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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03463058

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
SIOmethyl 4,9-di-O-acetyl-5-(acetylamino)-
3,5-dideoxy-D-glycero-alpha-D-galacto-
non-2-ulopyranosidonic acid		A3CL50.77
HMN2,4,6,7,8,9-HEXAHYDROXY-5-METHYLCARBOXAMIDO NONANOIC ACIDA,B,C,D1F730.76
CRA1-DEOXY-1-METHOXYCARBAMIDO-BETA-
D-GLUCO-2-HEPTULOPYRANOSONAMIDE		A1FS40.71
CRA1-DEOXY-1-METHOXYCARBAMIDO-BETA-
D-GLUCO-2-HEPTULOPYRANOSONAMIDE		A1B4D0.71
UDC(2S,3S)-2-((2S,3R,4S,5R)-5-ETHANAMIDO-
3-HYDROXY-2-(HYDROXYMETHYL)TETRAHYDRO-
2H-PYRAN-4-YLOXY)-3,4-DIHYDROXY-
2-METHYLBUTANOIC ACID		A,B,C,D2Z2C0.76
AMN9-DEOXY-9-AMINO-2-O-METHYL-5-N-
ACETYL-ALPHA-D-NEURAMINIC ACID		A,B,C,D,E,F1HGJ0.77
IVS3-HYDROXY-6-METHYL-4-(3-METHYL-
2-(3-METHYL-2-(3-METHYL-BUTYRYLAMINO)-
BUTYRYLAMINO)-BUTYRYLAMINO)-HEPTANOIC ACID ETHYL ESTER		A,B1ME60.71
ABX5-[1-(ACETYLAMINO)-3-METHYLBUTYL]-
4-(METHOXYCARBONYL)PROLINE		A1XOE0.73
CR61-DEOXY-1-ACETYLAMINO-BETA-D-GLUCO-
2-HEPTULOPYRANOSONAMIDE		A1P4H0.71
CR61-DEOXY-1-ACETYLAMINO-BETA-D-GLUCO-
2-HEPTULOPYRANOSONAMIDE		A1FU80.71
76VN-{[(2S,3S)-3-(ETHOXYCARBONYL)OXIRAN-
2-YL]CARBONYL}-L-ISOLEUCYL-L-ISOLEUCINE		A2DCB0.7
FSI5-(ACETYLAMINO)-2,6-ANHYDRO-3,5-
DIDEOXY-3-FLUORONONONIC ACID		A2AH20.78
FSI5-(ACETYLAMINO)-2,6-ANHYDRO-3,5-
DIDEOXY-3-FLUORONONONIC ACID		A2FHR0.78
FSI5-(ACETYLAMINO)-2,6-ANHYDRO-3,5-
DIDEOXY-3-FLUORONONONIC ACID		A2A750.78
FSI5-(ACETYLAMINO)-2,6-ANHYDRO-3,5-
DIDEOXY-3-FLUORONONONIC ACID		A,B2VK70.78
NAU4,4,6,7,8,9-HEXAHYDROXY-5-METHYLCARBOXAMIDONONANOIC ACIDA,C1F7B0.74
SKD2-ACETYLAMINO-7-(1,2-DIHYDROXY-
ETHYL)-3-HYDROXY-6,8-DIOXA-BICYCLO[3.2.1]OCTANE-
5-CARBOXYLIC ACID		A2SLI0.78
SKD2-ACETYLAMINO-7-(1,2-DIHYDROXY-
ETHYL)-3-HYDROXY-6,8-DIOXA-BICYCLO[3.2.1]OCTANE-
5-CARBOXYLIC ACID		A2JKB0.78
SKD2-ACETYLAMINO-7-(1,2-DIHYDROXY-
ETHYL)-3-HYDROXY-6,8-DIOXA-BICYCLO[3.2.1]OCTANE-
5-CARBOXYLIC ACID		A3SLI0.78
MLDGLCNAC(BETA1-4)-MURNAC(1,6-ANHYDRO)-
L-ALA-GAMMA-D-GLU-MESO-A2PM-D-ALA		A,X2F2L0.71
MLDGLCNAC(BETA1-4)-MURNAC(1,6-ANHYDRO)-
L-ALA-GAMMA-D-GLU-MESO-A2PM-D-ALA		A,B,C,D2CB30.71
AMUBETA-N-ACETYLMURAMIC ACIDA,B,C,D2APH0.7
AMUBETA-N-ACETYLMURAMIC ACIDA,P1TWQ0.7
AMUBETA-N-ACETYLMURAMIC ACIDA1D0K0.7
AMUBETA-N-ACETYLMURAMIC ACIDS9LYZ0.7
AMUBETA-N-ACETYLMURAMIC ACIDE,S148L0.7
AMUBETA-N-ACETYLMURAMIC ACIDD,K3CYQ0.7
AMUBETA-N-ACETYLMURAMIC ACIDU2AIZ0.7
2G0(2S)-1-[(2S)-6-amino-2-({[(2S,3S,4R,5S,6S)-
3,4,5-trihydroxy-6-methyltetrahydro-
2H-pyran-2-yl]acetyl}amino)hexanoyl]-
N-[(1S)-1-carbamoyl-3-methylbutyl]pyrrolidine-
2-carboxamide		A,B,C,D3DCQ0.71
LP4(R)-((2R,3S,4R,5S)-2-(HYDROXYMETHYL)-
5-((R)-3-HYDROXYTETRADECANAMIDO)-
3-(PHOSPHONOOXY)TETRAHYDRO-2H-PYRAN-
4-YL) 3-HYDROXYTETRADECANOATE		A2E590.71
MNA2-O-METHYL-5-N-ACETYL-ALPHA-D- NEURAMINIC ACIDA2P3I0.78
MNA2-O-METHYL-5-N-ACETYL-ALPHA-D- NEURAMINIC ACIDA1KQR0.78
MNA2-O-METHYL-5-N-ACETYL-ALPHA-D- NEURAMINIC ACIDA,B,C,D,E,F1HGH0.78
MNA2-O-METHYL-5-N-ACETYL-ALPHA-D- NEURAMINIC ACIDA,B2I2S0.78
MNA2-O-METHYL-5-N-ACETYL-ALPHA-D- NEURAMINIC ACIDA2P3J0.78
MNA2-O-METHYL-5-N-ACETYL-ALPHA-D- NEURAMINIC ACIDA,B,C,D,E,F1HGE0.78
MNA2-O-METHYL-5-N-ACETYL-ALPHA-D- NEURAMINIC ACIDA2P3K0.78
AH02-(2-ACETYLAMINO-4-HYDROXY-6,8-
DIOXA-BICYCLO[3.2.1]OCT-3-YLOXY)-
PROPIONIC ACID		A1QTE0.72
GDL2-ACETAMIDO-2-DEOXY-D-GLUCONO-1,5-
LACTONE		A,B1UR90.74
GDL2-ACETAMIDO-2-DEOXY-D-GLUCONO-1,5-
LACTONE		A,B,C,D,E,F1O7A0.74
GDL2-ACETAMIDO-2-DEOXY-D-GLUCONO-1,5-
LACTONE		A,B1UR80.74
MUBN-ACETYLMURAMIC ACIDL,N1WCO0.7
AMVMETHYL 2-(ACETYLAMINO)-3-O-[(1R)-
1-CARBOXYETHYL]-2-DEOXY-BETA-D-
GLUCOPYRANOSIDE		A2J8G0.7
AMVMETHYL 2-(ACETYLAMINO)-3-O-[(1R)-
1-CARBOXYETHYL]-2-DEOXY-BETA-D-
GLUCOPYRANOSIDE		A2J8F0.7
DH9(2S,3S,5S)-5-[(N-FORMYL-L-LEUCYL)OXY]-
2-HEXYL-3-HYDROXYHEXADECANOIC ACID		A,B2PX60.76
CNP2-PROPENYL-N-ACETYL-NEURAMIC ACIDA4SLI0.75
NAV6,7,8,9-TETRAHYDROXY-5-METHYLCARBOXAMIDO-
4-OXONONANOIC ACID		A,C1F7B0.73
MS8(2R,3aR,7aR)-2-[(2S)-2-amino-3-
hydroxy-3-oxo-propyl]-3,3a,5,6,7,7a-
hexahydrofuro[4,5-b]pyran-2-carboxylic acid		A,B3GBB0.77
ABW5-[1-(ACETYLAMINO)-3-METHYLBUTYL]-
2,5-ANHYDRO-3,4-DIDEOXY-4-(METHOXYCARBONYL)PENTONIC ACID		A1XOG1
DYH(2R,3aR,6S,7R,7aR)-2-[(2S)-2-amino-
2-carboxyethyl]-6-hydroxy-7-(methylamino)hexahydro-
2H-furo[3,2-b]pyran-2-carboxylic acid		A2ZNT0.83
DYH(2R,3aR,6S,7R,7aR)-2-[(2S)-2-amino-
2-carboxyethyl]-6-hydroxy-7-(methylamino)hexahydro-
2H-furo[3,2-b]pyran-2-carboxylic acid		A,B,C,D3GBA0.83
59AN-{[(2S,3S)-3-(ETHOXYCARBONYL)OXIRAN-
2-YL]CARBONYL}-L-ISOLEUCINE		A2DC80.72
NXDMETHYL 5-(ACETYLAMINO)-9-{[AMINO(OXO)ACETYL]AMINO}-
3,5,9-TRIDEOXY-D-GLYCERO-ALPHA-
D-GLUCO-NON-2-ULOPYRANOSIDONIC ACID		A2G5R0.74
NAY6,7,8,9-TETRAHYDROXY-5-METHYLCARBOXAMIDO-
2-OXONONANOIC ACID		A,C1F740.75
NDZ(2R,3aR,6R,7R,7aR)-2-[(2S)-2-amino-
2-carboxyethyl]-6,7-dihydroxyhexahydro-
2H-furo[3,2-b]pyran-2-carboxylic acid		A2ZNU0.75
GSL(2S,3R)-3-HYDROXY-2-(TETRADECANOYLAMINO)OCTADECYL ALPHA-
D-GALACTOPYRANOSIDURONIC ACID		A2FIK0.76
ANA4-O-ACETYL-ALPHA-2-OMETHYL-5-N-
ACETYL-ALPHA-D-NEURAMINIC ACID		A,B,C,D,E,F1HGI0.78
SIAO-SIALIC ACIDA,B1DBN0.78
SIAO-SIALIC ACIDA,B,C2DQY0.78
SIAO-SIALIC ACIDA,B3H720.78
SIAO-SIALIC ACIDA1N1Y0.78
SIAO-SIALIC ACIDA,B,C,D,E,F1V0F0.78
SIAO-SIALIC ACIDA,B,C1YAH0.78
SIAO-SIALIC ACIDA1MWE0.78
SIAO-SIALIC ACIDA,B,C,D,E,F1MX10.78
SIAO-SIALIC ACIDA2JH70.78
SIAO-SIALIC ACIDA1F310.78
SIAO-SIALIC ACIDA,B,C,D,E,F1SID0.78
SIAO-SIALIC ACIDA1W0P0.78
SIAO-SIALIC ACIDA,B2EHI0.78
SIAO-SIALIC ACIDA2RDG0.78
SIAO-SIALIC ACIDA,B2WGC0.78
SIAO-SIALIC ACIDA,B,C1USX0.78
SIAO-SIALIC ACIDH1MCO0.78
SIAO-SIALIC ACIDA,B,C,D1W200.78
SIAO-SIALIC ACIDA,B,C,D1G1R0.78
SIAO-SIALIC ACIDA,B,C,D,E,F1HGG0.78
SIAO-SIALIC ACIDA1FV20.78
SIAO-SIALIC ACIDA,B,D,E,G,H1MQM0.78
SIAO-SIALIC ACIDA,B,C1QFO0.78
SIAO-SIALIC ACIDC,D,E,F,H,I,
L,M,N,Q,R,S		2W9L0.78
SIAO-SIALIC ACIDB1URL0.78
SIAO-SIALIC ACIDA,B2RFT0.78
SIAO-SIALIC ACIDB,C,I1PTO0.78
SIAO-SIALIC ACIDA2HRL0.78
SIAO-SIALIC ACIDA2R610.78
SIAO-SIALIC ACIDA2ZG30.78
SIAO-SIALIC ACIDA,B,C,E,G,I,
J,K,L		1RVX0.78
SIAO-SIALIC ACIDA,B,C,D,E3BWR0.78
SIAO-SIALIC ACIDA,B,C,D1W1X0.78
SIAO-SIALIC ACIDA,B,C,D1WW40.78
SIAO-SIALIC ACIDA,B,C,D,E1VPS0.78
SIAO-SIALIC ACIDA2V730.78
SIAO-SIALIC ACIDA,B1JSH0.78
SIAO-SIALIC ACIDA,B,C,D1W210.78
SIAO-SIALIC ACIDA,B1JSN0.78
SIAO-SIALIC ACIDA,B,C,D1OW00.78
SIAO-SIALIC ACIDA2OSX0.78
SIAO-SIALIC ACIDA,B,C,D1G1S0.78
SIAO-SIALIC ACIDA2C4L0.78
SIAO-SIALIC ACIDA2Z8L0.78
SIAO-SIALIC ACIDA2JHD0.78
SIAO-SIALIC ACIDA,C,E,H,I,J1LGC0.78
SIAO-SIALIC ACIDA1G1T0.78
SIAO-SIALIC ACIDA,C,E,F,G,I,K1RVZ0.78
SIAO-SIALIC ACIDA,B,C,D,E,F1MX50.78
SIAO-SIALIC ACID1,2,32KMB0.78
SIAO-SIALIC ACIDA,B,C,D,E,F4HMG0.78
SIAO-SIALIC ACIDA,B1NSC0.78
SIAO-SIALIC ACIDA,B,C2W680.78
SIAO-SIALIC ACIDA1SE30.78
SIAO-SIALIC ACIDA,B,C1UXA0.78
SIAO-SIALIC ACIDA2QWB0.78
SIAO-SIALIC ACIDA2VU90.78
SIAO-SIALIC ACIDH,J,L1RVT0.78
SIAO-SIALIC ACIDA,B1FV30.78
SIAO-SIALIC ACIDA,B2C250.78
SIAO-SIALIC ACIDA,B,C,D,E,F2HRQ0.78
SIAO-SIALIC ACIDD,E,F,G,H3CHB0.78
SIAO-SIALIC ACIDA,B2WBW0.78
SIAO-SIALIC ACIDA,B1USR0.78
SIAO-SIALIC ACIDA,B,E1KJ20.78
SIAO-SIALIC ACIDA,B,C2HRR0.78
SIAO-SIALIC ACIDA1QDD0.78
SIAO-SIALIC ACIDA,B,C,D,E,F1SIE0.78
SIAO-SIALIC ACIDA,B,C,D1ZAG0.78
SIAO-SIALIC ACIDD,E,F,G,H2CHB0.78
SIAO-SIALIC ACIDB1H7T0.78
SIAO-SIALIC ACIDA,B2DS00.78
SIAO-SIALIC ACIDA2ZG10.78
SIAO-SIALIC ACIDA,B,C2DR00.78
SIAO-SIALIC ACIDA,B,C1UXB0.78
SIAO-SIALIC ACIDA,B,C,D,E,F,
G,H,I,J,K,L		1YAJ0.78
SIAO-SIALIC ACIDA,B2RFU0.78
SIAO-SIALIC ACIDA1W0O0.78
SIAO-SIALIC ACIDB,C,E,F,H,I,
K,L		3GHG0.78
SIAO-SIALIC ACIDA,B,C1YA40.78
SIAO-SIALIC ACIDA,B,D2CWG0.78
SIAO-SIALIC ACIDA,B,C2DQZ0.78
SIAO-SIALIC ACIDA,B,C,D,E,F2H7C0.78
SIAO-SIALIC ACIDA,B,C1YA80.78
SIAO-SIALIC ACIDA2C4A0.78
SIAO-SIALIC ACIDF,G,H1CT10.78
SIAO-SIALIC ACIDA1YYN0.78
SIAO-SIALIC ACIDA,B1JSO0.78
SIAO-SIALIC ACIDA,B1WGC0.78
SIAO-SIALIC ACIDA,B,C,D,E,F5HMG0.78
SIAO-SIALIC ACIDA2BF60.78
SIAO-SIALIC ACIDA,B,D,E,G,H1MQN0.78
SIAO-SIALIC ACIDA2DF30.78
SIAO-SIALIC ACIDA2BAT0.78
SIAO-SIALIC ACIDA,B,C,D,E,F2WBV0.78
SIAO-SIALIC ACIDA,B1JSI0.78
SLT5-(ACETYLAMINO)-3,5-DIDEOXYNON-
2-ULOPYRANONOSYL-(2->3)-BETA-D-
LYXO-HEXOPYRANOSYL-(1->4)HEXOPYRANOSE		A1S0I0.72
SLT5-(ACETYLAMINO)-3,5-DIDEOXYNON-
2-ULOPYRANONOSYL-(2->3)-BETA-D-
LYXO-HEXOPYRANOSYL-(1->4)HEXOPYRANOSE		A1Z4X0.72
NGC3,5-dideoxy-5-[(hydroxyacetyl)amino]-
D-glycero-alpha-D-galacto-non-2-
ulopyranosonic acid		A,B,C,D,E3DWP0.77
NGC3,5-dideoxy-5-[(hydroxyacetyl)amino]-
D-glycero-alpha-D-galacto-non-2-
ulopyranosonic acid		A,B,C,D,E3DWQ0.77
75VN-{[(2S,3S)-3-(ETHOXYCARBONYL)OXIRAN-
2-YL]CARBONYL}-L-ISOLEUCYL-L-ALANINE		A2DCA0.7
SLB5-N-ACETYL-BETA-D-NEURAMINIC ACIDA,B2ZOE0.78
SLB5-N-ACETYL-BETA-D-NEURAMINIC ACIDA1DFQ0.78
SLB5-N-ACETYL-BETA-D-NEURAMINIC ACIDA,B,C,D,E,F1V0F0.78
SLB5-N-ACETYL-BETA-D-NEURAMINIC ACIDA3B500.78
SLB5-N-ACETYL-BETA-D-NEURAMINIC ACIDA,B1V3C0.78
SLB5-N-ACETYL-BETA-D-NEURAMINIC ACIDA,B1FV30.78
SLB5-N-ACETYL-BETA-D-NEURAMINIC ACIDA,B,C,D3E810.78
SLB5-N-ACETYL-BETA-D-NEURAMINIC ACIDF2JHL0.78
SLB5-N-ACETYL-BETA-D-NEURAMINIC ACIDA1FV20.78
SLB5-N-ACETYL-BETA-D-NEURAMINIC ACIDA,B1E8U0.78
SLB5-N-ACETYL-BETA-D-NEURAMINIC ACIDA2BER0.78
G285-N-ACETYL-4-AMINO-6-DIETHYLCARBOXAMIDE-
4,5-DIHYDRO-2H-PYRAN-2-CARBOXYLIC ACID		A2QWJ0.72
G285-N-ACETYL-4-AMINO-6-DIETHYLCARBOXAMIDE-
4,5-DIHYDRO-2H-PYRAN-2-CARBOXYLIC ACID		A2QWG0.72
ERNA2O430.7