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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02454800

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
SPKSPERMINE (FULLY PROTONATED FORM)A,B1SE60.72
SPKSPERMINE (FULLY PROTONATED FORM)B1MG90.72
SPKSPERMINE (FULLY PROTONATED FORM)A1Y0Q0.72
SPKSPERMINE (FULLY PROTONATED FORM)A,B1KGK0.72
SPJ(3R,3'R)-N~1~,N~1~'-butane-1,4-
diyldibutane-1,3-diamine		A,B3BNM0.81
DMEDECAMETHONIUM IONA,B,C,D1MAA0.7
DMEDECAMETHONIUM IONA1ACL0.7
TBATETRABUTYLAMMONIUM IONI,L2BOB0.71
TBATETRABUTYLAMMONIUM IONA,C2DWD0.71
TBATETRABUTYLAMMONIUM IONA,C2HVJ0.71
TBATETRABUTYLAMMONIUM IONC2DWE0.71
TBATETRABUTYLAMMONIUM IONA,B1J950.71
TBATETRABUTYLAMMONIUM IONA,C2HVK0.71
TBATETRABUTYLAMMONIUM IONA1JVM0.71
TBATETRABUTYLAMMONIUM IONC2HJF0.71
TERN-(3-AMINO-PROPYL)-N-(5-AMINOPROPYL)-
1,4-DIAMINOBUTANE		A,B336D0.72
SPZ(3S,3'S)-N~1~,N~1~'-butane-1,4-
diyldibutane-1,3-diamine		A,B3BNU0.81
B33N-ETHYL-N-[3-(PROPYLAMINO)PROPYL]PROPANE-
1,3-DIAMINE		A,B2B4B0.74
2EP2-ETHYLPIPERIDINEH,I1A4W0.72
SPDSPERMIDINE1,2,3,41POY0.71
SPDSPERMIDINEA,B3BXZ0.71
SPDSPERMIDINEA2ELG0.71
SPDSPERMIDINEA,B,C2PWP0.71
SPDSPERMIDINEA,B1BO40.71
SPDSPERMIDINEA,B,C,D3C6K0.71
SPDSPERMIDINEA,B2O070.71
SPDSPERMIDINEA2P1E0.71
SPDSPERMIDINEA,B293D0.71
SPDSPERMIDINEA,B1TYP0.71
SPDSPERMIDINEA,B,C,D2QBY0.71
SPDSPERMIDINEA,B3CN80.71
SPDSPERMIDINEA1U8D0.71
SPDSPERMIDINEA2P180.71
SPDSPERMIDINEA,B2HMP0.71
SPDSPERMIDINED1I2X0.71
SPDSPERMIDINEA1POT0.71
DIPDIPENTYLAMINEC,D1A1B0.82
DIPDIPENTYLAMINEC,D1A070.82
DIPDIPENTYLAMINEC,D1A1A0.82
DIPDIPENTYLAMINEC,D1A080.82
DIPDIPENTYLAMINEC,D1A090.82
10ADIDECYL-DIMETHYL-AMMONIUMA,B,C,D1KPH0.7
10ADIDECYL-DIMETHYL-AMMONIUMA1KPI0.7
4PN4-PIPERIDINO-PIPERIDINEA1K4Y0.76
DREN-(6-AMINOHEXYL)HEXANE-1,6-DIAMINEA,B1Z6L0.8
SPWN,N'-BIS(3-AMMONIOPROPYL)BUTANE-
1,4-DIAMINIUM		A1V9G0.72
P2Y(2S)-PYRROLIDIN-2-YLMETHYLAMINEA,B,C,D1ORW0.72
SPMSPERMINEA,B1RH00.72
SPMSPERMINEA1ICK0.72
SPMSPERMINEA,B,D198D0.72
SPMSPERMINEA,B1RGT0.72
SPMSPERMINEA,B1Y840.72
SPMSPERMINEA2O3Y0.72
SPMSPERMINEA100D0.72
SPMSPERMINEA,B,C,D3EUI0.72
SPMSPERMINEA,B1FQ20.72
SPMSPERMINEB320D0.72
SPMSPERMINEA,B,C,D1XPQ0.72
SPMSPERMINEA,B,C,D,E,F2C120.72
SPMSPERMINEA1M690.72
SPMSPERMINEA1WOE0.72
SPMSPERMINEA,B1DCR0.72
SPMSPERMINEA,B323D0.72
SPMSPERMINEA,B326D0.72
SPMSPERMINEA1D120.72
SPMSPERMINEA211D0.72
SPMSPERMINEA,B355D0.72
SPMSPERMINEA,B1XPF0.72
SPMSPERMINEA,B1I1P0.72
SPMSPERMINEA1DNS0.72
SPMSPERMINEA,B2B2B0.72
SPMSPERMINEA,B1RG10.72
SPMSPERMINEA,B,C,D258D0.72
SPMSPERMINEA,B1RFF0.72
SPMSPERMINEA,B1EI40.72
SPMSPERMINEB,D1F6C0.72
SPMSPERMINEA,B1Y8L0.72
SPMSPERMINEA,B1FUF0.72
SPMSPERMINEA,B2F8W0.72
SPMSPERMINEA,B131D0.72
SPMSPERMINEA,B,C,D,E,F,
G,H		1N7A0.72
SPMSPERMINEA1Z7I0.72
SPMSPERMINEA,B2RF30.72
SPMSPERMINEA,B324D0.72
SPMSPERMINEA,B1DPL0.72
SPMSPERMINEA,B1PWF0.72
SPMSPERMINEB2PL80.72
SPMSPERMINEA,B,C,D3BJ80.72
SPMSPERMINEA248D0.72
SPMSPERMINEA,B1RFI0.72
SPMSPERMINEA,B2B8J0.72
SPMSPERMINEA1D100.72
SPMSPERMINEA,B1RGU0.72
SPMSPERMINEA,B428D0.72
SPMSPERMINEA1D480.72
SPMSPERMINEA1I0T0.72
SPMSPERMINED1I2Y0.72
SPMSPERMINEA,B1RG20.72
SPMSPERMINEA,B1YB90.72
SPMSPERMINEA2TRA0.72
SPMSPERMINEA,B1VRO0.72
SPMSPERMINEA206D0.72
SPMSPERMINEB1OFX0.72
SPMSPERMINEA210D0.72
SPMSPERMINEA2GWA0.72
SPMSPERMINEA321D0.72
SPMSPERMINEA,B1S2R0.72
SPMSPERMINEA,B2DCG0.72
SPMSPERMINEA,B2GUN0.72
SPMSPERMINEB2PLB0.72
SPMSPERMINEA,B1EDR0.72
SPMSPERMINEA,B,C,D1J8G0.72
SPMSPERMINEA,B,C,D,E,F,
G,H		1N7B0.72
SPMSPERMINEA,B1Z5T0.72
SPMSPERMINEA1TN20.72
SPMSPERMINEA2D470.72
SPMSPERMINEA1EVV0.72
SPMSPERMINEA,B1XL60.72
SPMSPERMINEA,B410D0.72
SPMSPERMINEA1D150.72
SPMSPERMINEA,B,C3B7P0.72
SPMSPERMINEA,B,C,D3C6M0.72