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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02438273

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
HHO1-(HYDROXYMETHYLENEAMINO)-8-HYDROXY-
OCTANE
I,J1AY60.8
DFU(2S,3R,4S,5R)-2-METHYLPIPERIDINE-
3,4,5-TRIOL
A,B2EAC0.8
PTOPSEUDOTROPINEA,B2AE20.76
XAOCYCLOHEXYLMETHYL-2,3-DIHYDROXY-
5-METHYL-HEXYLAMIDE
A1FQ60.72
XAOCYCLOHEXYLMETHYL-2,3-DIHYDROXY-
5-METHYL-HEXYLAMIDE
I,J1PSA0.72
XAOCYCLOHEXYLMETHYL-2,3-DIHYDROXY-
5-METHYL-HEXYLAMIDE
E,I1EPQ0.72
M1C(3S)-3-AMINO-1-(CYCLOPROPYLAMINO)HEPTANE-
2,2-DIOL
A1QXW0.7
MMN5-DEOXY-5-{[(1S)-1-HYDROXYETHYL]AMINO}-
D-GLUCITOL
A1XUZ0.7
AHS(3-AMINO-4-CYCLOHEXYL-2-HYDROXY-
BUTYL)-ISOBUTYL-CARBAMIC ACID
I5ER20.7
NBV(2R,3R,4R,5S)-1-BUTYL-2-(HYDROXYMETHYL)PIPERIDINE-
3,4,5-TRIOL
A,B2V3D0.7
NOJ1-DEOXYNOJIRIMYCINA,B1OIM0.75
NOJ1-DEOXYNOJIRIMYCINA,B2J770.75
NOJ1-DEOXYNOJIRIMYCINA,B2JKE0.75
NOJ1-DEOXYNOJIRIMYCINA3GBE0.75
NOJ1-DEOXYNOJIRIMYCINA,B3GXT0.75
NOJ1-DEOXYNOJIRIMYCINA,B1DIE0.75
NOJ1-DEOXYNOJIRIMYCINA1DOG0.75
NOJ1-DEOXYNOJIRIMYCINA,B1I750.75
NOJ1-DEOXYNOJIRIMYCINA,B2PWD0.75
DMJ1-DEOXYMANNOJIRIMYCINA,B1KRE0.75
DMJ1-DEOXYMANNOJIRIMYCINA1FO20.75
DMJ1-DEOXYMANNOJIRIMYCINA1G6I0.75
DMJ1-DEOXYMANNOJIRIMYCINA1HXK0.75
XDNPIPERIDINE-3,4,5-TRIOLA1V0K0.71
XDNPIPERIDINE-3,4,5-TRIOLA1V0M0.71
XDNPIPERIDINE-3,4,5-TRIOLA1FH70.71
XIFPIPERIDINE-3,4-DIOLA1V0L0.72
XIFPIPERIDINE-3,4-DIOLA1V0N0.72
XIFPIPERIDINE-3,4-DIOLA1FH80.72
NND(2R,3R,4R,5S)-2-(HYDROXYMETHYL)-
1-NONYLPIPERIDINE-3,4,5-TRIOL
A,B2V3E0.73