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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03085893

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
MG8N-OCTANOYL-N-METHYLGLUCAMINEA,B1SMH0.72
MG8N-OCTANOYL-N-METHYLGLUCAMINEA1Q610.72
MG8N-OCTANOYL-N-METHYLGLUCAMINEA1Q8U0.72
MG8N-OCTANOYL-N-METHYLGLUCAMINEA1SVE0.72
SNGMETHYL 2-ACETAMIDO-1,2-DIDEOXY-
1-SELENO-BETA-D-GLUCOPYRANOSIDE
A2BWM0.7
SNGMETHYL 2-ACETAMIDO-1,2-DIDEOXY-
1-SELENO-BETA-D-GLUCOPYRANOSIDE
A1O9V0.7
17B(2Z,3R,4S,5R,6R)-2-[(4-aminobutyl)imino]-
6-(hydroxymethyl)piperidine-3,4,5-
triol
A,B2VR40.73
LGS(3Z,5S,6R,7S,8R,8aR)-3-(octylimino)hexahydro[1,3]oxazolo[3,4-
a]pyridine-5,6,7,8-tetrol
A,B,C,D2WBG0.71
XDNPIPERIDINE-3,4,5-TRIOLA1V0K0.7
XDNPIPERIDINE-3,4,5-TRIOLA1V0M0.7
XDNPIPERIDINE-3,4,5-TRIOLA1FH70.7
3CUCASUARINEA,B,C,D2JJB0.7
3CUCASUARINEA3CTT0.7
NOK2-ACETAMIDO-1,2-DIDEOXYNOJIRMYCINA2VC90.73
15A(2Z,3R,4S,5R,6R)-2-[(2-aminoethyl)imino]-
6-(hydroxymethyl)piperidine-3,4,5-
triol
A,B2VQT0.72
DFU(2S,3R,4S,5R)-2-METHYLPIPERIDINE-
3,4,5-TRIOL
A,B2EAC0.79
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
GTL(2E,3R,4R,5R,6S)-3,4,5-TRIHYDROXY-
6-(HYDROXYMETHYL)-2-PIPERIDINONE
A,B2J790.7
GTL(2E,3R,4R,5R,6S)-3,4,5-TRIHYDROXY-
6-(HYDROXYMETHYL)-2-PIPERIDINONE
A,B1UWT0.7
NND(2R,3R,4R,5S)-2-(HYDROXYMETHYL)-
1-NONYLPIPERIDINE-3,4,5-TRIOL
A,B2V3E0.97
GHAA1TQU0.76
NBV(2R,3R,4R,5S)-1-BUTYL-2-(HYDROXYMETHYL)PIPERIDINE-
3,4,5-TRIOL
A,B2V3D1
PAI{[(2,2-DIHYDROXY-ETHYL)-(2,3,4,5-
TETRAHYDROXY-6-PHOSPHONOOXY-HEXYL)-
AMINO]-METHYL}-PHOSPHONIC ACID
A,B1JCX0.71
PAI{[(2,2-DIHYDROXY-ETHYL)-(2,3,4,5-
TETRAHYDROXY-6-PHOSPHONOOXY-HEXYL)-
AMINO]-METHYL}-PHOSPHONIC ACID
A1G7V0.71
AM3(3Z,5S,6R,7S,8S,8aR)-3-(octylimino)hexahydro[1,3]oxazolo[3,4-
a]pyridine-5,6,7,8-tetrol
A,B,C,D2WC30.71
GOX(2S,3S,4R,5R)-6-(HYDROXYAMINO)-
2-(HYDROXYMETHYL)-2,3,4,5-TETRAHYDROPYRIDINE-
3,4,5-TRIOL
A,B1UWU0.7
GOX(2S,3S,4R,5R)-6-(HYDROXYAMINO)-
2-(HYDROXYMETHYL)-2,3,4,5-TETRAHYDROPYRIDINE-
3,4,5-TRIOL
A3D510.7
GOX(2S,3S,4R,5R)-6-(HYDROXYAMINO)-
2-(HYDROXYMETHYL)-2,3,4,5-TETRAHYDROPYRIDINE-
3,4,5-TRIOL
A1U300.7
GOX(2S,3S,4R,5R)-6-(HYDROXYAMINO)-
2-(HYDROXYMETHYL)-2,3,4,5-TETRAHYDROPYRIDINE-
3,4,5-TRIOL
M1E720.7
GOX(2S,3S,4R,5R)-6-(HYDROXYAMINO)-
2-(HYDROXYMETHYL)-2,3,4,5-TETRAHYDROPYRIDINE-
3,4,5-TRIOL
A,B2J780.7
GOX(2S,3S,4R,5R)-6-(HYDROXYAMINO)-
2-(HYDROXYMETHYL)-2,3,4,5-TETRAHYDROPYRIDINE-
3,4,5-TRIOL
A1U2Y0.7
GOX(2S,3S,4R,5R)-6-(HYDROXYAMINO)-
2-(HYDROXYMETHYL)-2,3,4,5-TETRAHYDROPYRIDINE-
3,4,5-TRIOL
M,N1E6S0.7
CGBCALYSTEGINE B2A,B2CBV0.73
MMN5-DEOXY-5-{[(1S)-1-HYDROXYETHYL]AMINO}-
D-GLUCITOL
A1XUZ0.8
SWA1S-8AB-OCTAHYDRO-INDOLIZIDINE-1A,2A,8B-
TRIOL
A1HWW0.76
SWA1S-8AB-OCTAHYDRO-INDOLIZIDINE-1A,2A,8B-
TRIOL
A3BLB0.76
CTSCASTANOSPERMINEA1EQC0.81
CTSCASTANOSPERMINEA,B2JKP0.81
CTSCASTANOSPERMINEA,B,C2VL80.81
CTSCASTANOSPERMINEA,B2CBU0.81
CTSCASTANOSPERMINEA,B2PWG0.81