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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00512620

You can sort the columns by Ligand, Ligand name, PDB and Tanimoto.


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
2662-(propylsulfanyl)ethanolA2RBP0.77
OESN-OCTYL-2-HYDROXYETHYL SULFOXIDEA2HDF0.75
OESN-OCTYL-2-HYDROXYETHYL SULFOXIDEA,B,C2IXW0.75
OESN-OCTYL-2-HYDROXYETHYL SULFOXIDEA1BY30.75
OESN-OCTYL-2-HYDROXYETHYL SULFOXIDEA,B1BY50.75
HED2-HYDROXYETHYL DISULFIDEA1CVK0.75
HED2-HYDROXYETHYL DISULFIDEA3DMV0.75
HED2-HYDROXYETHYL DISULFIDEA1CTW0.75
HED2-HYDROXYETHYL DISULFIDEA248L0.75
HED2-HYDROXYETHYL DISULFIDEA1CV10.75
HED2-HYDROXYETHYL DISULFIDEA249L0.75
HED2-HYDROXYETHYL DISULFIDEA,B,C2Q9E0.75
HED2-HYDROXYETHYL DISULFIDEA1D3N0.75
HED2-HYDROXYETHYL DISULFIDEA3DN80.75
HED2-HYDROXYETHYL DISULFIDEA1P370.75
HED2-HYDROXYETHYL DISULFIDEA1G0M0.75
HED2-HYDROXYETHYL DISULFIDEA1QTC0.75
HED2-HYDROXYETHYL DISULFIDEA186L0.75
HED2-HYDROXYETHYL DISULFIDEA1P3N0.75
HED2-HYDROXYETHYL DISULFIDEA1QSQ0.75
HED2-HYDROXYETHYL DISULFIDEA1KS30.75
HED2-HYDROXYETHYL DISULFIDEA1I6S0.75
HED2-HYDROXYETHYL DISULFIDEA3DN00.75
HED2-HYDROXYETHYL DISULFIDEA3DN20.75
HED2-HYDROXYETHYL DISULFIDEA1LWG0.75
HED2-HYDROXYETHYL DISULFIDEA187L0.75
HED2-HYDROXYETHYL DISULFIDEA1QTB0.75
HED2-HYDROXYETHYL DISULFIDEA1CU50.75
HED2-HYDROXYETHYL DISULFIDEA3DN10.75
HED2-HYDROXYETHYL DISULFIDEA1D3F0.75
HED2-HYDROXYETHYL DISULFIDEA1G0P0.75
HED2-HYDROXYETHYL DISULFIDEA3DMZ0.75
HED2-HYDROXYETHYL DISULFIDEA1D2Y0.75
HED2-HYDROXYETHYL DISULFIDEA215L0.75
HED2-HYDROXYETHYL DISULFIDEA1QT50.75
HED2-HYDROXYETHYL DISULFIDEA252L0.75
HED2-HYDROXYETHYL DISULFIDEA1QUO0.75
HED2-HYDROXYETHYL DISULFIDEA235L0.75
HED2-HYDROXYETHYL DISULFIDEA250L0.75
HED2-HYDROXYETHYL DISULFIDEA1LW90.75
HED2-HYDROXYETHYL DISULFIDEA,B1PKW0.75
HED2-HYDROXYETHYL DISULFIDEA1CV00.75
HED2-HYDROXYETHYL DISULFIDEA3G3V0.75
HED2-HYDROXYETHYL DISULFIDEA1CV60.75
HED2-HYDROXYETHYL DISULFIDEA240L0.75
HED2-HYDROXYETHYL DISULFIDEA,B1PKZ0.75
HED2-HYDROXYETHYL DISULFIDEA241L0.75
HED2-HYDROXYETHYL DISULFIDEA1D2W0.75
HED2-HYDROXYETHYL DISULFIDEA1G0G0.75
HED2-HYDROXYETHYL DISULFIDEA1KY00.75
HED2-HYDROXYETHYL DISULFIDEA244L0.75
HED2-HYDROXYETHYL DISULFIDEA1D3J0.75
HED2-HYDROXYETHYL DISULFIDEA219L0.75
HED2-HYDROXYETHYL DISULFIDEA245L0.75
HED2-HYDROXYETHYL DISULFIDEA192L0.75
HED2-HYDROXYETHYL DISULFIDEA1P460.75
HED2-HYDROXYETHYL DISULFIDEA1G0L0.75
HED2-HYDROXYETHYL DISULFIDEA1KW50.75
HED2-HYDROXYETHYL DISULFIDEA212L0.75
HED2-HYDROXYETHYL DISULFIDEA1LWK0.75
HED2-HYDROXYETHYL DISULFIDEA1P2R0.75
HED2-HYDROXYETHYL DISULFIDEA236L0.75
HED2-HYDROXYETHYL DISULFIDEA,B2O6I0.75
HED2-HYDROXYETHYL DISULFIDEA3DNA0.75
HED2-HYDROXYETHYL DISULFIDEA1CX60.75
HED2-HYDROXYETHYL DISULFIDEA1P6Y0.75
HED2-HYDROXYETHYL DISULFIDEA246L0.75
HED2-HYDROXYETHYL DISULFIDEA1P640.75
HED2-HYDROXYETHYL DISULFIDEA1G0K0.75
HED2-HYDROXYETHYL DISULFIDEA210L0.75
HED2-HYDROXYETHYL DISULFIDEA181L0.75
HED2-HYDROXYETHYL DISULFIDEA1QUG0.75
HED2-HYDROXYETHYL DISULFIDEA182L0.75
HED2-HYDROXYETHYL DISULFIDEA1G0J0.75
HED2-HYDROXYETHYL DISULFIDEA1KY10.75
HED2-HYDROXYETHYL DISULFIDEA3DMX0.75
HED2-HYDROXYETHYL DISULFIDEA191L0.75
HED2-HYDROXYETHYL DISULFIDEA1ZYT0.75
HED2-HYDROXYETHYL DISULFIDEA1L0J0.75
HED2-HYDROXYETHYL DISULFIDEA3CDR0.75
HED2-HYDROXYETHYL DISULFIDEA3DN40.75
HED2-HYDROXYETHYL DISULFIDEA1NHB0.75
HED2-HYDROXYETHYL DISULFIDEA242L0.75
HED2-HYDROXYETHYL DISULFIDEA257L0.75
HED2-HYDROXYETHYL DISULFIDEA1QSB0.75
HED2-HYDROXYETHYL DISULFIDEA1L0K0.75
HED2-HYDROXYETHYL DISULFIDEA185L0.75
HED2-HYDROXYETHYL DISULFIDEA1P2L0.75
HED2-HYDROXYETHYL DISULFIDEA2CUU0.75
HED2-HYDROXYETHYL DISULFIDEA1QS50.75
HED2-HYDROXYETHYL DISULFIDEA1CU00.75
HED2-HYDROXYETHYL DISULFIDEA3DN60.75
HED2-HYDROXYETHYL DISULFIDEA1CV50.75
HED2-HYDROXYETHYL DISULFIDEA188L0.75
HED2-HYDROXYETHYL DISULFIDEA1CV40.75
HED2-HYDROXYETHYL DISULFIDEA3FA00.75
HED2-HYDROXYETHYL DISULFIDEA183L0.75
HED2-HYDROXYETHYL DISULFIDEA184L0.75
HED2-HYDROXYETHYL DISULFIDEA1PQJ0.75
HED2-HYDROXYETHYL DISULFIDEA2F2Q0.75
HED2-HYDROXYETHYL DISULFIDEA243L0.75
HED2-HYDROXYETHYL DISULFIDEA251L0.75
HED2-HYDROXYETHYL DISULFIDEA1CV30.75
HED2-HYDROXYETHYL DISULFIDEA1QTD0.75
HED2-HYDROXYETHYL DISULFIDEA1T8A0.75
HED2-HYDROXYETHYL DISULFIDEA1CUQ0.75
HED2-HYDROXYETHYL DISULFIDEA237L0.75
HED2-HYDROXYETHYL DISULFIDEA247L0.75
HED2-HYDROXYETHYL DISULFIDEA1KW70.75
HED2-HYDROXYETHYL DISULFIDEA1CU30.75
HED2-HYDROXYETHYL DISULFIDEA1CUP0.75
HED2-HYDROXYETHYL DISULFIDEA3F8V0.75
HED2-HYDROXYETHYL DISULFIDEA3G3W0.75
HED2-HYDROXYETHYL DISULFIDEA3G3X0.75
HED2-HYDROXYETHYL DISULFIDEA1CU20.75
HED2-HYDROXYETHYL DISULFIDEA1CX70.75
HED2-HYDROXYETHYL DISULFIDEA1PQO0.75
HED2-HYDROXYETHYL DISULFIDEX3DKE0.75
HED2-HYDROXYETHYL DISULFIDEA1CU60.75
HED2-HYDROXYETHYL DISULFIDEA238L0.75
HED2-HYDROXYETHYL DISULFIDEA2A4T0.75
HED2-HYDROXYETHYL DISULFIDEA1G060.75
HED2-HYDROXYETHYL DISULFIDEA211L0.75
HED2-HYDROXYETHYL DISULFIDEA1PQM0.75
HED2-HYDROXYETHYL DISULFIDEA1QT30.75
HED2-HYDROXYETHYL DISULFIDEA1ZWN0.75
HED2-HYDROXYETHYL DISULFIDEA1D3M0.75
HED2-HYDROXYETHYL DISULFIDEA1QT80.75
HED2-HYDROXYETHYL DISULFIDEA3DN30.75
HED2-HYDROXYETHYL DISULFIDEA1B6I0.75
HED2-HYDROXYETHYL DISULFIDEA1G0Q0.75
HED2-HYDROXYETHYL DISULFIDEA1G070.75