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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00011903

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
4PN4-PIPERIDINO-PIPERIDINEA1K4Y0.73
SPZ(3S,3'S)-N~1~,N~1~'-butane-1,4-
diyldibutane-1,3-diamine
A,B3BNU0.78
PIPPIPERIDINEH1ETS0.74
PIPPIPERIDINEH1ETT0.74
PIPPIPERIDINEE,I1PPC0.74
PIPPIPERIDINEI1QUR0.74
PIPPIPERIDINEE1PPH0.74
B33N-ETHYL-N-[3-(PROPYLAMINO)PROPYL]PROPANE-
1,3-DIAMINE
A,B2B4B0.71
FXY1-METHYLHEPTYLFORMAMIDEA,B1U3W0.71
DIPDIPENTYLAMINEC,D1A1B0.85
DIPDIPENTYLAMINEC,D1A070.85
DIPDIPENTYLAMINEC,D1A1A0.85
DIPDIPENTYLAMINEC,D1A080.85
DIPDIPENTYLAMINEC,D1A090.85
2EP2-ETHYLPIPERIDINEH,I1A4W0.83
HAICYCLOHEXYLAMMONIUM IONA1NAW0.76
HAICYCLOHEXYLAMMONIUM IONA,B2H520.76
HAICYCLOHEXYLAMMONIUM IONA,B1EJD0.76
HAICYCLOHEXYLAMMONIUM IONA,B2HHJ0.76
DNH1R,2R-DIAMINOCYCLOHEXANEA,B1IHH0.71
CXFCYCLOHEXYLFORMAMIDEA,B1E3I0.73
CXFCYCLOHEXYLFORMAMIDEA,B,C,D1LDY0.73
NMH(R)-N-(1-METHYL-HEXYL)-FORMAMIDEA,B,C,D1P1R0.73
DIY5-BUTYLPIPERIDINEC,D1A1E0.71
SPJ(3R,3'R)-N~1~,N~1~'-butane-1,4-
diyldibutane-1,3-diamine
A,B3BNM0.78
LPTCIS-(AMMINE)(CYCLOHEXYLAMINE)PLATINUM(II) COMPLEXA,C1LU50.74
DREN-(6-AMINOHEXYL)HEXANE-1,6-DIAMINEA,B1Z6L0.82