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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03410445

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
9MR(3R,4R,5R)-3-HYDROXY-5-(HYDROXYMETHYL)PIPERIDIN-
4-YL BETA-D-GLUCOPYRANOSIDE
A3CUF0.75
9MR(3R,4R,5R)-3-HYDROXY-5-(HYDROXYMETHYL)PIPERIDIN-
4-YL BETA-D-GLUCOPYRANOSIDE
A,B2OYK0.75
ISXGLUCOSE BETA-1,3-ISOFAGAMINEA2BVD0.74
IFM5-HYDROXYMETHYL-3,4-DIHYDROXYPIPERIDINEA1UP20.76
IFM5-HYDROXYMETHYL-3,4-DIHYDROXYPIPERIDINEA,B,C,D3GXF0.76
IFM5-HYDROXYMETHYL-3,4-DIHYDROXYPIPERIDINEA1OCN0.76
IFM5-HYDROXYMETHYL-3,4-DIHYDROXYPIPERIDINEA,B,C,D2NSX0.76
IFM5-HYDROXYMETHYL-3,4-DIHYDROXYPIPERIDINEA,B1OIF0.76
IFM5-HYDROXYMETHYL-3,4-DIHYDROXYPIPERIDINEA1OCQ0.76
IFM5-HYDROXYMETHYL-3,4-DIHYDROXYPIPERIDINEA2G9V0.76
NBV(2R,3R,4R,5S)-1-BUTYL-2-(HYDROXYMETHYL)PIPERIDINE-
3,4,5-TRIOL
A,B2V3D0.79
DMJ1-DEOXYMANNOJIRIMYCINA,B1KRE0.83
DMJ1-DEOXYMANNOJIRIMYCINA1FO20.83
DMJ1-DEOXYMANNOJIRIMYCINA1G6I0.83
DMJ1-DEOXYMANNOJIRIMYCINA1HXK0.83
NOJ1-DEOXYNOJIRIMYCINA,B1OIM0.83
NOJ1-DEOXYNOJIRIMYCINA,B2J770.83
NOJ1-DEOXYNOJIRIMYCINA,B2JKE0.83
NOJ1-DEOXYNOJIRIMYCINA3GBE0.83
NOJ1-DEOXYNOJIRIMYCINA,B3GXT0.83
NOJ1-DEOXYNOJIRIMYCINA,B1DIE0.83
NOJ1-DEOXYNOJIRIMYCINA1DOG0.83
NOJ1-DEOXYNOJIRIMYCINA,B1I750.83
NOJ1-DEOXYNOJIRIMYCINA,B2PWD0.83
NND(2R,3R,4R,5S)-2-(HYDROXYMETHYL)-
1-NONYLPIPERIDINE-3,4,5-TRIOL
A,B2V3E0.81
G2I(3R,4R,5R)-3-hydroxy-5-(hydroxymethyl)piperidin-
4-yl 4-O-beta-D-glucopyranosyl-
beta-D-glucopyranoside
A3CUH0.71
CTSCASTANOSPERMINEA1EQC0.72
CTSCASTANOSPERMINEA,B2JKP0.72
CTSCASTANOSPERMINEA,B,C2VL80.72
CTSCASTANOSPERMINEA,B2CBU0.72
CTSCASTANOSPERMINEA,B2PWG0.72
CHK6-[(CYCLOHEXYLACETYL)(2-HYDROXYETHYL)AMINO]-
6-DEOXY-D-XYLO-HEXITOL
B1Y010.71
17B(2Z,3R,4S,5R,6R)-2-[(4-aminobutyl)imino]-
6-(hydroxymethyl)piperidine-3,4,5-
triol
A,B2VR40.72
GACDIHYDRO-ACARBOSEA1GAI0.7
MNM(2S,3S,4R,5R)-2,3,4-TRIHYDROXY-
5-HYDROXYMETHYL-PIPERIDINE
A2ALW0.78
DFU(2S,3R,4S,5R)-2-METHYLPIPERIDINE-
3,4,5-TRIOL
A,B2EAC0.74
A164-O-(4,6-dideoxy-4-{[(1S,2S,3S,4R,5S)-
2,3,4-trihydroxy-5-(hydroxymethyl)cyclohexyl]amino}-
alpha-D-glucopyranosyl)-beta-D-
glucopyranose
A,B2VR50.73
MMN5-DEOXY-5-{[(1S)-1-HYDROXYETHYL]AMINO}-
D-GLUCITOL
A1XUZ0.76
CGBCALYSTEGINE B2A,B2CBV0.74
15A(2Z,3R,4S,5R,6R)-2-[(2-aminoethyl)imino]-
6-(hydroxymethyl)piperidine-3,4,5-
triol
A,B2VQT0.71
ABL6-HYDROXYMETHYL-5-(3,4,5-TRIHYDROXY-
6-HYDROXYMETHYL-TETRAHYDRO-PYRAN-
2-YLOXY)-PIPERIDINE-2,3,4-TRIOL
A,B1NAA0.71
ABL6-HYDROXYMETHYL-5-(3,4,5-TRIHYDROXY-
6-HYDROXYMETHYL-TETRAHYDRO-PYRAN-
2-YLOXY)-PIPERIDINE-2,3,4-TRIOL
A2AXR0.71
AHS(3-AMINO-4-CYCLOHEXYL-2-HYDROXY-
BUTYL)-ISOBUTYL-CARBAMIC ACID
I5ER20.71