General
Preferred name
CASTANOSPERMINE
Synonyms
NSC-625381 ()
P&D ID
PD015692
CAS
79831-76-8
107244-34-8
Tags
available
drug candidate
Drug indication
Diabetic complication
Drug Status
experimental
Probe control
Probe control not defined
Orthogonal probes
0
No orthogonal probes found
Similar probes
0
No structurally similar probes found
Structure
P&D probe-likeness score
Structure formats
[[ format ]]
[[ compound[format === 'MOL' ? 'molblock' : format.toLowerCase()] ]]
Description
(extracted from source data)
DESCRIPTION
Castanospermine is a natural alkaloid that can be extracted from black beans or the Moreton Bay chestnut tree (Castanospermum australae). Castanospermine is an ¦Á/ ¦Â-glucosidase inhibitor. Castanospermine has anti-inflammatory, antiviral replication and anti-metastatic effects on prostate cancer. Castanospermine can be used as an immunosuppressant to prevent transplant rejection[1][2][3][4].
DESCRIPTION
Glucosidases α and β inhibitor
(Tocriscreen Total)
DESCRIPTION
Non-selective MAO inhibitor
(Tocris Bioactive Compound Library)
DESCRIPTION
Glucosidases alpha and beta inhibitor
(Tocriscreen Plus)
DESCRIPTION
Castanospermine is an indolizine alkaloid first isolated from the seeds of Australian tree Castanospermum austral. It inhibits α- and β-glucosidases.
(Enamine Bioactive Compounds)
[[ p.pathway_name ]]
[[ compound.targets[tid].gene_name ]]
Cell lines
1
Organisms
2
Compound Sets
15
Cayman Chemical Bioactives
ChEMBL Drugs
CZ-OPENSCREEN Bioactive Library
Drug Repurposing Hub
DrugBank
DrugMAP
Enamine Bioactive Compounds
JUMP-Target 1 Compound Set
Mcule NIBR MoA Box Subset
MedChem Express Bioactive Compound Library
Novartis Chemogenetic Library (NIBR MoA Box)
ReFrame library
Tocris Bioactive Compound Library
Tocriscreen Plus
Tocriscreen Total
[[ a.name ]]
[[ ligand_id ]]
free of charge
External IDs
33
Molecular Weight
189.1
Hydrogen Bond Acceptors
5
Hydrogen Bond Donors
4
Rotatable Bonds
0
Ring Count
2
Aromatic Ring Count
0
cLogP
-2.48
TPSA
84.16
Fraction CSP3
1.0
Chiral centers
5.0
Largest ring
6.0
QED
0.34
Structural alerts
0
No structural alerts detected
Related compounds
Custom attributes
(extracted from source data)
Target Type
Enzymes
Primary Target
Glycosylases
MOA
Inhibitor
alpha glucosidase inhibitor
glucosidase inhibitor
Member status
member
Target
GAA, GBA
GAA
Glycosidase
Pathway
Metabolic Enzyme/Protease
Source data
