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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03503464

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
KDD2,6-anhydro-3,5-dideoxy-D-ribo-
oct-2-enonic acid
A,B2R1X0.7
HNE(2E,4R)-4-HYDROXYNON-2-ENALA,B2J3K0.77
KDB3,4,5-trideoxy-alpha-D-erythro-
oct-3-en-2-ulopyranosonic acid
A,B3BPC0.7
KDB3,4,5-trideoxy-alpha-D-erythro-
oct-3-en-2-ulopyranosonic acid
A,B2R1W0.7
6OB(8E,10S,12Z)-10-hydroxy-6-oxooctadeca-
8,12-dienoic acid
A,B2VV40.72
5HE(5R,6E,8Z,11Z,14Z,17Z)-5-hydroxyicosa-
6,8,11,14,17-pentaenoic acid
A,B2VV20.71
6OC(8R,9Z,12Z)-8-hydroxy-6-oxooctadeca-
9,12-dienoic acid
A,B2VV40.71
4HD(4S,5E,7Z,10Z,13Z,16Z,19Z)-4-hydroxydocosa-
5,7,10,13,16,19-hexaenoic acid
A,B2VV10.75
MUC[(2S)-5-oxo-2,5-dihydrofuran-2-
yl]acetic acid
A3DG60.72
MUC[(2S)-5-oxo-2,5-dihydrofuran-2-
yl]acetic acid
A3DGB0.72
MUC[(2S)-5-oxo-2,5-dihydrofuran-2-
yl]acetic acid
A,B3FJ40.72
MUC[(2S)-5-oxo-2,5-dihydrofuran-2-
yl]acetic acid
A,B,C,D3DG70.72
9OH(TRANS-12,13-EPOXY)-9-HYDROXY-10(E)-
OCTADECENOIC ACID
A1IK30.76
AFB1,6,7,8,9,11A,12,13,14,14A-DECAHYDRO-
1,13-DIHYDROXY-6-METHYL-4H-CYCLOPENT[F]OXACYCLOTRIDECIN-
4-ONE
A,B,E1R8Q0.8
AFB1,6,7,8,9,11A,12,13,14,14A-DECAHYDRO-
1,13-DIHYDROXY-6-METHYL-4H-CYCLOPENT[F]OXACYCLOTRIDECIN-
4-ONE
A1RE00.8
AFB1,6,7,8,9,11A,12,13,14,14A-DECAHYDRO-
1,13-DIHYDROXY-6-METHYL-4H-CYCLOPENT[F]OXACYCLOTRIDECIN-
4-ONE
A,E1S9D0.8
E2PPROSTAGLANDIN B2A1CZ20.73