Molecule Details
InChIKeyWHGYBXFWUBPSRW-FOUAGVGXSA-N
Canonical SMILESOC[C@H]1O[C@@H]2O[C@H]3[C@H](O)[C@@H](O)[C@@H](O[C@H]4[C@H](O)[C@@H](O)[C@@H](O[C@H]5[C@H](O)[C@@H](O)[C@@H](O[C@H]6[C@H](O)[C@@H](O)[C@@H](O[C@H]7[C@H](O)[C@@H](O)[C@@H](O[C@H]8[C@H](O)[C@@H](O)[C@@H](O[C@H]1[C@H](O)[C@H]2O)O[C@@H]8CO)O[C@@H]7CO)O[C@@H]6CO)O[C@@H]5CO)O[C@@H]4CO)O[C@@H]3CO
Clinical Status Data-mined Candidate
Targets (Human+Pathogen)2
Pfam Stratification Homologous
Avg pChEMBL6.88
SourceBindingDB
2D Structure
2D structure
Activity Profile
DrugBank Annotations
DrugBank ID DB03995
Drug NameBetadex
CAS Number7585-39-9
Groups investigational
ATC Codes nan
Descriptionnan

Categories: Carbohydrates Compounds used in a research, industrial, or household setting Cyclodextrins Dextrins Diet, Food, and Nutrition Dietary Carbohydrates Excipients Food Food Additives Food Ingredients Glucans Pharmaceutic Aids Pharmaceutical Preparations Pharmaceutical Vehicles Physiological Phenomena Polysaccharides Sequestering Agents Starch
Cross-references: BindingDB: 11 ChEBI: 495055 CHEMBL415690 ChemSpider: 10469496 C13183 PubChem:444041 PubChem:46505830 RxCUI: 1362685
Target Activities (2)
Target Gene Organism Category Pfam pChEMBL Type Source
P42684 ABL2 Homo sapiens Human PF08919 PF07714 PF00017 PF00018 7.3 Kd BindingDB
P00519 ABL1 Homo sapiens Human PF08919 PF07714 PF00017 PF00018 6.5 IC50 BindingDB
DrugBank Target Actions (3)
Target Gene Target Name Action Type
O69007 O69007 Maltogenic amylase binder targets
P0AEX9 P0AEX9 Maltose/maltodextrin-binding periplasmic protein binder targets
Q08751 Q08751 Neopullulanase 2 binder targets