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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03202030

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
N2PPENTANE-1,5-DIAMINEA,B2OO00.81
N2PPENTANE-1,5-DIAMINEA,B1H3M0.81
N2PPENTANE-1,5-DIAMINEA,B,C,D1GZL0.81
PUT1,4-DIAMINOBUTANEA1I7B0.73
PUT1,4-DIAMINOBUTANEA,B3DZ60.73
PUT1,4-DIAMINOBUTANEA,B,C,D1I7M0.73
PUT1,4-DIAMINOBUTANEA1I790.73
PUT1,4-DIAMINOBUTANEA,B2O060.73
PUT1,4-DIAMINOBUTANEA,B1JL00.73
PUT1,4-DIAMINOBUTANEA1I720.73
PUT1,4-DIAMINOBUTANEA,B,C,D1A990.73
PUT1,4-DIAMINOBUTANEA,B3DZ40.73
PUT1,4-DIAMINOBUTANEA,B3H0W0.73
PUT1,4-DIAMINOBUTANEA,B3DZ30.73
PUT1,4-DIAMINOBUTANEA,B1MSV0.73
PUT1,4-DIAMINOBUTANEA1I7C0.73
PUT1,4-DIAMINOBUTANEA,B3DZ70.73
PUT1,4-DIAMINOBUTANEA,B3EPB0.73
PUT1,4-DIAMINOBUTANEA,B,C,D1F3T0.73
PUT1,4-DIAMINOBUTANEA,B3DZ20.73
PUT1,4-DIAMINOBUTANEA,B3DZ50.73
PUT1,4-DIAMINOBUTANEA,B3EPA0.73
PUT1,4-DIAMINOBUTANEA,B3H0V0.73
CHN4-AMINOMETHYL-CYCLOHEXYLAMINEA,I1D9I0.74
DREN-(6-AMINOHEXYL)HEXANE-1,6-DIAMINEA,B1Z6L0.72
AMLAMYLAMINEA1JIR0.74
A71(6-AMINOHEXYLAMINE)(TRIAMMINE) PLATINUM(II) COMPLEXA,B2DYW0.85
BLYLYSINE BORONIC ACIDA,H1BTZ0.76
BLYLYSINE BORONIC ACIDA,H1BTW0.76
297dodecane-1,12-diamineA,B3BI20.79
16DHEXANE-1,6-DIAMINEA,B,C2QK90.88
16DHEXANE-1,6-DIAMINEA,B,C,D,E,F1WOG0.88
DIAOCTANE 1,8-DIAMINEA,B3BI50.79
DIAOCTANE 1,8-DIAMINEA,B,C1H830.79
LPTCIS-(AMMINE)(CYCLOHEXYLAMINE)PLATINUM(II) COMPLEXA,C1LU50.86
A72TRANS-BIS(HEXYLAMINE)-(DIAMMINE) PLATINUM(II) COMPLEXA,B2DYW0.77
1CBCYCLOPENTANAMINEA2AS60.79
DNH1R,2R-DIAMINOCYCLOHEXANEA,B1IHH0.83
HAICYCLOHEXYLAMMONIUM IONA1NAW0.82
HAICYCLOHEXYLAMMONIUM IONA,B2H520.82
HAICYCLOHEXYLAMMONIUM IONA,B1EJD0.82
HAICYCLOHEXYLAMMONIUM IONA,B2HHJ0.82