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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00021659

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
B33N-ETHYL-N-[3-(PROPYLAMINO)PROPYL]PROPANE-
1,3-DIAMINE		A,B2B4B0.8
DIPDIPENTYLAMINEC,D1A1B0.77
DIPDIPENTYLAMINEC,D1A070.77
DIPDIPENTYLAMINEC,D1A1A0.77
DIPDIPENTYLAMINEC,D1A080.77
DIPDIPENTYLAMINEC,D1A090.77
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
DR8N,N,N-TRIMETHYLHEPTA-1,3,5-TRIYN-
1-AMINIUM		A2ASC0.7
SPETHERMINEA,B319D0.74
DIB3-AMINO-(DIMETHYLPROPYLAMINE)A,D,E,G,I,J1S320.7
DIB3-AMINO-(DIMETHYLPROPYLAMINE)E,I,J1M1A0.7
DIB3-AMINO-(DIMETHYLPROPYLAMINE)D,I,J1M180.7
DIB3-AMINO-(DIMETHYLPROPYLAMINE)E,I,J1M190.7
SPJ(3R,3'R)-N~1~,N~1~'-butane-1,4-
diyldibutane-1,3-diamine		A,B3BNM0.71
TEATRIETHYLAMMONIUM IONA1BD10.85
TERN-(3-AMINO-PROPYL)-N-(5-AMINOPROPYL)-
1,4-DIAMINOBUTANE		A,B336D0.72
PAWN-(2-AMINOETHYL)-N'-{2-[(2-AMINOETHYL)AMINO]ETHYL}ETHANE-
1,2-DIAMINE		A,B2IE10.71
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
SPZ(3S,3'S)-N~1~,N~1~'-butane-1,4-
diyldibutane-1,3-diamine		A,B3BNU0.71
N3DN-methylpropane-1,3-diamineA,B3EY20.7
ETNMETHYLETHYLAMINEA1TES0.7
NETTETRAETHYLAMMONIUM IONA,B,C,D,E,F,
G,H		1CE80.7
NETTETRAETHYLAMMONIUM IONB,C,E,F,H,I,
K,L		1JDB0.7
NETTETRAETHYLAMMONIUM IONA,B,C,D,E,G,H1BXR0.7
NETTETRAETHYLAMMONIUM IONA,B,C,D,E,F,
G,H		1KEE0.7
NETTETRAETHYLAMMONIUM IONA,B,C,D,E,F,
G,H		1C300.7
NETTETRAETHYLAMMONIUM IONA,B,C,D,E,F,
G,H		1T360.7
NETTETRAETHYLAMMONIUM IONA,B,C,D,E,F,
G,H		1C3O0.7
NETTETRAETHYLAMMONIUM IONA,B,C,D,E,F,
G,H		1A9X0.7
NETTETRAETHYLAMMONIUM IONA,B,C,D,E,F,
G,H		1CS00.7
NETTETRAETHYLAMMONIUM IONA,B,C,D,E,F,
G,H		1M6V0.7
SPWN,N'-BIS(3-AMMONIOPROPYL)BUTANE-
1,4-DIAMINIUM		A1V9G0.72
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