General
Preferred name
biochanin A
Synonyms
ICX5609037 ()
4-methylgenistein ()
Olmelin ()
BIOCHANIN ()
P&D ID
PD001613
CAS
491-80-5
Tags
available
drug candidate
natural product
Drug indication
Discovery agent
Drug Status
investigational
Structure
Probe scores
P&D probe-likeness score
[[ v.score ]]%
Structure formats
[[ format ]]
[[ compound[format === 'MOL' ? 'molblock' : format.toLowerCase()] ]]
Description
(extracted from source data)
DESCRIPTION Biochanin A is a naturally occurring fatty acid amide hydrolase (FAAH) inhibitor, which inhibits FAAH with IC50s of 1.8, 1.4 and 2.4 ¦ÌM for mouse, rat, and human FAAH, respectively.
PRICE 29
DESCRIPTION Biochanin A (4-Methylgenistein) is an isoflavone derivative isolated from red clover Trifolium pratense with anticarcinogenic properties. Biochanin A is a naturally occurring fatty acid amide hydrolase (FAAH) inhibitor.
DESCRIPTION Biochanin A is a phytochemical present in Trifolium pratense L (red clover). It acts as a phytoestrogen. (GtoPdb)
Cell lines
2
Organisms
4
Compound Sets
13
AdooQ Bioactive Compound Library
A10146
Cayman Chemical Bioactives
16476
Drug Repurposing Hub
DrugBank
DB15334
DrugMAP
DM0HPWY
DrugMatrix
EUbOPEN Chemogenomics Library
EUB0001890
Guide to Pharmacology
2829
MedChem Express Bioactive Compound Library
HY-14595
Novartis Chemogenetic Library (NIBR MoA Box)
Selleckchem Bioactive Compound Library
Biochanin-A(4-Methylgenistein)
The Spectrum Collection
ZINC Tool Compounds
ZINC000018847037
External IDs
35
Properties
(calculated by RDKit )
Molecular Weight
284.07
Hydrogen Bond Acceptors
5
Hydrogen Bond Donors
2
Rotatable Bonds
2
Ring Count
3
Aromatic Ring Count
3
cLogP
2.88
TPSA
79.9
Fraction CSP3
0.06
Chiral centers
0.0
Largest ring
6.0
QED
0.76
Structural alerts
0
No structural alerts detected
Custom attributes
(extracted from source data)
Member status
virtual
MOA
Androgen Receptor Antagonists
Steroid 5alpha-Reductase Inhibitors
PPARalpha Agonists
PPARgamma Agonists
protein tyrosine kinase inhibitor
Target
CYP19A1, ESRRA, ESRRB, ESRRG, FASN
Autophagy
Endogenous Metabolite
FAAH
Pathway
Metabolic Enzyme/Protease
Neuronal Signaling
Recommended Cell Concentration
None
Source data