | 4-HYDROXYPHENYLACETATE | A,B,C,D | 2JBT | 0.76 | |
4HP | 4-HYDROXYPHENYLACETATE | A | 2YYJ | 0.76 | |
4HP | 4-HYDROXYPHENYLACETATE | A | 2YYM | 0.76 | |
4HP | 4-HYDROXYPHENYLACETATE | B | 1AI6 | 0.76 | |
4HP | 4-HYDROXYPHENYLACETATE | M,N,O,P,Q,R | 3PCG | 0.76 | |
2LP | 2-ALLYLPHENOL | A | 1OV5 | 0.84 | |
2HC | (2E)-3-(2-HYDROXYPHENYL)ACRYLIC ACID | A,B | 1V5Z | 0.75 | |
1NP | 1-NAPHTHOL | X | 2ZVQ | 0.75 | |
AEF | 4-(2-aminoethyl)phenol | A | 3BRA | 1 | |
2MP | 3,4-DIMETHYLPHENOL | A | 1L5O | 0.82 | |
8PP | 2-[(2E,6E,10E,14E,18E,22E,26E)- 3,7,11,15,19,23,27,31-OCTAMETHYLDOTRIACONTA- 2,6,10,14,18,22,26,30-OCTAENYL]PHENOL | A,B,C,D | 1Y0G | 0.8 | |
2AC | 2-AMINO-P-CRESOL | H,I | 1A2C | 0.78 | |
2AC | 2-AMINO-P-CRESOL | A | 1L4M | 0.78 | |
43M | 4-CHLORO-3-METHYLPHENOL | A | 2P7A | 0.71 | |
12M | (2-ETHYLPHENYL)METHANOL | A,B | 2F62 | 0.7 | |
2OH | 4,4'-PROPANE-2,2-DIYLDIPHENOL | A | 2E2R | 0.77 | |
2OH | 4,4'-PROPANE-2,2-DIYLDIPHENOL | A | 2P7G | 0.77 | |
1OH | 4-(1-methyl-1-phenylethyl)phenol | A | 2ZAS | 0.77 |