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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03335140

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
CDE1,2-DIMETHYL-PROPYLAMINEC1B0R0.77
LPTCIS-(AMMINE)(CYCLOHEXYLAMINE)PLATINUM(II) COMPLEXA,C1LU50.81
IBN2-METHYLPROPAN-1-AMINEA,B2QDY0.72
PUT1,4-DIAMINOBUTANEA1I7B0.75
PUT1,4-DIAMINOBUTANEA,B3DZ60.75
PUT1,4-DIAMINOBUTANEA,B,C,D1I7M0.75
PUT1,4-DIAMINOBUTANEA1I790.75
PUT1,4-DIAMINOBUTANEA,B2O060.75
PUT1,4-DIAMINOBUTANEA,B1JL00.75
PUT1,4-DIAMINOBUTANEA1I720.75
PUT1,4-DIAMINOBUTANEA,B,C,D1A990.75
PUT1,4-DIAMINOBUTANEA,B3DZ40.75
PUT1,4-DIAMINOBUTANEA,B3H0W0.75
PUT1,4-DIAMINOBUTANEA,B3DZ30.75
PUT1,4-DIAMINOBUTANEA,B1MSV0.75
PUT1,4-DIAMINOBUTANEA1I7C0.75
PUT1,4-DIAMINOBUTANEA,B3DZ70.75
PUT1,4-DIAMINOBUTANEA,B3EPB0.75
PUT1,4-DIAMINOBUTANEA,B,C,D1F3T0.75
PUT1,4-DIAMINOBUTANEA,B3DZ20.75
PUT1,4-DIAMINOBUTANEA,B3DZ50.75
PUT1,4-DIAMINOBUTANEA,B3EPA0.75
PUT1,4-DIAMINOBUTANEA,B3H0V0.75
N2PPENTANE-1,5-DIAMINEA,B2OO00.76
N2PPENTANE-1,5-DIAMINEA,B1H3M0.76
N2PPENTANE-1,5-DIAMINEA,B,C,D1GZL0.76
LEN3-METHYLBUTAN-1-AMINEA1PE50.73
LEN3-METHYLBUTAN-1-AMINEA1PE70.73
LEN3-METHYLBUTAN-1-AMINEA1PE80.73
LYTBUTYLAMINEA1EAG0.83
HAICYCLOHEXYLAMMONIUM IONA1NAW0.85
HAICYCLOHEXYLAMMONIUM IONA,B2H520.85
HAICYCLOHEXYLAMMONIUM IONA,B1EJD0.85
HAICYCLOHEXYLAMMONIUM IONA,B2HHJ0.85
2MHcis-4-methylcyclohexanamineA,B,C2PT90.72
A71(6-AMINOHEXYLAMINE)(TRIAMMINE) PLATINUM(II) COMPLEXA,B2DYW0.74
DCI2-METHYL-BUTYLAMINEE,I1ENT0.73
DCI2-METHYL-BUTYLAMINEA,I1GVW0.73
DCI2-METHYL-BUTYLAMINEE1EPP0.73
DCI2-METHYL-BUTYLAMINEI4ER10.73
BNONORLEUCINE BORONIC ACIDA,P6LPR0.74
BNONORLEUCINE BORONIC ACIDA,P3LPR0.74
BNONORLEUCINE BORONIC ACIDA,P1P050.74
3CN3-AMINOPROPANEA,B,C,D3C0R0.74
3CN3-AMINOPROPANEB3BY40.74
AMLAMYLAMINEA1JIR0.83
DNH1R,2R-DIAMINOCYCLOHEXANEA,B1IHH0.79
16DHEXANE-1,6-DIAMINEA,B,C2QK90.77
16DHEXANE-1,6-DIAMINEA,B,C,D,E,F1WOG0.77
A72TRANS-BIS(HEXYLAMINE)-(DIAMMINE) PLATINUM(II) COMPLEXA,B2DYW0.72
1CBCYCLOPENTANAMINEA2AS60.81