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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03289089

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
CR61-DEOXY-1-ACETYLAMINO-BETA-D-GLUCO-
2-HEPTULOPYRANOSONAMIDE
A1P4H0.76
CR61-DEOXY-1-ACETYLAMINO-BETA-D-GLUCO-
2-HEPTULOPYRANOSONAMIDE
A1FU80.76
NAU4,4,6,7,8,9-HEXAHYDROXY-5-METHYLCARBOXAMIDONONANOIC ACIDA,C1F7B0.74
F34N-[(3S,4R,5R,6R)-4,5,6-trihydroxyazepan-
3-yl]acetamide
A,B2W670.74
233[5-(3,4,5-TRIHYDROXY-6-HYDROXYMETHYL-
TETRAHYDRO-PYRAN-2-YLCARBAMOYL)-
PENTYL]-CARBAMIC ACID METHYL ESTER
D,E,F,G,H1MD20.77
GDL2-ACETAMIDO-2-DEOXY-D-GLUCONO-1,5-
LACTONE
A,B1UR90.75
GDL2-ACETAMIDO-2-DEOXY-D-GLUCONO-1,5-
LACTONE
A,B,C,D,E,F1O7A0.75
GDL2-ACETAMIDO-2-DEOXY-D-GLUCONO-1,5-
LACTONE
A,B1UR80.75
DT62,4-BIS(ACETYLAMINO)-1,5-ANHYDRO-
2,4-DIDEOXY-D-GLUCITOL
A,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P,Q,R
2HIL0.7
DT62,4-BIS(ACETYLAMINO)-1,5-ANHYDRO-
2,4-DIDEOXY-D-GLUCITOL
A2HI20.7
MG8N-OCTANOYL-N-METHYLGLUCAMINEA,B1SMH0.75
MG8N-OCTANOYL-N-METHYLGLUCAMINEA1Q610.75
MG8N-OCTANOYL-N-METHYLGLUCAMINEA1Q8U0.75
MG8N-OCTANOYL-N-METHYLGLUCAMINEA1SVE0.75
DL62-AZIDO-N-((2R,3R,4S,5S,6R)-3,4,5-
TRIHYDROXY-6-(HYDROXYMETHYL)-TETRAHYDRO-
2H-PYRAN-2-YL)ACETAMIDE
A2FFR0.74
NAV6,7,8,9-TETRAHYDROXY-5-METHYLCARBOXAMIDO-
4-OXONONANOIC ACID
A,C1F7B0.73
NBG1-N-ACETYL-BETA-D-GLUCOSAMINEA,B1L5Q0.73
NBG1-N-ACETYL-BETA-D-GLUCOSAMINEA,B3CEM0.73
NBG1-N-ACETYL-BETA-D-GLUCOSAMINEA,B1L5R0.73
NBG1-N-ACETYL-BETA-D-GLUCOSAMINEA,B1EXV0.73
NBG1-N-ACETYL-BETA-D-GLUCOSAMINEA,B1L5S0.73
NBG1-N-ACETYL-BETA-D-GLUCOSAMINEA,B1L7X0.73
NBG1-N-ACETYL-BETA-D-GLUCOSAMINEA1WW20.73
NBG1-N-ACETYL-BETA-D-GLUCOSAMINEA2PRJ0.73
NBG1-N-ACETYL-BETA-D-GLUCOSAMINEA,B1FC00.73
NBG1-N-ACETYL-BETA-D-GLUCOSAMINEA,B3CEJ0.73
NBG1-N-ACETYL-BETA-D-GLUCOSAMINEA,B3CEH0.73
NBG1-N-ACETYL-BETA-D-GLUCOSAMINEA,B1XOI0.73
NBG1-N-ACETYL-BETA-D-GLUCOSAMINEA,B3DDW0.73
NBG1-N-ACETYL-BETA-D-GLUCOSAMINEA,B1EM60.73
NBG1-N-ACETYL-BETA-D-GLUCOSAMINEA,B3DDS0.73
NBG1-N-ACETYL-BETA-D-GLUCOSAMINEA,B3DD10.73
HQ6N-[(3R,4S,5R,6R,7R)-3,5,6-trihydroxy-
7-(hydroxymethyl)azepan-4-yl]acetamide
A,B2W660.71
NAY6,7,8,9-TETRAHYDROXY-5-METHYLCARBOXAMIDO-
2-OXONONANOIC ACID
A,C1F740.74
IFL(3S,4R,5R)-3,4-DIHYDROXY-5-(HYDROXYMETHYL)PIPERIDIN-
2-ONE
A,B1UZ10.76
IFL(3S,4R,5R)-3,4-DIHYDROXY-5-(HYDROXYMETHYL)PIPERIDIN-
2-ONE
A2V380.76
IFL(3S,4R,5R)-3,4-DIHYDROXY-5-(HYDROXYMETHYL)PIPERIDIN-
2-ONE
A,B2VJX0.76
IFL(3S,4R,5R)-3,4-DIHYDROXY-5-(HYDROXYMETHYL)PIPERIDIN-
2-ONE
A1UZ40.76
HG91-DEOXY-1-[(2-HYDROXYETHYL)(NONANOYL)AMINO]HEXITOLA,B,C,D1SO20.73
4GPN-(BETA-D-GLUCOPYRANOSYL)OXAMIC ACIDA2F3P0.71
HMN2,4,6,7,8,9-HEXAHYDROXY-5-METHYLCARBOXAMIDO NONANOIC ACIDA,B,C,D1F730.77
8GPA2F3U0.72
CRA1-DEOXY-1-METHOXYCARBAMIDO-BETA-
D-GLUCO-2-HEPTULOPYRANOSONAMIDE
A1FS40.73
CRA1-DEOXY-1-METHOXYCARBAMIDO-BETA-
D-GLUCO-2-HEPTULOPYRANOSONAMIDE
A1B4D0.73
NGC3,5-dideoxy-5-[(hydroxyacetyl)amino]-
D-glycero-alpha-D-galacto-non-2-
ulopyranosonic acid
A,B,C,D,E3DWP0.7
NGC3,5-dideoxy-5-[(hydroxyacetyl)amino]-
D-glycero-alpha-D-galacto-non-2-
ulopyranosonic acid
A,B,C,D,E3DWQ0.7
BGNN-BUTANOYL-2-AMINO-2-DEOXY-GLUCOPYRANOSIDEA,B,C,D1NWG0.7