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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00009988

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
SPMSPERMINEA,B1RH00.8
SPMSPERMINEA1ICK0.8
SPMSPERMINEA,B,D198D0.8
SPMSPERMINEA,B1RGT0.8
SPMSPERMINEA,B1Y840.8
SPMSPERMINEA2O3Y0.8
SPMSPERMINEA100D0.8
SPMSPERMINEA,B,C,D3EUI0.8
SPMSPERMINEA,B1FQ20.8
SPMSPERMINEB320D0.8
SPMSPERMINEA,B,C,D1XPQ0.8
SPMSPERMINEA,B,C,D,E,F2C120.8
SPMSPERMINEA1M690.8
SPMSPERMINEA1WOE0.8
SPMSPERMINEA,B1DCR0.8
SPMSPERMINEA,B323D0.8
SPMSPERMINEA,B326D0.8
SPMSPERMINEA1D120.8
SPMSPERMINEA211D0.8
SPMSPERMINEA,B355D0.8
SPMSPERMINEA,B1XPF0.8
SPMSPERMINEA,B1I1P0.8
SPMSPERMINEA1DNS0.8
SPMSPERMINEA,B2B2B0.8
SPMSPERMINEA,B1RG10.8
SPMSPERMINEA,B,C,D258D0.8
SPMSPERMINEA,B1RFF0.8
SPMSPERMINEA,B1EI40.8
SPMSPERMINEB,D1F6C0.8
SPMSPERMINEA,B1Y8L0.8
SPMSPERMINEA,B1FUF0.8
SPMSPERMINEA,B2F8W0.8
SPMSPERMINEA,B131D0.8
SPMSPERMINEA,B,C,D,E,F,
G,H
1N7A0.8
SPMSPERMINEA1Z7I0.8
SPMSPERMINEA,B2RF30.8
SPMSPERMINEA,B324D0.8
SPMSPERMINEA,B1DPL0.8
SPMSPERMINEA,B1PWF0.8
SPMSPERMINEB2PL80.8
SPMSPERMINEA,B,C,D3BJ80.8
SPMSPERMINEA248D0.8
SPMSPERMINEA,B1RFI0.8
SPMSPERMINEA,B2B8J0.8
SPMSPERMINEA1D100.8
SPMSPERMINEA,B1RGU0.8
SPMSPERMINEA,B428D0.8
SPMSPERMINEA1D480.8
SPMSPERMINEA1I0T0.8
SPMSPERMINED1I2Y0.8
SPMSPERMINEA,B1RG20.8
SPMSPERMINEA,B1YB90.8
SPMSPERMINEA2TRA0.8
SPMSPERMINEA,B1VRO0.8
SPMSPERMINEA206D0.8
SPMSPERMINEB1OFX0.8
SPMSPERMINEA210D0.8
SPMSPERMINEA2GWA0.8
SPMSPERMINEA321D0.8
SPMSPERMINEA,B1S2R0.8
SPMSPERMINEA,B2DCG0.8
SPMSPERMINEA,B2GUN0.8
SPMSPERMINEB2PLB0.8
SPMSPERMINEA,B1EDR0.8
SPMSPERMINEA,B,C,D1J8G0.8
SPMSPERMINEA,B,C,D,E,F,
G,H
1N7B0.8
SPMSPERMINEA,B1Z5T0.8
SPMSPERMINEA1TN20.8
SPMSPERMINEA2D470.8
SPMSPERMINEA1EVV0.8
SPMSPERMINEA,B1XL60.8
SPMSPERMINEA,B410D0.8
SPMSPERMINEA1D150.8
SPMSPERMINEA,B,C3B7P0.8
SPMSPERMINEA,B,C,D3C6M0.8
SPWN,N'-BIS(3-AMMONIOPROPYL)BUTANE-
1,4-DIAMINIUM
A1V9G0.8
DREN-(6-AMINOHEXYL)HEXANE-1,6-DIAMINEA,B1Z6L0.77
TBATETRABUTYLAMMONIUM IONI,L2BOB0.72
TBATETRABUTYLAMMONIUM IONA,C2DWD0.72
TBATETRABUTYLAMMONIUM IONA,C2HVJ0.72
TBATETRABUTYLAMMONIUM IONC2DWE0.72
TBATETRABUTYLAMMONIUM IONA,B1J950.72
TBATETRABUTYLAMMONIUM IONA,C2HVK0.72
TBATETRABUTYLAMMONIUM IONA1JVM0.72
TBATETRABUTYLAMMONIUM IONC2HJF0.72
SPZ(3S,3'S)-N~1~,N~1~'-butane-1,4-
diyldibutane-1,3-diamine
A,B3BNU0.78
DIPDIPENTYLAMINEC,D1A1B0.86
DIPDIPENTYLAMINEC,D1A070.86
DIPDIPENTYLAMINEC,D1A1A0.86
DIPDIPENTYLAMINEC,D1A080.86
DIPDIPENTYLAMINEC,D1A090.86
PAWN-(2-AMINOETHYL)-N'-{2-[(2-AMINOETHYL)AMINO]ETHYL}ETHANE-
1,2-DIAMINE
A,B2IE10.73
104N,N'-BIS(2-AMINOETHYL)-1,2-ETHANEDIAMINEA,B1DJ60.7
TERN-(3-AMINO-PROPYL)-N-(5-AMINOPROPYL)-
1,4-DIAMINOBUTANE
A,B336D0.8
N3DN-methylpropane-1,3-diamineA,B3EY20.79
MD2N,N'-BIS(2,3-BUTADIENYL)-1,4-BUTANE-
DIAMINE
A,B,C1B5Q0.73
B33N-ETHYL-N-[3-(PROPYLAMINO)PROPYL]PROPANE-
1,3-DIAMINE
A,B2B4B0.89
SPDSPERMIDINE1,2,3,41POY0.79
SPDSPERMIDINEA,B3BXZ0.79
SPDSPERMIDINEA2ELG0.79
SPDSPERMIDINEA,B,C2PWP0.79
SPDSPERMIDINEA,B1BO40.79
SPDSPERMIDINEA,B,C,D3C6K0.79
SPDSPERMIDINEA,B2O070.79
SPDSPERMIDINEA2P1E0.79
SPDSPERMIDINEA,B293D0.79
SPDSPERMIDINEA,B1TYP0.79
SPDSPERMIDINEA,B,C,D2QBY0.79
SPDSPERMIDINEA,B3CN80.79
SPDSPERMIDINEA1U8D0.79
SPDSPERMIDINEA2P180.79
SPDSPERMIDINEA,B2HMP0.79
SPDSPERMIDINED1I2X0.79
SPDSPERMIDINEA1POT0.79
ETNMETHYLETHYLAMINEA1TES0.73
DIB3-AMINO-(DIMETHYLPROPYLAMINE)A,D,E,G,I,J1S320.79
DIB3-AMINO-(DIMETHYLPROPYLAMINE)E,I,J1M1A0.79
DIB3-AMINO-(DIMETHYLPROPYLAMINE)D,I,J1M180.79
DIB3-AMINO-(DIMETHYLPROPYLAMINE)E,I,J1M190.79
P241-(AMINOETHYL)AMINO-4-AMINOBUTANEB1O9M0.77
P241-(AMINOETHYL)AMINO-4-AMINOBUTANEA,B292D0.77
TEATRIETHYLAMMONIUM IONA1BD10.88
SPETHERMINEA,B319D0.83
NETTETRAETHYLAMMONIUM IONA,B,C,D,E,F,
G,H
1CE80.73
NETTETRAETHYLAMMONIUM IONB,C,E,F,H,I,
K,L
1JDB0.73
NETTETRAETHYLAMMONIUM IONA,B,C,D,E,G,H1BXR0.73
NETTETRAETHYLAMMONIUM IONA,B,C,D,E,F,
G,H
1KEE0.73
NETTETRAETHYLAMMONIUM IONA,B,C,D,E,F,
G,H
1C300.73
NETTETRAETHYLAMMONIUM IONA,B,C,D,E,F,
G,H
1T360.73
NETTETRAETHYLAMMONIUM IONA,B,C,D,E,F,
G,H
1C3O0.73
NETTETRAETHYLAMMONIUM IONA,B,C,D,E,F,
G,H
1A9X0.73
NETTETRAETHYLAMMONIUM IONA,B,C,D,E,F,
G,H
1CS00.73
NETTETRAETHYLAMMONIUM IONA,B,C,D,E,F,
G,H
1M6V0.73
SPJ(3R,3'R)-N~1~,N~1~'-butane-1,4-
diyldibutane-1,3-diamine
A,B3BNM0.78
SPKSPERMINE (FULLY PROTONATED FORM)A,B1SE60.8
SPKSPERMINE (FULLY PROTONATED FORM)B1MG90.8
SPKSPERMINE (FULLY PROTONATED FORM)A1Y0Q0.8
SPKSPERMINE (FULLY PROTONATED FORM)A,B1KGK0.8