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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs01113331

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
DR26-DEOXY-ALPHA-L-IDOPYRANOSYL-(1-
>2)-ALPHA-D-GLUCOPYRANOSYL-(1->4)-
2-(ACETYLAMINO)-2-DEOXY-BETA-L-
GULOPYRANOSE		A3E6J0.71
DR26-DEOXY-ALPHA-L-IDOPYRANOSYL-(1-
>2)-ALPHA-D-GLUCOPYRANOSYL-(1->4)-
2-(ACETYLAMINO)-2-DEOXY-BETA-L-
GULOPYRANOSE		A1ZJ30.71
DR26-DEOXY-ALPHA-L-IDOPYRANOSYL-(1-
>2)-ALPHA-D-GLUCOPYRANOSYL-(1->4)-
2-(ACETYLAMINO)-2-DEOXY-BETA-L-
GULOPYRANOSE		A1ZI40.71
TNRO-(2-ACETAMIDO-2-DEOXY-ALPHA-D-
GALACTOPYRANOSYL)-L-SERINE		A,B,C,D1N470.7
TNRO-(2-ACETAMIDO-2-DEOXY-ALPHA-D-
GALACTOPYRANOSYL)-L-SERINE		A2CGZ0.7
TNRO-(2-ACETAMIDO-2-DEOXY-ALPHA-D-
GALACTOPYRANOSYL)-L-SERINE		A,B,C,D2D3S0.7
TNRO-(2-ACETAMIDO-2-DEOXY-ALPHA-D-
GALACTOPYRANOSYL)-L-SERINE		A2D7R0.7
IGCN-[(1S,2R,3E)-1-({[ALPHA-D-GALACTOPYRANOSYL-
(1->3)-BETA-D-GALACTOPYRANOSYL-
(1->4)-BETA-D-GLUCOPYRANOSYL]OXY}METHYL)-
2-HYDROXYHEPTADEC-3-EN-1-YL]OCTANAMIDE		A,C2Q7Y0.75
SFTSULFOGALACTOCERAMIDEA,B2BHI0.71
GTH3-O-GLUCOPYRANOSYL-THREONINE-[2-
DEOXY-2-ACETAMIDO-GLUCOPYRANOSIDE]		A1WCT0.72
SLFSULFATE-3-D-GALACTOSYL-BETA-1-1-
N-STEAROYL-D-SPHINGOSINE		B,D3BRR0.73
SLFSULFATE-3-D-GALACTOSYL-BETA-1-1-
N-STEAROYL-D-SPHINGOSINE		A,C1ONQ0.73
AF14,6-dideoxy-4-{[(1S,4S,5S,6S)-4,5,6-
trihydroxy-3-(hydroxymethyl)cyclohex-
2-en-1-yl]amino}-beta-D-glucopyranose		A1BG90.74
CBSDI(N-ACETYL-D-GLUCOSAMINE)A1LJN0.71
CBSDI(N-ACETYL-D-GLUCOSAMINE)A1ZU00.71
CBSDI(N-ACETYL-D-GLUCOSAMINE)A2HRH0.71
CBSDI(N-ACETYL-D-GLUCOSAMINE)A,B1TW50.71
CBSDI(N-ACETYL-D-GLUCOSAMINE)A,H2HRG0.71
CBSDI(N-ACETYL-D-GLUCOSAMINE)12BS70.71
CBSDI(N-ACETYL-D-GLUCOSAMINE)A1C7T0.71
CBSDI(N-ACETYL-D-GLUCOSAMINE)A,B2QT60.71
CBSDI(N-ACETYL-D-GLUCOSAMINE)A1QBB0.71
CBSDI(N-ACETYL-D-GLUCOSAMINE)A1C7S0.71
NLC2-(ACETYLAMINO)-2-DEOXY-4-O-BETA-
D-GALACTOPYRANOSYL-ALPHA-D-GLUCOPYRANOSE		A,B2VS40.7
NLC2-(ACETYLAMINO)-2-DEOXY-4-O-BETA-
D-GALACTOPYRANOSYL-ALPHA-D-GLUCOPYRANOSE		A1W3G0.7
NLC2-(ACETYLAMINO)-2-DEOXY-4-O-BETA-
D-GALACTOPYRANOSYL-ALPHA-D-GLUCOPYRANOSE		A,B3EHN0.7
NLC2-(ACETYLAMINO)-2-DEOXY-4-O-BETA-
D-GALACTOPYRANOSYL-ALPHA-D-GLUCOPYRANOSE		A1W3F0.7
NLC2-(ACETYLAMINO)-2-DEOXY-4-O-BETA-
D-GALACTOPYRANOSYL-ALPHA-D-GLUCOPYRANOSE		A1ZJ10.7
NLC2-(ACETYLAMINO)-2-DEOXY-4-O-BETA-
D-GALACTOPYRANOSYL-ALPHA-D-GLUCOPYRANOSE		A2YY10.7
NLC2-(ACETYLAMINO)-2-DEOXY-4-O-BETA-
D-GALACTOPYRANOSYL-ALPHA-D-GLUCOPYRANOSE		A1ZI30.7
NLC2-(ACETYLAMINO)-2-DEOXY-4-O-BETA-
D-GALACTOPYRANOSYL-ALPHA-D-GLUCOPYRANOSE		A,B2VS30.7
M4OA3D3H0.71
CIS(15Z)-N-((1S,2R,3E)-2-HYDROXY-1-
{[(3-O-SULFO-BETA-D-GALACTOPYRANOSYL)OXY]METHYL}HEPTADEC-
3-ENYL)TETRACOS-15-ENAMIDE		A,C2AKR0.73
UCD(4S,5R,6R)-6-((2R,3R,4R,5R,6R)-
3-ACETAMIDO-2,5-DIHYDROXY-6-(HYDROXYMETHYL)-
TETRAHYDRO-2H-PYRAN-4-YLOXY)-4,5-
DIHYDROXY-5,6-DIHYDRO-4H-PYRAN-
2-CARBOXYLIC ACID		A,B2AHG0.81
UCD(4S,5R,6R)-6-((2R,3R,4R,5R,6R)-
3-ACETAMIDO-2,5-DIHYDROXY-6-(HYDROXYMETHYL)-
TETRAHYDRO-2H-PYRAN-4-YLOXY)-4,5-
DIHYDROXY-5,6-DIHYDRO-4H-PYRAN-
2-CARBOXYLIC ACID		A2D8L0.81
AAOACARBOSE DERIVED HEXASACCHARIDEA1XH00.73
IABISO-ACARBOSEA1XCX0.74
ABCMODIFIED ACARBOSE HEXASACCHARIDEA7TAA0.73
AREACARBOSE DERIVED PENTASACCHARIDEA3BAY0.74
AREACARBOSE DERIVED PENTASACCHARIDEA1XH20.74
AREACARBOSE DERIVED PENTASACCHARIDEA1XD00.74
AREACARBOSE DERIVED PENTASACCHARIDEA3BAJ0.74
ACGMODIFIED ACARBOSE PENTASACCHARIDEA,B1LWJ0.74
3SAACARBOSE DERIVED TRISACCHARIDEA1XCW0.76
E553-O-DECYL-2-DEOXY-6-O-{2-DEOXY-
3-O-[(3R)-3-METHOXYDECYL]-6-O-METHYL-
2-[(11Z)-OCTADEC-11-ENOYLAMINO]-
4-O-PHOSPHONO-BETA-D-GLUCOPYRANOSYL}-
2-[(3-OXOTETRADECANOYL)AMINO]-1-
O-PHOSPHONO-ALPHA-D-GLUCOPYRANOSE		A,B,C,D,M2Z650.71
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,C2QPU0.74
ACRACARBOSEA1MXD0.74
ACRACARBOSEA,B2ZQ00.74
ACRACARBOSEA2F6D0.74
ACRACARBOSEA,X2QMJ0.74
ACRACARBOSEA2OWC0.74
ACRACARBOSEA2OWW0.74
ACRACARBOSEA1GAH0.74
ACRACARBOSEA,B1K1Y0.74
ACRACARBOSEA,B1DED0.74
ACRACARBOSEA1ESW0.74
ACRACARBOSEA1AGM0.74
ACRACARBOSEA1MXG0.74
ACRACARBOSEA,B1LF90.74
ACRACARBOSEA,B2ECP0.74
ACRACARBOSEA1KXH0.74
ACRACARBOSEA1ULV0.74
ACRACARBOSEA3BC90.74
AC16-METHYL-5-(4,5,6-TRIHYDROXY-3-
HYDROXYMETHYL-CYCLOHEX-2-ENYLAMINO)-
TETRAHYDRO-PYRAN-2,3,4-TRIOL		A1W9X0.74
AC16-METHYL-5-(4,5,6-TRIHYDROXY-3-
HYDROXYMETHYL-CYCLOHEX-2-ENYLAMINO)-
TETRAHYDRO-PYRAN-2,3,4-TRIOL		A1B2Y0.74
AC16-METHYL-5-(4,5,6-TRIHYDROXY-3-
HYDROXYMETHYL-CYCLOHEX-2-ENYLAMINO)-
TETRAHYDRO-PYRAN-2,3,4-TRIOL		A1HX00.74
AC16-METHYL-5-(4,5,6-TRIHYDROXY-3-
HYDROXYMETHYL-CYCLOHEX-2-ENYLAMINO)-
TETRAHYDRO-PYRAN-2,3,4-TRIOL		A1OSE0.74
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		A2QV40.74
HS22-deoxy-4-O-(4-deoxy-alpha-L-threo-
hex-4-enopyranuronosyl)-2-{[(1R)-
1-hydroxyethyl]amino}-alpha-D-glucopyranose		A,B,C3E800.77
FSMFORSMANN ANTIGENA2CGY0.71
DAN2-DEOXY-2,3-DEHYDRO-N-ACETYL-NEURAMINIC ACIDH,J,L1RV00.73
DAN2-DEOXY-2,3-DEHYDRO-N-ACETYL-NEURAMINIC ACIDA2QWC0.73
DAN2-DEOXY-2,3-DEHYDRO-N-ACETYL-NEURAMINIC ACIDA2SIM0.73
DAN2-DEOXY-2,3-DEHYDRO-N-ACETYL-NEURAMINIC ACIDA,B1IVF0.73
DAN2-DEOXY-2,3-DEHYDRO-N-ACETYL-NEURAMINIC ACIDA1SLI0.73
DAN2-DEOXY-2,3-DEHYDRO-N-ACETYL-NEURAMINIC ACIDA,B1MS10.73
DAN2-DEOXY-2,3-DEHYDRO-N-ACETYL-NEURAMINIC ACIDA,B1USR0.73
DAN2-DEOXY-2,3-DEHYDRO-N-ACETYL-NEURAMINIC ACIDA,B,C,D2CEX0.73
DAN2-DEOXY-2,3-DEHYDRO-N-ACETYL-NEURAMINIC ACIDA,B1MS00.73
DAN2-DEOXY-2,3-DEHYDRO-N-ACETYL-NEURAMINIC ACIDA1W8N0.73
DAN2-DEOXY-2,3-DEHYDRO-N-ACETYL-NEURAMINIC ACIDA,B1V3D0.73
DAN2-DEOXY-2,3-DEHYDRO-N-ACETYL-NEURAMINIC ACIDA,B2F270.73
DAN2-DEOXY-2,3-DEHYDRO-N-ACETYL-NEURAMINIC ACIDA,B2F290.73
DAN2-DEOXY-2,3-DEHYDRO-N-ACETYL-NEURAMINIC ACIDA1W0O0.73
DAN2-DEOXY-2,3-DEHYDRO-N-ACETYL-NEURAMINIC ACIDA1MZ60.73
DAN2-DEOXY-2,3-DEHYDRO-N-ACETYL-NEURAMINIC ACIDA,B,C1WCQ0.73
DAN2-DEOXY-2,3-DEHYDRO-N-ACETYL-NEURAMINIC ACIDA,B1NSD0.73
DAN2-DEOXY-2,3-DEHYDRO-N-ACETYL-NEURAMINIC ACIDA2VW10.73
DAN2-DEOXY-2,3-DEHYDRO-N-ACETYL-NEURAMINIC ACIDA,B1E8V0.73
DAN2-DEOXY-2,3-DEHYDRO-N-ACETYL-NEURAMINIC ACIDA,B2F250.73
DAN2-DEOXY-2,3-DEHYDRO-N-ACETYL-NEURAMINIC ACIDA1Z500.73
DAN2-DEOXY-2,3-DEHYDRO-N-ACETYL-NEURAMINIC ACIDA2VK60.73
DAN2-DEOXY-2,3-DEHYDRO-N-ACETYL-NEURAMINIC ACIDA,B1MS80.73
DAN2-DEOXY-2,3-DEHYDRO-N-ACETYL-NEURAMINIC ACIDA,B3H730.73
DAN2-DEOXY-2,3-DEHYDRO-N-ACETYL-NEURAMINIC ACIDA1EUS0.73
DAN2-DEOXY-2,3-DEHYDRO-N-ACETYL-NEURAMINIC ACIDA1F8B0.73
DAN2-DEOXY-2,3-DEHYDRO-N-ACETYL-NEURAMINIC ACIDA2HTW0.73
DAN2-DEOXY-2,3-DEHYDRO-N-ACETYL-NEURAMINIC ACIDA1NNB0.73
DAN2-DEOXY-2,3-DEHYDRO-N-ACETYL-NEURAMINIC ACIDA1Z4Z0.73
DAN2-DEOXY-2,3-DEHYDRO-N-ACETYL-NEURAMINIC ACIDA,B2VVZ0.73
DAN2-DEOXY-2,3-DEHYDRO-N-ACETYL-NEURAMINIC ACIDA1N1V0.73
DAN2-DEOXY-2,3-DEHYDRO-N-ACETYL-NEURAMINIC ACIDA,B,C1USX0.73
DAN2-DEOXY-2,3-DEHYDRO-N-ACETYL-NEURAMINIC ACIDA1Z4W0.73
DAN2-DEOXY-2,3-DEHYDRO-N-ACETYL-NEURAMINIC ACIDA,B1VCU0.73
DAN2-DEOXY-2,3-DEHYDRO-N-ACETYL-NEURAMINIC ACIDA1N1T0.73
DAN2-DEOXY-2,3-DEHYDRO-N-ACETYL-NEURAMINIC ACIDA2HTR0.73
DAN2-DEOXY-2,3-DEHYDRO-N-ACETYL-NEURAMINIC ACIDA1Z4V0.73
6SAACARBOSE DERIVED HEXASACCHARIDEA1XD10.73
AS52-(acetylamino)-4-O-[2-(acetylamino)-
2-deoxy-alpha-L-gulopyranosyl]-
1,5-anhydro-2-deoxy-D-mannitol		A,B2VLC0.71
AMVMETHYL 2-(ACETYLAMINO)-3-O-[(1R)-
1-CARBOXYETHYL]-2-DEOXY-BETA-D-
GLUCOPYRANOSIDE		A2J8G0.71
AMVMETHYL 2-(ACETYLAMINO)-3-O-[(1R)-
1-CARBOXYETHYL]-2-DEOXY-BETA-D-
GLUCOPYRANOSIDE		A2J8F0.71