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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03186990

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
DMEDECAMETHONIUM IONA,B,C,D1MAA0.74
DMEDECAMETHONIUM IONA1ACL0.74
GC71-GUANIDINIUM-7-AMINOHEPTANEA,B1RQD0.76
2EP2-ETHYLPIPERIDINEH,I1A4W0.71
HPLHEPTYLFORMAMIDEA,B1U3V0.7
MD2N,N'-BIS(2,3-BUTADIENYL)-1,4-BUTANE-
DIAMINE
A,B,C1B5Q0.7
DREN-(6-AMINOHEXYL)HEXANE-1,6-DIAMINEA,B1Z6L0.91
DIAOCTANE 1,8-DIAMINEA,B3BI50.71
DIAOCTANE 1,8-DIAMINEA,B,C1H830.71
A72TRANS-BIS(HEXYLAMINE)-(DIAMMINE) PLATINUM(II) COMPLEXA,B2DYW0.79
297dodecane-1,12-diamineA,B3BI20.71
B33N-ETHYL-N-[3-(PROPYLAMINO)PROPYL]PROPANE-
1,3-DIAMINE
A,B2B4B0.79
DIPDIPENTYLAMINEC,D1A1B0.88
DIPDIPENTYLAMINEC,D1A070.88
DIPDIPENTYLAMINEC,D1A1A0.88
DIPDIPENTYLAMINEC,D1A080.88
DIPDIPENTYLAMINEC,D1A090.88
SPDSPERMIDINE1,2,3,41POY0.76
SPDSPERMIDINEA,B3BXZ0.76
SPDSPERMIDINEA2ELG0.76
SPDSPERMIDINEA,B,C2PWP0.76
SPDSPERMIDINEA,B1BO40.76
SPDSPERMIDINEA,B,C,D3C6K0.76
SPDSPERMIDINEA,B2O070.76
SPDSPERMIDINEA2P1E0.76
SPDSPERMIDINEA,B293D0.76
SPDSPERMIDINEA,B1TYP0.76
SPDSPERMIDINEA,B,C,D2QBY0.76
SPDSPERMIDINEA,B3CN80.76
SPDSPERMIDINEA1U8D0.76
SPDSPERMIDINEA2P180.76
SPDSPERMIDINEA,B2HMP0.76
SPDSPERMIDINED1I2X0.76
SPDSPERMIDINEA1POT0.76
10ADIDECYL-DIMETHYL-AMMONIUMA,B,C,D1KPH0.74
10ADIDECYL-DIMETHYL-AMMONIUMA1KPI0.74
PIPPIPERIDINEH1ETS0.71
PIPPIPERIDINEH1ETT0.71
PIPPIPERIDINEE,I1PPC0.71
PIPPIPERIDINEI1QUR0.71
PIPPIPERIDINEE1PPH0.71
CATDODECANE-TRIMETHYLAMINEA,B2SHP0.74
16DHEXANE-1,6-DIAMINEA,B,C2QK90.72
16DHEXANE-1,6-DIAMINEA,B,C,D,E,F1WOG0.72
16ACETYL-TRIMETHYL-AMMONIUMA3HF00.71
16ACETYL-TRIMETHYL-AMMONIUMA,B,C,D1KPG0.71
16ACETYL-TRIMETHYL-AMMONIUMA1TPY0.71
4PN4-PIPERIDINO-PIPERIDINEA1K4Y0.71
P241-(AMINOETHYL)AMINO-4-AMINOBUTANEB1O9M0.74
P241-(AMINOETHYL)AMINO-4-AMINOBUTANEA,B292D0.74