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Compound Detail

CHEMBL6067643

L-FUCOSE
🧪 Phase III
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🧪 Phase III
C[C@H](O)[C@@H](O)[C@@H](O)[C@H](O)C=O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL6067643
Name L-FUCOSE
Phase Phase III
Structure Type MOL
InChI Key PNNNRSAQSRJVSB-KCDKBNATSA-N

Known Names

(-)-fucose 6-deoxy-l-galactopyranose Avtx-803 CERC-803 Deoxygalactose-cerecor Elfucosa Elfucose Fucose Fucose, l- Fucose-cerecor L-(-)-fucose L-fucopyranose +3 more
3
Targets
15
Activities
3
Assay Types
0
PK Parameters
16
Publications
15
Known Names
1
Indications

Molecular Properties

164.2
MW (Da)
-2.35
ALogP
5
HBA
4
HBD
98.0
PSA (Ų)
0.35
QED
0
Ro5 Violations
4
Rot. Bonds

Drug Information

Molecule Type Small molecule
Chirality Single Enantiomer

Flags

Natural Product
USAN Year 2023

Extended Properties

Molecular Formula C6H12O5
MW 164.16
Aromatic Rings 0
Heavy Atoms 11
NP-Likeness 2.16

Indications

Leukocyte-Adhesion Deficiency Syndrome

Activity Summary

IC50 9 meas. best 6.04
Kd 3 meas. best 5.54
Ki 3 meas.

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Fucose-binding lectin PA-IIL
CHEMBL4523938
 IC50 6.04 5.72 910.0 3
Unchecked
CHEMBL612545
 IC50 5.61 5.3833 2460.0 3
PA-I galactophilic lectin
CHEMBL3351196
 Kd 5.54 5.54 2900.0 1
Unchecked
CHEMBL612545
 Kd 5.52 5.52 3000.0 1

Activity Data Samples

Top measurements by pChEMBL value

Target Type Rel. Value Units pChEMBL Assay PubMed
Fucose-binding lectin PA-IIL IC50 = 910.0 nM 6.04 Competitive inhibition of N-(fluorescein-5-yl)-N'-(alpha-L-fucopyranosyl ethylen... 31553873
Unchecked IC50 = 2460.0 nM 5.61 Inhibition of Pseudomonas aeruginosa PA14 LecB expressed in Escherichia coli BL2... 32924479
Unchecked IC50 = 2630.0 nM 5.58 Inhibition of Pseudomonas aeruginosa PAO1 LecB expressed in Escherichia coli BL2... 32924479
Fucose-binding lectin PA-IIL IC50 = 2740.0 nM 5.56 Inhibition of Pseudomonas aeruginosa PAO1 LecB after 6 hrs by fluorescence polar... 31553873
Fucose-binding lectin PA-IIL IC50 = 2740.0 nM 5.56 Inhibition of Pseudomonas aeruginosa LecB by fluorescence polarization assay 31449405
PA-I galactophilic lectin Kd = 2900.0 nM 5.54 Binding affinity to Pseudomonas aeruginosa PAO1 LecA assessed as dissociation co... 26804741
Unchecked Kd = 3000.0 nM 5.52 Binding affinity to Pseudomonas aeruginosa LecB -
Unchecked IC50 = 11000.0 nM 4.96 Binding affinity to Pseudomonas aeruginosa lectin LecB after 1 hr by enzyme-link... -

Literature References

PubMed DOI Target Context # Activities
7359528 10.1021/jm00176a008 SW613 2
17905738 10.1074/jbc.m706950200 Cryptosporidium parvum 2
17905738 10.1074/jbc.m706950200 Cryptosporidium hominis 2
17905738 10.1074/jbc.m706950200 Unchecked 2
24556146 10.1016/j.ejmech.2014.01.047 CD209 antigen 2
- 10.1039/C0MD00270D Unchecked 2
- 10.1039/C5MD00557D Lectin 2
31553873 10.1021/acs.jmedchem.9b01120 Fucose-binding lectin PA-IIL 2
32924479 10.1021/acs.jmedchem.0c00856 Unchecked 2
- 10.1016/0960-894X(95)00377-6 Tissue alpha-L-fucosidase 1
- 10.1016/S0960-894X(00)80649-6 Tissue alpha-L-fucosidase 1
7031247 10.1021/jm00143a005 Acrosin 1
- 10.1039/C2MD20338C CD209 antigen 1
- 10.1039/C3MD00346A Unchecked 1
31449405 10.1021/acs.jmedchem.9b00481 Fucose-binding lectin PA-IIL 1
26804741 10.1021/acs.jmedchem.5b01698 PA-I galactophilic lectin 1

Data from ChEMBL 36 via Core Engine