Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03950586
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 |
2MP | 3,4-DIMETHYLPHENOL | A | 1L5O | 0.77 | |
AEH | 4-(2-aminoethyl)-2-ethylphenol | A | 3BUG | 0.84 | |
4HP | 4-HYDROXYPHENYLACETATE | A,B,C,D | 2JBT | 0.72 | |
4HP | 4-HYDROXYPHENYLACETATE | A | 2YYJ | 0.72 | |
4HP | 4-HYDROXYPHENYLACETATE | A | 2YYM | 0.72 | |
4HP | 4-HYDROXYPHENYLACETATE | B | 1AI6 | 0.72 | |
4HP | 4-HYDROXYPHENYLACETATE | M,N,O,P,Q,R | 3PCG | 0.72 | |
4BZ | 4-(HYDROXYMETHYL)BENZAMIDINE | A | 1S6H | 0.78 | |
AED | 4-(2-aminoethyl)-2-cyclohexylphenol | A | 3BUH | 0.81 | |
166 | 6-CARBAMIMIDOYL-2-[2-HYDROXY-6- (4-HYDROXY-PHENYL)-INDAN-1-YL]- HEXANOIC ACID | B,I | 1QJ1 | 0.73 | |
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 | 0.75 | |
108 | 2-(5-CARBAMIMIDOYL-2-HYDROXY-BENZYLAMINO)- PROPIONIC ACID | A | 1G3B | 0.73 | |
108 | 2-(5-CARBAMIMIDOYL-2-HYDROXY-BENZYLAMINO)- PROPIONIC ACID | A | 1G3D | 0.73 | |
2LP | 2-ALLYLPHENOL | A | 1OV5 | 0.79 | |
AEF | 4-(2-aminoethyl)phenol | A | 3BRA | 0.88 | |
AHT | 4-(2,5-DIAMINO-5-HYDROXY-PENTYL)- PHENOL | I,T | 1TMB | 0.8 | |
1NP | 1-NAPHTHOL | X | 2ZVQ | 0.71 | |
4HL | 4-(HYDRAZINOMETHYL)PHENOL | A,B | 2E2U | 0.78 | |
2HC | (2E)-3-(2-HYDROXYPHENYL)ACRYLIC ACID | A,B | 1V5Z | 0.71 | |
55E | 4-(4-hydroxy-3-methylphenyl)-6- phenylpyrimidin-2(5H)-one | A | 3DCV | 0.75 | |
1OH | 4-(1-methyl-1-phenylethyl)phenol | A | 2ZAS | 0.73 | |
AEG | 4-[(2R)-2-aminopropyl]phenol | A | 3BUF | 0.85 | |
2AC | 2-AMINO-P-CRESOL | H,I | 1A2C | 0.74 | |
2AC | 2-AMINO-P-CRESOL | A | 1L4M | 0.74 | |
109 | 2-(4-CARBAMIMIDOYL-2-HYDROXY-BENZYLAMINO)- PROPIONIC ACID | A | 1G3C | 0.71 | |
109 | 2-(4-CARBAMIMIDOYL-2-HYDROXY-BENZYLAMINO)- PROPIONIC ACID | A | 1G3E | 0.71 | |
2OH | 4,4'-PROPANE-2,2-DIYLDIPHENOL | A | 2E2R | 0.72 | |
2OH | 4,4'-PROPANE-2,2-DIYLDIPHENOL | A | 2P7G | 0.72 |