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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03914211

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
16ACETYL-TRIMETHYL-AMMONIUMA3HF00.74
16ACETYL-TRIMETHYL-AMMONIUMA,B,C,D1KPG0.74
16ACETYL-TRIMETHYL-AMMONIUMA1TPY0.74
A71(6-AMINOHEXYLAMINE)(TRIAMMINE) PLATINUM(II) COMPLEXA,B2DYW0.72
CATDODECANE-TRIMETHYLAMINEA,B2SHP0.76
DIPDIPENTYLAMINEC,D1A1B0.84
DIPDIPENTYLAMINEC,D1A070.84
DIPDIPENTYLAMINEC,D1A1A0.84
DIPDIPENTYLAMINEC,D1A080.84
DIPDIPENTYLAMINEC,D1A090.84
10ADIDECYL-DIMETHYL-AMMONIUMA,B,C,D1KPH0.71
10ADIDECYL-DIMETHYL-AMMONIUMA1KPI0.71
B33N-ETHYL-N-[3-(PROPYLAMINO)PROPYL]PROPANE-
1,3-DIAMINE
A,B2B4B0.76
GC71-GUANIDINIUM-7-AMINOHEPTANEA,B1RQD0.83
A72TRANS-BIS(HEXYLAMINE)-(DIAMMINE) PLATINUM(II) COMPLEXA,B2DYW0.76
DIY5-BUTYLPIPERIDINEC,D1A1E0.75
16DHEXANE-1,6-DIAMINEA,B,C2QK90.74
16DHEXANE-1,6-DIAMINEA,B,C,D,E,F1WOG0.74
297dodecane-1,12-diamineA,B3BI20.84
DREN-(6-AMINOHEXYL)HEXANE-1,6-DIAMINEA,B1Z6L0.88
HPLHEPTYLFORMAMIDEA,B1U3V0.76
FXY1-METHYLHEPTYLFORMAMIDEA,B1U3W0.75
DIAOCTANE 1,8-DIAMINEA,B3BI50.84
DIAOCTANE 1,8-DIAMINEA,B,C1H830.84
2EP2-ETHYLPIPERIDINEH,I1A4W0.73
DIXMETHYL(CYCLOPENTYL-PROPYL)AMINEC,D1A1C0.79
N3DN-methylpropane-1,3-diamineA,B3EY20.72
DMEDECAMETHONIUM IONA,B,C,D1MAA0.76
DMEDECAMETHONIUM IONA1ACL0.76