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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00012324

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
AMLAMYLAMINEA1JIR0.75
1CBCYCLOPENTANAMINEA2AS60.73
DNH1R,2R-DIAMINOCYCLOHEXANEA,B1IHH0.72
HAICYCLOHEXYLAMMONIUM IONA1NAW0.77
HAICYCLOHEXYLAMMONIUM IONA,B2H520.77
HAICYCLOHEXYLAMMONIUM IONA,B1EJD0.77
HAICYCLOHEXYLAMMONIUM IONA,B2HHJ0.77
A71(6-AMINOHEXYLAMINE)(TRIAMMINE) PLATINUM(II) COMPLEXA,B2DYW0.73
16DHEXANE-1,6-DIAMINEA,B,C2QK90.76
16DHEXANE-1,6-DIAMINEA,B,C,D,E,F1WOG0.76
DIAOCTANE 1,8-DIAMINEA,B3BI50.86
DIAOCTANE 1,8-DIAMINEA,B,C1H830.86
LPTCIS-(AMMINE)(CYCLOHEXYLAMINE)PLATINUM(II) COMPLEXA,C1LU50.74
A72TRANS-BIS(HEXYLAMINE)-(DIAMMINE) PLATINUM(II) COMPLEXA,B2DYW0.77
FXY1-METHYLHEPTYLFORMAMIDEA,B1U3W0.72
2MHcis-4-methylcyclohexanamineA,B,C2PT90.71
297dodecane-1,12-diamineA,B3BI20.86