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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03201106

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
13D1,3-DIAMINOPROPANEA,B2F8W0.76
3CN3-AMINOPROPANEA,B,C,D3C0R0.71
3CN3-AMINOPROPANEB3BY40.71
NPTNEOPENTYLAMINEI1IVQ0.73
N2PPENTANE-1,5-DIAMINEA,B2OO00.74
N2PPENTANE-1,5-DIAMINEA,B1H3M0.74
N2PPENTANE-1,5-DIAMINEA,B,C,D1GZL0.74
PUT1,4-DIAMINOBUTANEA1I7B0.81
PUT1,4-DIAMINOBUTANEA,B3DZ60.81
PUT1,4-DIAMINOBUTANEA,B,C,D1I7M0.81
PUT1,4-DIAMINOBUTANEA1I790.81
PUT1,4-DIAMINOBUTANEA,B2O060.81
PUT1,4-DIAMINOBUTANEA,B1JL00.81
PUT1,4-DIAMINOBUTANEA1I720.81
PUT1,4-DIAMINOBUTANEA,B,C,D1A990.81
PUT1,4-DIAMINOBUTANEA,B3DZ40.81
PUT1,4-DIAMINOBUTANEA,B3H0W0.81
PUT1,4-DIAMINOBUTANEA,B3DZ30.81
PUT1,4-DIAMINOBUTANEA,B1MSV0.81
PUT1,4-DIAMINOBUTANEA1I7C0.81
PUT1,4-DIAMINOBUTANEA,B3DZ70.81
PUT1,4-DIAMINOBUTANEA,B3EPB0.81
PUT1,4-DIAMINOBUTANEA,B,C,D1F3T0.81
PUT1,4-DIAMINOBUTANEA,B3DZ20.81
PUT1,4-DIAMINOBUTANEA,B3DZ50.81
PUT1,4-DIAMINOBUTANEA,B3EPA0.81
PUT1,4-DIAMINOBUTANEA,B3H0V0.81
LYTBUTYLAMINEA1EAG0.73