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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02848216

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
GC71-GUANIDINIUM-7-AMINOHEPTANEA,B1RQD0.76
2EP2-ETHYLPIPERIDINEH,I1A4W0.76
DIXMETHYL(CYCLOPENTYL-PROPYL)AMINEC,D1A1C0.73
DIB3-AMINO-(DIMETHYLPROPYLAMINE)A,D,E,G,I,J1S320.7
DIB3-AMINO-(DIMETHYLPROPYLAMINE)E,I,J1M1A0.7
DIB3-AMINO-(DIMETHYLPROPYLAMINE)D,I,J1M180.7
DIB3-AMINO-(DIMETHYLPROPYLAMINE)E,I,J1M190.7
N2PPENTANE-1,5-DIAMINEA,B2OO00.71
N2PPENTANE-1,5-DIAMINEA,B1H3M0.71
N2PPENTANE-1,5-DIAMINEA,B,C,D1GZL0.71
AMLAMYLAMINEA1JIR0.78
DIAOCTANE 1,8-DIAMINEA,B3BI50.71
DIAOCTANE 1,8-DIAMINEA,B,C1H830.71
EPI4-ETHYLPIPERIDINEH,I1FPC0.71
16DHEXANE-1,6-DIAMINEA,B,C2QK90.79
16DHEXANE-1,6-DIAMINEA,B,C,D,E,F1WOG0.79
HPLHEPTYLFORMAMIDEA,B1U3V0.75
297dodecane-1,12-diamineA,B3BI20.71
A72TRANS-BIS(HEXYLAMINE)-(DIAMMINE) PLATINUM(II) COMPLEXA,B2DYW0.74
DREN-(6-AMINOHEXYL)HEXANE-1,6-DIAMINEA,B1Z6L0.87
A71(6-AMINOHEXYLAMINE)(TRIAMMINE) PLATINUM(II) COMPLEXA,B2DYW0.76
LYTBUTYLAMINEA1EAG0.7
B33N-ETHYL-N-[3-(PROPYLAMINO)PROPYL]PROPANE-
1,3-DIAMINE
A,B2B4B0.74
ETNMETHYLETHYLAMINEA1TES0.7
DIPDIPENTYLAMINEC,D1A1B0.9
DIPDIPENTYLAMINEC,D1A070.9
DIPDIPENTYLAMINEC,D1A1A0.9
DIPDIPENTYLAMINEC,D1A080.9
DIPDIPENTYLAMINEC,D1A090.9
BNONORLEUCINE BORONIC ACIDA,P6LPR0.7
BNONORLEUCINE BORONIC ACIDA,P3LPR0.7
BNONORLEUCINE BORONIC ACIDA,P1P050.7