Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs01660045
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 |
PTF![]() | [(METHYLSULFANYL)METHYL]BENZENE | C,F | 1RHQ | 0.84 | ![]() |
BZB![]() | BENZO[B]THIOPHENE-2-BORONIC ACID | A,B | 3FKV | 0.7 | ![]() |
BZB![]() | BENZO[B]THIOPHENE-2-BORONIC ACID | A,B | 1C3B | 0.7 | ![]() |
SEH![]() | S-BENZYL PHENYLACETOTHIOHYDROXIMATE- O-SULFATE | M | 1W9D | 0.73 | ![]() |
2HT![]() | 3-methylbenzonitrile | A,B | 3F88 | 0.72 | ![]() |
FPR![]() | PROPYLBENZENE | C | 1RHK | 0.72 | ![]() |
PVS![]() | (ethenylsulfonyl)benzene | A | 3BLU | 0.72 | ![]() |
TLD![]() | 4-methylbenzene-1,2-dithiol | A | 2Z94 | 0.77 | ![]() |
PXY![]() | PARA-XYLENE | A | 187L | 0.74 | ![]() |
PXY![]() | PARA-XYLENE | A | 225L | 0.74 | ![]() |
MBN![]() | TOLUENE | A,B | 3D7O | 0.71 | ![]() |
MBN![]() | TOLUENE | A,B | 1R1X | 0.71 | ![]() |
MBN![]() | TOLUENE | A,B | 1JLX | 0.71 | ![]() |
MBN![]() | TOLUENE | A,B,C,D | 3D17 | 0.71 | ![]() |
MBN![]() | TOLUENE | A,B | 2VRL | 0.71 | ![]() |
MBN![]() | TOLUENE | A,I | 2Z3E | 0.71 | ![]() |
MBN![]() | TOLUENE | A,B | 1YZI | 0.71 | ![]() |
MBN![]() | TOLUENE | A,B | 2DN1 | 0.71 | ![]() |
MBN![]() | TOLUENE | A,B | 3EN1 | 0.71 | ![]() |
SML![]() | PHENYL METHYL SULFONE | A,I | 1D6W | 0.71 | ![]() |
SML![]() | PHENYL METHYL SULFONE | A,I | 1D9I | 0.71 | ![]() |
4BT![]() | 2-{2-[4-(2-CARBAMIMIDOYLSULFANYL- ETHYL)-PHENYL]-ETHYL}-ISOTHIOUREA | A,B | 1D1X | 0.7 | ![]() |
N4B![]() | N-BUTYLBENZENE | A | 186L | 0.72 | ![]() |
IBZ![]() | 2-IODOBENZYLTHIO GROUP | A,B | 1CEL | 0.71 | ![]() |
PYL![]() | PHENYLETHANE | C | 1B07 | 0.72 | ![]() |
PYL![]() | PHENYLETHANE | A,B | 2VRM | 0.72 | ![]() |
PYL![]() | PHENYLETHANE | A | 1NHB | 0.72 | ![]() |
HZH![]() | 1,1,1-trifluoro-3-[(2-phenylethyl)sulfanyl]propan- 2-one | A,B | 3DEA | 0.73 | ![]() |