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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00008787

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
DNH1R,2R-DIAMINOCYCLOHEXANEA,B1IHH0.78
LPTCIS-(AMMINE)(CYCLOHEXYLAMINE)PLATINUM(II) COMPLEXA,C1LU50.81
AMLAMYLAMINEA1JIR0.7
2MHcis-4-methylcyclohexanamineA,B,C2PT90.72
DREN-(6-AMINOHEXYL)HEXANE-1,6-DIAMINEA,B1Z6L0.74
DIPDIPENTYLAMINEC,D1A1B0.76
DIPDIPENTYLAMINEC,D1A070.76
DIPDIPENTYLAMINEC,D1A1A0.76
DIPDIPENTYLAMINEC,D1A080.76
DIPDIPENTYLAMINEC,D1A090.76
PIPPIPERIDINEH1ETS0.76
PIPPIPERIDINEH1ETT0.76
PIPPIPERIDINEE,I1PPC0.76
PIPPIPERIDINEI1QUR0.76
PIPPIPERIDINEE1PPH0.76
EPI4-ETHYLPIPERIDINEH,I1FPC0.7
P2Y(2S)-PYRROLIDIN-2-YLMETHYLAMINEA,B,C,D1ORW0.7
2EP2-ETHYLPIPERIDINEH,I1A4W0.85
CYICYCLOHEXYL ISOCYANIDEA,B2CZ60.71
CYICYCLOHEXYL ISOCYANIDEA,B2D0Q0.71
HAICYCLOHEXYLAMMONIUM IONA1NAW0.83
HAICYCLOHEXYLAMMONIUM IONA,B2H520.83
HAICYCLOHEXYLAMMONIUM IONA,B1EJD0.83
HAICYCLOHEXYLAMMONIUM IONA,B2HHJ0.83
NMH(R)-N-(1-METHYL-HEXYL)-FORMAMIDEA,B,C,D1P1R0.7
CXFCYCLOHEXYLFORMAMIDEA,B1E3I0.78
CXFCYCLOHEXYLFORMAMIDEA,B,C,D1LDY0.78