Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs01406522
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 |
HZH | 1,1,1-trifluoro-3-[(2-phenylethyl)sulfanyl]propan- 2-one | A,B | 3DEA | 0.79 | |
PRA | 3-PHENYLPROPYLAMINE | A | 1TNK | 0.71 | |
PRA | 3-PHENYLPROPYLAMINE | M | 1UTL | 0.71 | |
PBN | 4-PHENYLBUTYLAMINE | A | 1TNI | 0.71 | |
PBN | 4-PHENYLBUTYLAMINE | A | 1UTP | 0.71 | |
STF | (5R)-2-SULFANYL-5-[4-(TRIFLUOROMETHYL)BENZYL]- 1,3-THIAZOL-4-ONE | A | 2EXG | 0.71 | |
NFA | PHENYLALANINE AMIDE | A,B,C,D | 2BTJ | 0.71 | |
NFA | PHENYLALANINE AMIDE | A,B,C,D,E,F | 2EFX | 0.71 | |
NFA | PHENYLALANINE AMIDE | A,B,C,D | 2VVJ | 0.71 | |
NFA | PHENYLALANINE AMIDE | A | 2A4O | 0.71 | |
NFA | PHENYLALANINE AMIDE | A,B | 1XAE | 0.71 | |
NFA | PHENYLALANINE AMIDE | A,B,C,D | 2OGR | 0.71 | |
NFA | PHENYLALANINE AMIDE | A,B,C,D | 1QA7 | 0.71 | |
NFA | PHENYLALANINE AMIDE | A,B,C,D | 2GW4 | 0.71 | |
SEH | S-BENZYL PHENYLACETOTHIOHYDROXIMATE- O-SULFATE | M | 1W9D | 0.73 | |
CPM | S-(2-CARBOXY-3-PHENYLPROPYL)THIODIIMINE- S-METHANE | A | 1CPS | 0.7 | |
PEA | 2-PHENYLETHYLAMINE | A,B,E,F,G,H | 1MHW | 0.7 | |
PEA | 2-PHENYLETHYLAMINE | A | 1TNJ | 0.7 | |
PEA | 2-PHENYLETHYLAMINE | D,H | 2HKM | 0.7 | |
PEA | 2-PHENYLETHYLAMINE | A | 1UTO | 0.7 | |
PEA | 2-PHENYLETHYLAMINE | A,B | 1D6Y | 0.7 | |
PEA | 2-PHENYLETHYLAMINE | A,B | 1D6Z | 0.7 | |
PEA | 2-PHENYLETHYLAMINE | A,B | 1D6U | 0.7 | |
PEA | 2-PHENYLETHYLAMINE | A | 1UTM | 0.7 | |
OXE | ORTHO-XYLENE | A,B | 3E0X | 0.72 | |
OXE | ORTHO-XYLENE | A | 188L | 0.72 | |
PTF | [(METHYLSULFANYL)METHYL]BENZENE | C,F | 1RHQ | 0.78 | |
4BT | 2-{2-[4-(2-CARBAMIMIDOYLSULFANYL- ETHYL)-PHENYL]-ETHYL}-ISOTHIOUREA | A,B | 1D1X | 0.72 | |
3BT | 2-{2-[3-(2-CARBAMIMIDOYLSULFANYL- ETHYL)-PHENYL]-ETHYL}-ISOTHIOUREA | A,B | 1D1Y | 0.72 | |
BCS | BENZYLCYSTEINE | A,B,G,H | 10GS | 0.77 | |
BCS | BENZYLCYSTEINE | A | 1EH8 | 0.77 |