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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00018324

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
PAWN-(2-AMINOETHYL)-N'-{2-[(2-AMINOETHYL)AMINO]ETHYL}ETHANE-
1,2-DIAMINE
A,B2IE11
104N,N'-BIS(2-AMINOETHYL)-1,2-ETHANEDIAMINEA,B1DJ60.96
P241-(AMINOETHYL)AMINO-4-AMINOBUTANEB1O9M0.83
P241-(AMINOETHYL)AMINO-4-AMINOBUTANEA,B292D0.83
SPETHERMINEA,B319D0.83
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
TERN-(3-AMINO-PROPYL)-N-(5-AMINOPROPYL)-
1,4-DIAMINOBUTANE
A,B336D0.8
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
B33N-ETHYL-N-[3-(PROPYLAMINO)PROPYL]PROPANE-
1,3-DIAMINE
A,B2B4B0.77
TEATRIETHYLAMMONIUM IONA1BD10.75
SPZ(3S,3'S)-N~1~,N~1~'-butane-1,4-
diyldibutane-1,3-diamine
A,B3BNU0.73
SPDSPERMIDINE1,2,3,41POY0.73
SPDSPERMIDINEA,B3BXZ0.73
SPDSPERMIDINEA2ELG0.73
SPDSPERMIDINEA,B,C2PWP0.73
SPDSPERMIDINEA,B1BO40.73
SPDSPERMIDINEA,B,C,D3C6K0.73
SPDSPERMIDINEA,B2O070.73
SPDSPERMIDINEA2P1E0.73
SPDSPERMIDINEA,B293D0.73
SPDSPERMIDINEA,B1TYP0.73
SPDSPERMIDINEA,B,C,D2QBY0.73
SPDSPERMIDINEA,B3CN80.73
SPDSPERMIDINEA1U8D0.73
SPDSPERMIDINEA2P180.73
SPDSPERMIDINEA,B2HMP0.73
SPDSPERMIDINED1I2X0.73
SPDSPERMIDINEA1POT0.73
SPJ(3R,3'R)-N~1~,N~1~'-butane-1,4-
diyldibutane-1,3-diamine
A,B3BNM0.73
DREN-(6-AMINOHEXYL)HEXANE-1,6-DIAMINEA,B1Z6L0.72