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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02865564

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
2EP2-ETHYLPIPERIDINEH,I1A4W0.71
HAICYCLOHEXYLAMMONIUM IONA1NAW1
HAICYCLOHEXYLAMMONIUM IONA,B2H521
HAICYCLOHEXYLAMMONIUM IONA,B1EJD1
HAICYCLOHEXYLAMMONIUM IONA,B2HHJ1
A71(6-AMINOHEXYLAMINE)(TRIAMMINE) PLATINUM(II) COMPLEXA,B2DYW0.75
CYICYCLOHEXYL ISOCYANIDEA,B2CZ60.78
CYICYCLOHEXYL ISOCYANIDEA,B2D0Q0.78
2MHcis-4-methylcyclohexanamineA,B,C2PT90.78
DNH1R,2R-DIAMINOCYCLOHEXANEA,B1IHH0.93
AMLAMYLAMINEA1JIR0.77
N2PPENTANE-1,5-DIAMINEA,B2OO00.77
N2PPENTANE-1,5-DIAMINEA,B1H3M0.77
N2PPENTANE-1,5-DIAMINEA,B,C,D1GZL0.77
AMCAMINOMETHYLCYCLOHEXANEA1TNG0.72
AMCAMINOMETHYLCYCLOHEXANEA,B1DLG0.72
1PTCYCLOHEXANE-1(R),2(R)-DIAMINE-PLATINUM(II)A1PG90.76
1PTCYCLOHEXANE-1(R),2(R)-DIAMINE-PLATINUM(II)A1PGC0.76
1PTCYCLOHEXANE-1(R),2(R)-DIAMINE-PLATINUM(II)A2K0U0.76
1PTCYCLOHEXANE-1(R),2(R)-DIAMINE-PLATINUM(II)A2K0T0.76
DIAOCTANE 1,8-DIAMINEA,B3BI50.7
DIAOCTANE 1,8-DIAMINEA,B,C1H830.7
CHN4-AMINOMETHYL-CYCLOHEXYLAMINEA,I1D9I0.76
LPTCIS-(AMMINE)(CYCLOHEXYLAMINE)PLATINUM(II) COMPLEXA,C1LU50.96
1CBCYCLOPENTANAMINEA2AS60.81
297dodecane-1,12-diamineA,B3BI20.7
16DHEXANE-1,6-DIAMINEA,B,C2QK90.78
16DHEXANE-1,6-DIAMINEA,B,C,D,E,F1WOG0.78