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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02444557

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
QV44,6-dideoxy-4-{[(1S,4R,5R,6S)-4-
{[alpha-D-glucopyranosyl-(1->4)-
alpha-D-glucopyranosyl-(1->4)-alpha-
D-glucopyranosyl]oxy}-5,6-dihydroxy-
3-(hydroxymethyl)cyclohex-2-en-
1-yl]amino}-alpha-D-glucopyranose
A2QV40.71
IABISO-ACARBOSEA1XCX0.73
ACGMODIFIED ACARBOSE PENTASACCHARIDEA,B1LWJ0.71
VDM(1S,2S,3R,6S)-4-(HYDROXYMETHYL)-
6-{[(1S,2S,3S,4R,5R)-2,3,4-TRIHYDROXY-
5-(HYDROXYMETHYL)CYCLOHEXYL]AMINO}CYCLOHEX-
4-ENE-1,2,3-TRIOL
A2JF41
3SAACARBOSE DERIVED TRISACCHARIDEA1XCW0.75
AREACARBOSE DERIVED PENTASACCHARIDEA3BAY0.71
AREACARBOSE DERIVED PENTASACCHARIDEA1XH20.71
AREACARBOSE DERIVED PENTASACCHARIDEA1XD00.71
AREACARBOSE DERIVED PENTASACCHARIDEA3BAJ0.71
HSD(1S,2S,3R,6R)-6-amino-4-(hydroxymethyl)cyclohex-
4-ene-1,2,3-triol
A1UH30.79
AC16-METHYL-5-(4,5,6-TRIHYDROXY-3-
HYDROXYMETHYL-CYCLOHEX-2-ENYLAMINO)-
TETRAHYDRO-PYRAN-2,3,4-TRIOL
A1W9X0.8
AC16-METHYL-5-(4,5,6-TRIHYDROXY-3-
HYDROXYMETHYL-CYCLOHEX-2-ENYLAMINO)-
TETRAHYDRO-PYRAN-2,3,4-TRIOL
A1B2Y0.8
AC16-METHYL-5-(4,5,6-TRIHYDROXY-3-
HYDROXYMETHYL-CYCLOHEX-2-ENYLAMINO)-
TETRAHYDRO-PYRAN-2,3,4-TRIOL
A1HX00.8
AC16-METHYL-5-(4,5,6-TRIHYDROXY-3-
HYDROXYMETHYL-CYCLOHEX-2-ENYLAMINO)-
TETRAHYDRO-PYRAN-2,3,4-TRIOL
A1OSE0.8
ACI6-AMINO-4-HYDROXYMETHYL-CYCLOHEX-
4-ENE-1,2,3-TRIOL
A3BMW0.79
ACI6-AMINO-4-HYDROXYMETHYL-CYCLOHEX-
4-ENE-1,2,3-TRIOL
A1E3Z0.79
ACI6-AMINO-4-HYDROXYMETHYL-CYCLOHEX-
4-ENE-1,2,3-TRIOL
A1UH30.79
ACI6-AMINO-4-HYDROXYMETHYL-CYCLOHEX-
4-ENE-1,2,3-TRIOL
A3BC90.79
ACI6-AMINO-4-HYDROXYMETHYL-CYCLOHEX-
4-ENE-1,2,3-TRIOL
A1A470.79
ACI6-AMINO-4-HYDROXYMETHYL-CYCLOHEX-
4-ENE-1,2,3-TRIOL
A2CXG0.79
ACI6-AMINO-4-HYDROXYMETHYL-CYCLOHEX-
4-ENE-1,2,3-TRIOL
A,B1V3L0.79
ACI6-AMINO-4-HYDROXYMETHYL-CYCLOHEX-
4-ENE-1,2,3-TRIOL
A,B1UKS0.79
ACI6-AMINO-4-HYDROXYMETHYL-CYCLOHEX-
4-ENE-1,2,3-TRIOL
A1WPC0.79
ACI6-AMINO-4-HYDROXYMETHYL-CYCLOHEX-
4-ENE-1,2,3-TRIOL
A,B1UKQ0.79
ACI6-AMINO-4-HYDROXYMETHYL-CYCLOHEX-
4-ENE-1,2,3-TRIOL
A,B1UKT0.79
ACI6-AMINO-4-HYDROXYMETHYL-CYCLOHEX-
4-ENE-1,2,3-TRIOL
A,B1V3M0.79
ACI6-AMINO-4-HYDROXYMETHYL-CYCLOHEX-
4-ENE-1,2,3-TRIOL
A1UA70.79
BEUN-[(1S,2R,5R,6R)-2-AMINO-5,6-DIHYDROXY-
4-(HYDROXYMETHYL)CYCLOHEX-3-EN-
1-YL]ACETAMIDE
A,B2JIW0.8
DAF1,4-DEOXY-4-((5-HYDROXYMETHYL-2,3,4-
TRIHYDROXYCYCLOHEX-5-ENYL)AMINO)FRUCTOSE
A2GJP0.83
DAF1,4-DEOXY-4-((5-HYDROXYMETHYL-2,3,4-
TRIHYDROXYCYCLOHEX-5-ENYL)AMINO)FRUCTOSE
A1G9H0.83
DAF1,4-DEOXY-4-((5-HYDROXYMETHYL-2,3,4-
TRIHYDROXYCYCLOHEX-5-ENYL)AMINO)FRUCTOSE
A1BG90.83
DAF1,4-DEOXY-4-((5-HYDROXYMETHYL-2,3,4-
TRIHYDROXYCYCLOHEX-5-ENYL)AMINO)FRUCTOSE
A1PPI0.83
DAF1,4-DEOXY-4-((5-HYDROXYMETHYL-2,3,4-
TRIHYDROXYCYCLOHEX-5-ENYL)AMINO)FRUCTOSE
A1RP90.83
DAF1,4-DEOXY-4-((5-HYDROXYMETHYL-2,3,4-
TRIHYDROXYCYCLOHEX-5-ENYL)AMINO)FRUCTOSE
A1G940.83
DAF1,4-DEOXY-4-((5-HYDROXYMETHYL-2,3,4-
TRIHYDROXYCYCLOHEX-5-ENYL)AMINO)FRUCTOSE
A1RPK0.83
OEV(1S,2S,3R,6R)-4-(hydroxymethyl)-
6-(octylamino)cyclohex-4-ene-1,2,3-
triol
A3D500.86
AF14,6-dideoxy-4-{[(1S,4S,5S,6S)-4,5,6-
trihydroxy-3-(hydroxymethyl)cyclohex-
2-en-1-yl]amino}-beta-D-glucopyranose
A1BG90.8
ACRACARBOSEA1MXD0.73
ACRACARBOSEA,B2ZQ00.73
ACRACARBOSEA2F6D0.73
ACRACARBOSEA,X2QMJ0.73
ACRACARBOSEA2OWC0.73
ACRACARBOSEA2OWW0.73
ACRACARBOSEA1GAH0.73
ACRACARBOSEA,B1K1Y0.73
ACRACARBOSEA,B1DED0.73
ACRACARBOSEA1ESW0.73
ACRACARBOSEA1AGM0.73
ACRACARBOSEA1MXG0.73
ACRACARBOSEA,B1LF90.73
ACRACARBOSEA,B2ECP0.73
ACRACARBOSEA1KXH0.73
ACRACARBOSEA1ULV0.73
ACRACARBOSEA3BC90.73
ADH1-AMINO-2,3-DIHYDROXY-5-HYDROXYMETHYL CYCLOHEX-
5-ENE
A1DTU0.75
ADH1-AMINO-2,3-DIHYDROXY-5-HYDROXYMETHYL CYCLOHEX-
5-ENE
A1KCK0.75
ADH1-AMINO-2,3-DIHYDROXY-5-HYDROXYMETHYL CYCLOHEX-
5-ENE
A2DIJ0.75
QPS4,6-dideoxy-4-{[(1S,4R,5S,6S)-4,5,6-
trihydroxy-3-(hydroxymethyl)cyclohex-
2-en-1-yl]amino}-alpha-D-glucopyranosyl-
(1->4)-alpha-D-glucopyranosyl-(1-
>4)-beta-D-glucopyranose
A,B,C2QPU0.73