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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02230077

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
N3DN-methylpropane-1,3-diamineA,B3EY20.8
TEATRIETHYLAMMONIUM IONA1BD10.77
B33N-ETHYL-N-[3-(PROPYLAMINO)PROPYL]PROPANE-
1,3-DIAMINE		A,B2B4B0.9
TERN-(3-AMINO-PROPYL)-N-(5-AMINOPROPYL)-
1,4-DIAMINOBUTANE		A,B336D0.87
SP5N-[3-({4-[(3-aminopropyl)amino]butyl}amino)propyl]acetamideA,B3CND0.72
SPWN,N'-BIS(3-AMMONIOPROPYL)BUTANE-
1,4-DIAMINIUM		A1V9G0.87
PAWN-(2-AMINOETHYL)-N'-{2-[(2-AMINOETHYL)AMINO]ETHYL}ETHANE-
1,2-DIAMINE		A,B2IE10.75
SPMSPERMINEA,B1RH00.87
SPMSPERMINEA1ICK0.87
SPMSPERMINEA,B,D198D0.87
SPMSPERMINEA,B1RGT0.87
SPMSPERMINEA,B1Y840.87
SPMSPERMINEA2O3Y0.87
SPMSPERMINEA100D0.87
SPMSPERMINEA,B,C,D3EUI0.87
SPMSPERMINEA,B1FQ20.87
SPMSPERMINEB320D0.87
SPMSPERMINEA,B,C,D1XPQ0.87
SPMSPERMINEA,B,C,D,E,F2C120.87
SPMSPERMINEA1M690.87
SPMSPERMINEA1WOE0.87
SPMSPERMINEA,B1DCR0.87
SPMSPERMINEA,B323D0.87
SPMSPERMINEA,B326D0.87
SPMSPERMINEA1D120.87
SPMSPERMINEA211D0.87
SPMSPERMINEA,B355D0.87
SPMSPERMINEA,B1XPF0.87
SPMSPERMINEA,B1I1P0.87
SPMSPERMINEA1DNS0.87
SPMSPERMINEA,B2B2B0.87
SPMSPERMINEA,B1RG10.87
SPMSPERMINEA,B,C,D258D0.87
SPMSPERMINEA,B1RFF0.87
SPMSPERMINEA,B1EI40.87
SPMSPERMINEB,D1F6C0.87
SPMSPERMINEA,B1Y8L0.87
SPMSPERMINEA,B1FUF0.87
SPMSPERMINEA,B2F8W0.87
SPMSPERMINEA,B131D0.87
SPMSPERMINEA,B,C,D,E,F,
G,H		1N7A0.87
SPMSPERMINEA1Z7I0.87
SPMSPERMINEA,B2RF30.87
SPMSPERMINEA,B324D0.87
SPMSPERMINEA,B1DPL0.87
SPMSPERMINEA,B1PWF0.87
SPMSPERMINEB2PL80.87
SPMSPERMINEA,B,C,D3BJ80.87
SPMSPERMINEA248D0.87
SPMSPERMINEA,B1RFI0.87
SPMSPERMINEA,B2B8J0.87
SPMSPERMINEA1D100.87
SPMSPERMINEA,B1RGU0.87
SPMSPERMINEA,B428D0.87
SPMSPERMINEA1D480.87
SPMSPERMINEA1I0T0.87
SPMSPERMINED1I2Y0.87
SPMSPERMINEA,B1RG20.87
SPMSPERMINEA,B1YB90.87
SPMSPERMINEA2TRA0.87
SPMSPERMINEA,B1VRO0.87
SPMSPERMINEA206D0.87
SPMSPERMINEB1OFX0.87
SPMSPERMINEA210D0.87
SPMSPERMINEA2GWA0.87
SPMSPERMINEA321D0.87
SPMSPERMINEA,B1S2R0.87
SPMSPERMINEA,B2DCG0.87
SPMSPERMINEA,B2GUN0.87
SPMSPERMINEB2PLB0.87
SPMSPERMINEA,B1EDR0.87
SPMSPERMINEA,B,C,D1J8G0.87
SPMSPERMINEA,B,C,D,E,F,
G,H		1N7B0.87
SPMSPERMINEA,B1Z5T0.87
SPMSPERMINEA1TN20.87
SPMSPERMINEA2D470.87
SPMSPERMINEA1EVV0.87
SPMSPERMINEA,B1XL60.87
SPMSPERMINEA,B410D0.87
SPMSPERMINEA1D150.87
SPMSPERMINEA,B,C3B7P0.87
SPMSPERMINEA,B,C,D3C6M0.87
SPZ(3S,3'S)-N~1~,N~1~'-butane-1,4-
diyldibutane-1,3-diamine		A,B3BNU0.85
104N,N'-BIS(2-AMINOETHYL)-1,2-ETHANEDIAMINEA,B1DJ60.72
DREN-(6-AMINOHEXYL)HEXANE-1,6-DIAMINEA,B1Z6L0.74
SPETHERMINEA,B319D0.9
SPKSPERMINE (FULLY PROTONATED FORM)A,B1SE60.87
SPKSPERMINE (FULLY PROTONATED FORM)B1MG90.87
SPKSPERMINE (FULLY PROTONATED FORM)A1Y0Q0.87
SPKSPERMINE (FULLY PROTONATED FORM)A,B1KGK0.87
SPJ(3R,3'R)-N~1~,N~1~'-butane-1,4-
diyldibutane-1,3-diamine		A,B3BNM0.85
DIPDIPENTYLAMINEC,D1A1B0.76
DIPDIPENTYLAMINEC,D1A070.76
DIPDIPENTYLAMINEC,D1A1A0.76
DIPDIPENTYLAMINEC,D1A080.76
DIPDIPENTYLAMINEC,D1A090.76
SPDSPERMIDINE1,2,3,41POY0.81
SPDSPERMIDINEA,B3BXZ0.81
SPDSPERMIDINEA2ELG0.81
SPDSPERMIDINEA,B,C2PWP0.81
SPDSPERMIDINEA,B1BO40.81
SPDSPERMIDINEA,B,C,D3C6K0.81
SPDSPERMIDINEA,B2O070.81
SPDSPERMIDINEA2P1E0.81
SPDSPERMIDINEA,B293D0.81
SPDSPERMIDINEA,B1TYP0.81
SPDSPERMIDINEA,B,C,D2QBY0.81
SPDSPERMIDINEA,B3CN80.81
SPDSPERMIDINEA1U8D0.81
SPDSPERMIDINEA2P180.81
SPDSPERMIDINEA,B2HMP0.81
SPDSPERMIDINED1I2X0.81
SPDSPERMIDINEA1POT0.81
P241-(AMINOETHYL)AMINO-4-AMINOBUTANEB1O9M0.73
P241-(AMINOETHYL)AMINO-4-AMINOBUTANEA,B292D0.73
DIB3-AMINO-(DIMETHYLPROPYLAMINE)A,D,E,G,I,J1S320.8
DIB3-AMINO-(DIMETHYLPROPYLAMINE)E,I,J1M1A0.8
DIB3-AMINO-(DIMETHYLPROPYLAMINE)D,I,J1M180.8
DIB3-AMINO-(DIMETHYLPROPYLAMINE)E,I,J1M190.8