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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00010661

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
CHN4-AMINOMETHYL-CYCLOHEXYLAMINEA,I1D9I0.73
LPTCIS-(AMMINE)(CYCLOHEXYLAMINE)PLATINUM(II) COMPLEXA,C1LU50.79
A72TRANS-BIS(HEXYLAMINE)-(DIAMMINE) PLATINUM(II) COMPLEXA,B2DYW0.82
N2PPENTANE-1,5-DIAMINEA,B2OO00.88
N2PPENTANE-1,5-DIAMINEA,B1H3M0.88
N2PPENTANE-1,5-DIAMINEA,B,C,D1GZL0.88
DREN-(6-AMINOHEXYL)HEXANE-1,6-DIAMINEA,B1Z6L0.77
HAICYCLOHEXYLAMMONIUM IONA1NAW0.75
HAICYCLOHEXYLAMMONIUM IONA,B2H520.75
HAICYCLOHEXYLAMMONIUM IONA,B1EJD0.75
HAICYCLOHEXYLAMMONIUM IONA,B2HHJ0.75
BPTBIS(TRANS-PLATINUM ETHYLENEDIAMINE DIAMINE CHLORO)COMPLEXA1AU60.74
BLYLYSINE BORONIC ACIDA,H1BTZ0.81
BLYLYSINE BORONIC ACIDA,H1BTW0.81
BNONORLEUCINE BORONIC ACIDA,P6LPR0.71
BNONORLEUCINE BORONIC ACIDA,P3LPR0.71
BNONORLEUCINE BORONIC ACIDA,P1P050.71
A71(6-AMINOHEXYLAMINE)(TRIAMMINE) PLATINUM(II) COMPLEXA,B2DYW0.92
DNH1R,2R-DIAMINOCYCLOHEXANEA,B1IHH0.76
297dodecane-1,12-diamineA,B3BI20.92
AMLAMYLAMINEA1JIR0.8
16DHEXANE-1,6-DIAMINEA,B,C2QK90.96
16DHEXANE-1,6-DIAMINEA,B,C,D,E,F1WOG0.96
LYTBUTYLAMINEA1EAG0.72
DIAOCTANE 1,8-DIAMINEA,B3BI50.92
DIAOCTANE 1,8-DIAMINEA,B,C1H830.92
PUT1,4-DIAMINOBUTANEA1I7B0.79
PUT1,4-DIAMINOBUTANEA,B3DZ60.79
PUT1,4-DIAMINOBUTANEA,B,C,D1I7M0.79
PUT1,4-DIAMINOBUTANEA1I790.79
PUT1,4-DIAMINOBUTANEA,B2O060.79
PUT1,4-DIAMINOBUTANEA,B1JL00.79
PUT1,4-DIAMINOBUTANEA1I720.79
PUT1,4-DIAMINOBUTANEA,B,C,D1A990.79
PUT1,4-DIAMINOBUTANEA,B3DZ40.79
PUT1,4-DIAMINOBUTANEA,B3H0W0.79
PUT1,4-DIAMINOBUTANEA,B3DZ30.79
PUT1,4-DIAMINOBUTANEA,B1MSV0.79
PUT1,4-DIAMINOBUTANEA1I7C0.79
PUT1,4-DIAMINOBUTANEA,B3DZ70.79
PUT1,4-DIAMINOBUTANEA,B3EPB0.79
PUT1,4-DIAMINOBUTANEA,B,C,D1F3T0.79
PUT1,4-DIAMINOBUTANEA,B3DZ20.79
PUT1,4-DIAMINOBUTANEA,B3DZ50.79
PUT1,4-DIAMINOBUTANEA,B3EPA0.79
PUT1,4-DIAMINOBUTANEA,B3H0V0.79
AMCAMINOMETHYLCYCLOHEXANEA1TNG0.74
AMCAMINOMETHYLCYCLOHEXANEA,B1DLG0.74
GC71-GUANIDINIUM-7-AMINOHEPTANEA,B1RQD0.73
1CBCYCLOPENTANAMINEA2AS60.71