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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00011199

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
DIY5-BUTYLPIPERIDINEC,D1A1E0.72
AMLAMYLAMINEA1JIR0.75
DIPDIPENTYLAMINEC,D1A1B1
DIPDIPENTYLAMINEC,D1A071
DIPDIPENTYLAMINEC,D1A1A1
DIPDIPENTYLAMINEC,D1A081
DIPDIPENTYLAMINEC,D1A091
TERN-(3-AMINO-PROPYL)-N-(5-AMINOPROPYL)-
1,4-DIAMINOBUTANE
A,B336D0.81
B33N-ETHYL-N-[3-(PROPYLAMINO)PROPYL]PROPANE-
1,3-DIAMINE
A,B2B4B0.83
SPWN,N'-BIS(3-AMMONIOPROPYL)BUTANE-
1,4-DIAMINIUM
A1V9G0.81
SPMSPERMINEA,B1RH00.81
SPMSPERMINEA1ICK0.81
SPMSPERMINEA,B,D198D0.81
SPMSPERMINEA,B1RGT0.81
SPMSPERMINEA,B1Y840.81
SPMSPERMINEA2O3Y0.81
SPMSPERMINEA100D0.81
SPMSPERMINEA,B,C,D3EUI0.81
SPMSPERMINEA,B1FQ20.81
SPMSPERMINEB320D0.81
SPMSPERMINEA,B,C,D1XPQ0.81
SPMSPERMINEA,B,C,D,E,F2C120.81
SPMSPERMINEA1M690.81
SPMSPERMINEA1WOE0.81
SPMSPERMINEA,B1DCR0.81
SPMSPERMINEA,B323D0.81
SPMSPERMINEA,B326D0.81
SPMSPERMINEA1D120.81
SPMSPERMINEA211D0.81
SPMSPERMINEA,B355D0.81
SPMSPERMINEA,B1XPF0.81
SPMSPERMINEA,B1I1P0.81
SPMSPERMINEA1DNS0.81
SPMSPERMINEA,B2B2B0.81
SPMSPERMINEA,B1RG10.81
SPMSPERMINEA,B,C,D258D0.81
SPMSPERMINEA,B1RFF0.81
SPMSPERMINEA,B1EI40.81
SPMSPERMINEB,D1F6C0.81
SPMSPERMINEA,B1Y8L0.81
SPMSPERMINEA,B1FUF0.81
SPMSPERMINEA,B2F8W0.81
SPMSPERMINEA,B131D0.81
SPMSPERMINEA,B,C,D,E,F,
G,H
1N7A0.81
SPMSPERMINEA1Z7I0.81
SPMSPERMINEA,B2RF30.81
SPMSPERMINEA,B324D0.81
SPMSPERMINEA,B1DPL0.81
SPMSPERMINEA,B1PWF0.81
SPMSPERMINEB2PL80.81
SPMSPERMINEA,B,C,D3BJ80.81
SPMSPERMINEA248D0.81
SPMSPERMINEA,B1RFI0.81
SPMSPERMINEA,B2B8J0.81
SPMSPERMINEA1D100.81
SPMSPERMINEA,B1RGU0.81
SPMSPERMINEA,B428D0.81
SPMSPERMINEA1D480.81
SPMSPERMINEA1I0T0.81
SPMSPERMINED1I2Y0.81
SPMSPERMINEA,B1RG20.81
SPMSPERMINEA,B1YB90.81
SPMSPERMINEA2TRA0.81
SPMSPERMINEA,B1VRO0.81
SPMSPERMINEA206D0.81
SPMSPERMINEB1OFX0.81
SPMSPERMINEA210D0.81
SPMSPERMINEA2GWA0.81
SPMSPERMINEA321D0.81
SPMSPERMINEA,B1S2R0.81
SPMSPERMINEA,B2DCG0.81
SPMSPERMINEA,B2GUN0.81
SPMSPERMINEB2PLB0.81
SPMSPERMINEA,B1EDR0.81
SPMSPERMINEA,B,C,D1J8G0.81
SPMSPERMINEA,B,C,D,E,F,
G,H
1N7B0.81
SPMSPERMINEA,B1Z5T0.81
SPMSPERMINEA1TN20.81
SPMSPERMINEA2D470.81
SPMSPERMINEA1EVV0.81
SPMSPERMINEA,B1XL60.81
SPMSPERMINEA,B410D0.81
SPMSPERMINEA1D150.81
SPMSPERMINEA,B,C3B7P0.81
SPMSPERMINEA,B,C,D3C6M0.81
MD2N,N'-BIS(2,3-BUTADIENYL)-1,4-BUTANE-
DIAMINE
A,B,C1B5Q0.74
SPJ(3R,3'R)-N~1~,N~1~'-butane-1,4-
diyldibutane-1,3-diamine
A,B3BNM0.79
SPETHERMINEA,B319D0.77
HPLHEPTYLFORMAMIDEA,B1U3V0.73
N3DN-methylpropane-1,3-diamineA,B3EY20.73
SPKSPERMINE (FULLY PROTONATED FORM)A,B1SE60.81
SPKSPERMINE (FULLY PROTONATED FORM)B1MG90.81
SPKSPERMINE (FULLY PROTONATED FORM)A1Y0Q0.81
SPKSPERMINE (FULLY PROTONATED FORM)A,B1KGK0.81
SPZ(3S,3'S)-N~1~,N~1~'-butane-1,4-
diyldibutane-1,3-diamine
A,B3BNU0.79
PIPPIPERIDINEH1ETS0.81
PIPPIPERIDINEH1ETT0.81
PIPPIPERIDINEE,I1PPC0.81
PIPPIPERIDINEI1QUR0.81
PIPPIPERIDINEE1PPH0.81
P241-(AMINOETHYL)AMINO-4-AMINOBUTANEB1O9M0.77
P241-(AMINOETHYL)AMINO-4-AMINOBUTANEA,B292D0.77
TEATRIETHYLAMMONIUM IONA1BD10.76
EPI4-ETHYLPIPERIDINEH,I1FPC0.74
A72TRANS-BIS(HEXYLAMINE)-(DIAMMINE) PLATINUM(II) COMPLEXA,B2DYW0.72
DREN-(6-AMINOHEXYL)HEXANE-1,6-DIAMINEA,B1Z6L0.9
2EP2-ETHYLPIPERIDINEH,I1A4W0.74
16DHEXANE-1,6-DIAMINEA,B,C2QK90.7
16DHEXANE-1,6-DIAMINEA,B,C,D,E,F1WOG0.7
DIXMETHYL(CYCLOPENTYL-PROPYL)AMINEC,D1A1C0.71
GC71-GUANIDINIUM-7-AMINOHEPTANEA,B1RQD0.74
SPDSPERMIDINE1,2,3,41POY0.8
SPDSPERMIDINEA,B3BXZ0.8
SPDSPERMIDINEA2ELG0.8
SPDSPERMIDINEA,B,C2PWP0.8
SPDSPERMIDINEA,B1BO40.8
SPDSPERMIDINEA,B,C,D3C6K0.8
SPDSPERMIDINEA,B2O070.8
SPDSPERMIDINEA2P1E0.8
SPDSPERMIDINEA,B293D0.8
SPDSPERMIDINEA,B1TYP0.8
SPDSPERMIDINEA,B,C,D2QBY0.8
SPDSPERMIDINEA,B3CN80.8
SPDSPERMIDINEA1U8D0.8
SPDSPERMIDINEA2P180.8
SPDSPERMIDINEA,B2HMP0.8
SPDSPERMIDINED1I2X0.8
SPDSPERMIDINEA1POT0.8