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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02224173

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
CGBCALYSTEGINE B2A,B2CBV0.79
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
NOZ(2S,3S,4R,5R)-5-(hydroxymethyl)piperidine-
2,3,4-triol		A,B2VL40.72
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
TOB1,3-DIAMINO-5,6-DIHYDROXYCYCLOHEXANEA1TOB0.72
XDNPIPERIDINE-3,4,5-TRIOLA1V0K0.84
XDNPIPERIDINE-3,4,5-TRIOLA1V0M0.84
XDNPIPERIDINE-3,4,5-TRIOLA1FH70.84
DQQ2,5-DIDEOXY-2,5-IMINO-D-MANNITOLA2AEY0.79
SWA1S-8AB-OCTAHYDRO-INDOLIZIDINE-1A,2A,8B-
TRIOL		A1HWW0.72
SWA1S-8AB-OCTAHYDRO-INDOLIZIDINE-1A,2A,8B-
TRIOL		A3BLB0.72
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
MMN5-DEOXY-5-{[(1S)-1-HYDROXYETHYL]AMINO}-
D-GLUCITOL		A1XUZ0.73
DIG2,5-DIDEOXY-2,5-IMINO-D-GLUCITOLA,B1DID0.79
XIFPIPERIDINE-3,4-DIOLA1V0L0.85
XIFPIPERIDINE-3,4-DIOLA1V0N0.85
XIFPIPERIDINE-3,4-DIOLA1FH80.85
PTOPSEUDOTROPINEA,B2AE20.7
DFU(2S,3R,4S,5R)-2-METHYLPIPERIDINE-
3,4,5-TRIOL		A,B2EAC0.89
NOY(2R,3S,4R,5R)-5-(HYDROXYMETHYL)PIPERIDINE-
2,3,4-TRIOL		A,B2J750.72
NOY(2R,3S,4R,5R)-5-(HYDROXYMETHYL)PIPERIDINE-
2,3,4-TRIOL		A2V3G0.72
NOY(2R,3S,4R,5R)-5-(HYDROXYMETHYL)PIPERIDINE-
2,3,4-TRIOL		A,B2VQU0.72
NOK2-ACETAMIDO-1,2-DIDEOXYNOJIRMYCINA2VC90.71
MNM(2S,3S,4R,5R)-2,3,4-TRIHYDROXY-
5-HYDROXYMETHYL-PIPERIDINE		A2ALW0.72
HHO1-(HYDROXYMETHYLENEAMINO)-8-HYDROXY-
OCTANE		I,J1AY60.7
NOJ1-DEOXYNOJIRIMYCINA,B1OIM0.86
NOJ1-DEOXYNOJIRIMYCINA,B2J770.86
NOJ1-DEOXYNOJIRIMYCINA,B2JKE0.86
NOJ1-DEOXYNOJIRIMYCINA3GBE0.86
NOJ1-DEOXYNOJIRIMYCINA,B3GXT0.86
NOJ1-DEOXYNOJIRIMYCINA,B1DIE0.86
NOJ1-DEOXYNOJIRIMYCINA1DOG0.86
NOJ1-DEOXYNOJIRIMYCINA,B1I750.86
NOJ1-DEOXYNOJIRIMYCINA,B2PWD0.86
DMJ1-DEOXYMANNOJIRIMYCINA,B1KRE0.86
DMJ1-DEOXYMANNOJIRIMYCINA1FO20.86
DMJ1-DEOXYMANNOJIRIMYCINA1G6I0.86
DMJ1-DEOXYMANNOJIRIMYCINA1HXK0.86
NBV(2R,3R,4R,5S)-1-BUTYL-2-(HYDROXYMETHYL)PIPERIDINE-
3,4,5-TRIOL		A,B2V3D0.73
PA2PAROMOMYCIN (RING 2)B1O9M0.73
PA2PAROMOMYCIN (RING 2)A1PBR0.73
NND(2R,3R,4R,5S)-2-(HYDROXYMETHYL)-
1-NONYLPIPERIDINE-3,4,5-TRIOL		A,B2V3E0.73
IMRIMINORIBITOLA,B,C1I800.78
1AB1,4-DIDEOXY-1,4-IMINO-D-ARABINITOLA2G9Q0.78