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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03213770

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
5AX2-(ACETYLAMINO)-1,5-ANHYDRO-2-DEOXY-
D-GLUCITOL		A2JCQ0.7
5AX2-(ACETYLAMINO)-1,5-ANHYDRO-2-DEOXY-
D-GLUCITOL		A,B2IH90.7
5AX2-(ACETYLAMINO)-1,5-ANHYDRO-2-DEOXY-
D-GLUCITOL		A,B,C,D,E,F2J2P0.7
5AX2-(ACETYLAMINO)-1,5-ANHYDRO-2-DEOXY-
D-GLUCITOL		A3DIV0.7
SWA1S-8AB-OCTAHYDRO-INDOLIZIDINE-1A,2A,8B-
TRIOL		A1HWW0.74
SWA1S-8AB-OCTAHYDRO-INDOLIZIDINE-1A,2A,8B-
TRIOL		A3BLB0.74
HQ6N-[(3R,4S,5R,6R,7R)-3,5,6-trihydroxy-
7-(hydroxymethyl)azepan-4-yl]acetamide		A,B2W660.7
GTL(2E,3R,4R,5R,6S)-3,4,5-TRIHYDROXY-
6-(HYDROXYMETHYL)-2-PIPERIDINONE		A,B2J790.71
GTL(2E,3R,4R,5R,6S)-3,4,5-TRIHYDROXY-
6-(HYDROXYMETHYL)-2-PIPERIDINONE		A,B1UWT0.71
IFM5-HYDROXYMETHYL-3,4-DIHYDROXYPIPERIDINEA1UP20.71
IFM5-HYDROXYMETHYL-3,4-DIHYDROXYPIPERIDINEA,B,C,D3GXF0.71
IFM5-HYDROXYMETHYL-3,4-DIHYDROXYPIPERIDINEA1OCN0.71
IFM5-HYDROXYMETHYL-3,4-DIHYDROXYPIPERIDINEA,B,C,D2NSX0.71
IFM5-HYDROXYMETHYL-3,4-DIHYDROXYPIPERIDINEA,B1OIF0.71
IFM5-HYDROXYMETHYL-3,4-DIHYDROXYPIPERIDINEA1OCQ0.71
IFM5-HYDROXYMETHYL-3,4-DIHYDROXYPIPERIDINEA2G9V0.71
GOX(2S,3S,4R,5R)-6-(HYDROXYAMINO)-
2-(HYDROXYMETHYL)-2,3,4,5-TETRAHYDROPYRIDINE-
3,4,5-TRIOL		A,B1UWU0.71
GOX(2S,3S,4R,5R)-6-(HYDROXYAMINO)-
2-(HYDROXYMETHYL)-2,3,4,5-TETRAHYDROPYRIDINE-
3,4,5-TRIOL		A3D510.71
GOX(2S,3S,4R,5R)-6-(HYDROXYAMINO)-
2-(HYDROXYMETHYL)-2,3,4,5-TETRAHYDROPYRIDINE-
3,4,5-TRIOL		A1U300.71
GOX(2S,3S,4R,5R)-6-(HYDROXYAMINO)-
2-(HYDROXYMETHYL)-2,3,4,5-TETRAHYDROPYRIDINE-
3,4,5-TRIOL		M1E720.71
GOX(2S,3S,4R,5R)-6-(HYDROXYAMINO)-
2-(HYDROXYMETHYL)-2,3,4,5-TETRAHYDROPYRIDINE-
3,4,5-TRIOL		A,B2J780.71
GOX(2S,3S,4R,5R)-6-(HYDROXYAMINO)-
2-(HYDROXYMETHYL)-2,3,4,5-TETRAHYDROPYRIDINE-
3,4,5-TRIOL		A1U2Y0.71
GOX(2S,3S,4R,5R)-6-(HYDROXYAMINO)-
2-(HYDROXYMETHYL)-2,3,4,5-TETRAHYDROPYRIDINE-
3,4,5-TRIOL		M,N1E6S0.71
NCW(1S,2R,3S,4R,5R)-2,3,4-trihydroxy-
N-octyl-6-oxa-8-azabicyclo[3.2.1]octane-
8-carbothioamide		A,B2VRJ0.72
DFU(2S,3R,4S,5R)-2-METHYLPIPERIDINE-
3,4,5-TRIOL		A,B2EAC0.76
ABL6-HYDROXYMETHYL-5-(3,4,5-TRIHYDROXY-
6-HYDROXYMETHYL-TETRAHYDRO-PYRAN-
2-YLOXY)-PIPERIDINE-2,3,4-TRIOL		A,B1NAA0.72
ABL6-HYDROXYMETHYL-5-(3,4,5-TRIHYDROXY-
6-HYDROXYMETHYL-TETRAHYDRO-PYRAN-
2-YLOXY)-PIPERIDINE-2,3,4-TRIOL		A2AXR0.72
CTSCASTANOSPERMINEA1EQC0.78
CTSCASTANOSPERMINEA,B2JKP0.78
CTSCASTANOSPERMINEA,B,C2VL80.78
CTSCASTANOSPERMINEA,B2CBU0.78
CTSCASTANOSPERMINEA,B2PWG0.78
NOZ(2S,3S,4R,5R)-5-(hydroxymethyl)piperidine-
2,3,4-triol		A,B2VL40.75
XDNPIPERIDINE-3,4,5-TRIOLA1V0K0.72
XDNPIPERIDINE-3,4,5-TRIOLA1V0M0.72
XDNPIPERIDINE-3,4,5-TRIOLA1FH70.72
NEB2-DEOXY-D-STREPTAMINEA1NEM0.7
NOJ1-DEOXYNOJIRIMYCINA,B1OIM0.85
NOJ1-DEOXYNOJIRIMYCINA,B2J770.85
NOJ1-DEOXYNOJIRIMYCINA,B2JKE0.85
NOJ1-DEOXYNOJIRIMYCINA3GBE0.85
NOJ1-DEOXYNOJIRIMYCINA,B3GXT0.85
NOJ1-DEOXYNOJIRIMYCINA,B1DIE0.85
NOJ1-DEOXYNOJIRIMYCINA1DOG0.85
NOJ1-DEOXYNOJIRIMYCINA,B1I750.85
NOJ1-DEOXYNOJIRIMYCINA,B2PWD0.85
DMJ1-DEOXYMANNOJIRIMYCINA,B1KRE0.85
DMJ1-DEOXYMANNOJIRIMYCINA1FO20.85
DMJ1-DEOXYMANNOJIRIMYCINA1G6I0.85
DMJ1-DEOXYMANNOJIRIMYCINA1HXK0.85
CGBCALYSTEGINE B2A,B2CBV1
DIG2,5-DIDEOXY-2,5-IMINO-D-GLUCITOLA,B1DID0.84
NOK2-ACETAMIDO-1,2-DIDEOXYNOJIRMYCINA2VC90.71
MNM(2S,3S,4R,5R)-2,3,4-TRIHYDROXY-
5-HYDROXYMETHYL-PIPERIDINE		A2ALW0.75
CYY2-DEOXYSTREPTAMINEA1QD30.7
XIFPIPERIDINE-3,4-DIOLA1V0L0.7
XIFPIPERIDINE-3,4-DIOLA1V0N0.7
XIFPIPERIDINE-3,4-DIOLA1FH80.7
NOY(2R,3S,4R,5R)-5-(HYDROXYMETHYL)PIPERIDINE-
2,3,4-TRIOL		A,B2J750.75
NOY(2R,3S,4R,5R)-5-(HYDROXYMETHYL)PIPERIDINE-
2,3,4-TRIOL		A2V3G0.75
NOY(2R,3S,4R,5R)-5-(HYDROXYMETHYL)PIPERIDINE-
2,3,4-TRIOL		A,B2VQU0.75
NBG1-N-ACETYL-BETA-D-GLUCOSAMINEA,B1L5Q0.7
NBG1-N-ACETYL-BETA-D-GLUCOSAMINEA,B3CEM0.7
NBG1-N-ACETYL-BETA-D-GLUCOSAMINEA,B1L5R0.7
NBG1-N-ACETYL-BETA-D-GLUCOSAMINEA,B1EXV0.7
NBG1-N-ACETYL-BETA-D-GLUCOSAMINEA,B1L5S0.7
NBG1-N-ACETYL-BETA-D-GLUCOSAMINEA,B1L7X0.7
NBG1-N-ACETYL-BETA-D-GLUCOSAMINEA1WW20.7
NBG1-N-ACETYL-BETA-D-GLUCOSAMINEA2PRJ0.7
NBG1-N-ACETYL-BETA-D-GLUCOSAMINEA,B1FC00.7
NBG1-N-ACETYL-BETA-D-GLUCOSAMINEA,B3CEJ0.7
NBG1-N-ACETYL-BETA-D-GLUCOSAMINEA,B3CEH0.7
NBG1-N-ACETYL-BETA-D-GLUCOSAMINEA,B1XOI0.7
NBG1-N-ACETYL-BETA-D-GLUCOSAMINEA,B3DDW0.7
NBG1-N-ACETYL-BETA-D-GLUCOSAMINEA,B1EM60.7
NBG1-N-ACETYL-BETA-D-GLUCOSAMINEA,B3DDS0.7
NBG1-N-ACETYL-BETA-D-GLUCOSAMINEA,B3DD10.7
NND(2R,3R,4R,5S)-2-(HYDROXYMETHYL)-
1-NONYLPIPERIDINE-3,4,5-TRIOL		A,B2V3E0.74
3CUCASUARINEA,B,C,D2JJB0.71
3CUCASUARINEA3CTT0.71
NBV(2R,3R,4R,5S)-1-BUTYL-2-(HYDROXYMETHYL)PIPERIDINE-
3,4,5-TRIOL		A,B2V3D0.73
MMN5-DEOXY-5-{[(1S)-1-HYDROXYETHYL]AMINO}-
D-GLUCITOL		A1XUZ0.8
DQQ2,5-DIDEOXY-2,5-IMINO-D-MANNITOLA2AEY0.84
IMRIMINORIBITOLA,B,C1I800.78
1AB1,4-DIDEOXY-1,4-IMINO-D-ARABINITOLA2G9Q0.78