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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03446312

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
LYTBUTYLAMINEA1EAG0.76
AMLAMYLAMINEA1JIR0.84
LPTCIS-(AMMINE)(CYCLOHEXYLAMINE)PLATINUM(II) COMPLEXA,C1LU50.82
A71(6-AMINOHEXYLAMINE)(TRIAMMINE) PLATINUM(II) COMPLEXA,B2DYW0.75
13D1,3-DIAMINOPROPANEA,B2F8W0.72
CDE1,2-DIMETHYL-PROPYLAMINEC1B0R0.71
DNH1R,2R-DIAMINOCYCLOHEXANEA,B1IHH0.79
HAICYCLOHEXYLAMMONIUM IONA1NAW0.79
HAICYCLOHEXYLAMMONIUM IONA,B2H520.79
HAICYCLOHEXYLAMMONIUM IONA,B1EJD0.79
HAICYCLOHEXYLAMMONIUM IONA,B2HHJ0.79
BNONORLEUCINE BORONIC ACIDA,P6LPR0.75
BNONORLEUCINE BORONIC ACIDA,P3LPR0.75
BNONORLEUCINE BORONIC ACIDA,P1P050.75
A72TRANS-BIS(HEXYLAMINE)-(DIAMMINE) PLATINUM(II) COMPLEXA,B2DYW0.73
DIAOCTANE 1,8-DIAMINEA,B3BI50.7
DIAOCTANE 1,8-DIAMINEA,B,C1H830.7
N2PPENTANE-1,5-DIAMINEA,B2OO00.84
N2PPENTANE-1,5-DIAMINEA,B1H3M0.84
N2PPENTANE-1,5-DIAMINEA,B,C,D1GZL0.84
1CBCYCLOPENTANAMINEA2AS60.81
297dodecane-1,12-diamineA,B3BI20.7
PUT1,4-DIAMINOBUTANEA1I7B0.76
PUT1,4-DIAMINOBUTANEA,B3DZ60.76
PUT1,4-DIAMINOBUTANEA,B,C,D1I7M0.76
PUT1,4-DIAMINOBUTANEA1I790.76
PUT1,4-DIAMINOBUTANEA,B2O060.76
PUT1,4-DIAMINOBUTANEA,B1JL00.76
PUT1,4-DIAMINOBUTANEA1I720.76
PUT1,4-DIAMINOBUTANEA,B,C,D1A990.76
PUT1,4-DIAMINOBUTANEA,B3DZ40.76
PUT1,4-DIAMINOBUTANEA,B3H0W0.76
PUT1,4-DIAMINOBUTANEA,B3DZ30.76
PUT1,4-DIAMINOBUTANEA,B1MSV0.76
PUT1,4-DIAMINOBUTANEA1I7C0.76
PUT1,4-DIAMINOBUTANEA,B3DZ70.76
PUT1,4-DIAMINOBUTANEA,B3EPB0.76
PUT1,4-DIAMINOBUTANEA,B,C,D1F3T0.76
PUT1,4-DIAMINOBUTANEA,B3DZ20.76
PUT1,4-DIAMINOBUTANEA,B3DZ50.76
PUT1,4-DIAMINOBUTANEA,B3EPA0.76
PUT1,4-DIAMINOBUTANEA,B3H0V0.76
16DHEXANE-1,6-DIAMINEA,B,C2QK90.78
16DHEXANE-1,6-DIAMINEA,B,C,D,E,F1WOG0.78
BLYLYSINE BORONIC ACIDA,H1BTZ0.72
BLYLYSINE BORONIC ACIDA,H1BTW0.72