Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs01086253
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 |
817![]() | 1-{[N-(1-IMINO-GUANIDINO-METHYL)]SULFANYLMETHYL}- 3-TRIFLUOROMETHYL-BENZENE | A | 2ANO | 0.83 | ![]() |
FPR![]() | PROPYLBENZENE | C | 1RHK | 0.7 | ![]() |
C1A![]() | 1,4-BIS-{[N-(1-IMINO-1GUANIDINO- METHYL)]SULFANYLMETHYL}-3,6-DIMETHYL- BENZENE | A | 2ANQ | 0.86 | ![]() |
I4B![]() | ISOBUTYLBENZENE | A | 184L | 0.73 | ![]() |
OXE![]() | ORTHO-XYLENE | A,B | 3E0X | 0.71 | ![]() |
OXE![]() | ORTHO-XYLENE | A | 188L | 0.71 | ![]() |
PTF![]() | [(METHYLSULFANYL)METHYL]BENZENE | C,F | 1RHQ | 0.79 | ![]() |
PYL![]() | PHENYLETHANE | C | 1B07 | 0.7 | ![]() |
PYL![]() | PHENYLETHANE | A,B | 2VRM | 0.7 | ![]() |
PYL![]() | PHENYLETHANE | A | 1NHB | 0.7 | ![]() |
4BT![]() | 2-{2-[4-(2-CARBAMIMIDOYLSULFANYL- ETHYL)-PHENYL]-ETHYL}-ISOTHIOUREA | A,B | 1D1X | 0.93 | ![]() |
N4B![]() | N-BUTYLBENZENE | A | 186L | 0.7 | ![]() |
3BT![]() | 2-{2-[3-(2-CARBAMIMIDOYLSULFANYL- ETHYL)-PHENYL]-ETHYL}-ISOTHIOUREA | A,B | 1D1Y | 0.93 | ![]() |