Molecule Details
InChIKeyDRHXTSWSUAJOJZ-FMDGEEDCSA-N
Compound NameN-Acetyl-glucosamine thiazoline
Canonical SMILESCC1=N[C@@H]2[C@@H](O)[C@H](O)[C@@H](CO)O[C@@H]2S1
Clinical Status Data-mined Candidate
Targets (Human+Pathogen)3
Pfam Stratification Cross-Family
Avg pChEMBL6.79
SourceChEMBL;BindingDB
2D Structure
2D structure
Activity Profile
DrugBank Annotations
DrugBank ID DB03747
Drug NameN-Acetyl-glucosamine thiazoline
CAS Number179030-22-9
Groups experimental
ATC Codes nan
DescriptionN-Acetyl-glucosamine thiazoline (NAG-thiazoline) is an analog of the oxazolinium bicyclic intermediate leading from N-acetylglucosamine to 1,6-anhydro-N-acetylmuramic acid.

Categories: Amino Sugars Carbohydrates Hexosamines Sulfur Compounds
Cross-references: BindingDB: 50327038 CHEMBL257158 ChemSpider: 4451076 PDB: NGT PubChem:5289024 PubChem:46508064 RxCUI: 2597521 ZINC: ZINC000016051892
Target Activities (3)
Target Gene Organism Category Pfam pChEMBL Type Source
O60502 OGA Homo sapiens Human PF07555 7.2 Ki ChEMBL;BindingDB
P07686 HEXB Homo sapiens Human PF00728 PF14845 6.6 Ki ChEMBL;BindingDB
P06865 HEXA Homo sapiens Human PF00728 PF14845 6.6 Ki ChEMBL;BindingDB
DrugBank Target Actions (2)
Target Gene Target Name Action Type
O85361 O85361 beta-N-acetylhexosaminidase binder targets
P07686 HEXB Beta-hexosaminidase subunit beta binder targets