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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03018604

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
DIY5-BUTYLPIPERIDINEC,D1A1E0.77
AMCAMINOMETHYLCYCLOHEXANEA1TNG0.88
AMCAMINOMETHYLCYCLOHEXANEA,B1DLG0.88
AMLAMYLAMINEA1JIR0.7
LEN3-METHYLBUTAN-1-AMINEA1PE50.73
LEN3-METHYLBUTAN-1-AMINEA1PE70.73
LEN3-METHYLBUTAN-1-AMINEA1PE80.73
16DHEXANE-1,6-DIAMINEA,B,C2QK90.71
16DHEXANE-1,6-DIAMINEA,B,C,D,E,F1WOG0.71
DCI2-METHYL-BUTYLAMINEE,I1ENT0.73
DCI2-METHYL-BUTYLAMINEA,I1GVW0.73
DCI2-METHYL-BUTYLAMINEE1EPP0.73
DCI2-METHYL-BUTYLAMINEI4ER10.73
CHN4-AMINOMETHYL-CYCLOHEXYLAMINEA,I1D9I0.8
DIAOCTANE 1,8-DIAMINEA,B3BI50.75
DIAOCTANE 1,8-DIAMINEA,B,C1H830.75
2MHcis-4-methylcyclohexanamineA,B,C2PT90.82
297dodecane-1,12-diamineA,B3BI20.75
A72TRANS-BIS(HEXYLAMINE)-(DIAMMINE) PLATINUM(II) COMPLEXA,B2DYW0.73
DIXMETHYL(CYCLOPENTYL-PROPYL)AMINEC,D1A1C0.81