General
Preferred name
PUERARIN
Synonyms
kakonein ()
Puerarin 80 mm ()
NSC-380711 ()
NPI 031G ()
Daidzein 8-c-glucoside ()
P&D ID
PD019429
CAS
3681-99-0
Tags
available
drug candidate
natural product
Drug indication
Alcohol dependence
Cardiovascular disease
Drug Status
investigational
Max Phase
2.0
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
Puerarin is a plant-derived hydroxyisoflavone compound.
(GtoPdb)
DESCRIPTION
Puerarin is an isoflavone extracted from Pueraria root and is a 5-HT2C receptor antagonist. Puerarin inhibits the dorsal motor nucleus of the vagus (DMV)-vagus nerve pathway, which in turn leads to decreased fat absorption[1][2][3][4][5].
PRICE
68
DESCRIPTION
Puerarin is a natural isoflavone isolated from plants of the genus Pueraria used in traditional Chinese herbal medicine. It has antioxidant, antiinflammatory, antithrombotic activity. It activates calcium- and voltage-activated potassium channel Large conductance (KCa1.1), EC50=0.8 nM.
(Enamine Bioactive Compounds)
DESCRIPTION
Puerarin (Kakonein), also known as Kakonein, is a member of the class of compounds known as isoflavonoid C-glycosides. It is a 5-HT2C receptor antagonist.
(TargetMol Bioactive Compound Library)
[[ p.pathway_name ]]
[[ compound.targets[tid].gene_name ]]
Compound Sets
12
Cayman Chemical Bioactives
ChEMBL Drugs
Concise Guide to Pharmacology 2023/24
Drug Repurposing Hub
DrugBank
DrugMAP
Enamine Bioactive Compounds
Enamine BioReference Compounds
Guide to Pharmacology
MedChem Express Bioactive Compound Library
ReFrame library
TargetMol Bioactive Compound Library
[[ a.name ]]
[[ ligand_id ]]
free of charge
External IDs
31
Molecular Weight
416.11
Hydrogen Bond Acceptors
9
Hydrogen Bond Donors
6
Rotatable Bonds
3
Ring Count
4
Aromatic Ring Count
3
cLogP
0.39
TPSA
160.82
Fraction CSP3
0.29
Chiral centers
5.0
Largest ring
6.0
QED
0.35
Structural alerts
0
No structural alerts detected
Related compounds
Custom attributes
(extracted from source data)
Target
5-HT
5-HT Receptor
MOA
serotonin receptor antagonist
Pathway
GPCR/G protein
Neuronal Signaling
Neuroscience
Source data
