General
Preferred name
APIGENIN
Synonyms
Apigenol ()
C.I. Natural Yellow 1 ()
4',5,7-Trihydroxyflavone ()
NSC 83244 ()
LY 080400 ()
Apigenin (LY 080400) ()
Apigenin-d5 ()
NSC-83244 ()
P&D ID
PD002200
CAS
520-36-5
461015-54-3
263711-74-6
Tags
natural product
drug candidate
nuisance
obsolete probe
available
Drug indication
Discovery agent
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
Molecular docking studies show interactions with 5-HT1A and 5-HT2A receptors . In vivo reductions in depressive and anxiety symptoms have been demonstrated in rodents.
(GtoPdb)
DESCRIPTION
Inhibits RNA polymerase
(Tocris Bioactive Compound Library)
DESCRIPTION
Arrests cell cycle at G2/M phase
(LOPAC library)
DESCRIPTION
Protein kinase inhibitor
(Tocriscreen Total)
[[ p.pathway_name ]]
[[ compound.targets[tid].gene_name ]]
Cell lines
16
Organisms
12
Compound Sets
22
AdooQ Bioactive Compound Library
Concise Guide to Pharmacology 2017/18
Concise Guide to Pharmacology 2019/20
Concise Guide to Pharmacology 2021/22
Concise Guide to Pharmacology 2023/24
Drug Repurposing Hub
DrugBank
DrugMAP
Guide to Pharmacology
IPPI - DB
LOPAC library
LSP-MoA library (Laboratory of Systems Pharmacology)
MedChem Express Bioactive Compound Library
Nuisance compounds in cellular assays
Obsolete Compounds
ReFrame library
Selleckchem Bioactive Compound Library
TargetMol Bioactive Compound Library
The Spectrum Collection
Tocris Bioactive Compound Library
Tocriscreen Total
[[ a.name ]]
[[ ligand_id ]]
free of charge
External IDs
51
Molecular Weight
270.05
Hydrogen Bond Acceptors
5
Hydrogen Bond Donors
3
Rotatable Bonds
1
Ring Count
3
Aromatic Ring Count
3
cLogP
2.58
TPSA
90.9
Fraction CSP3
0.0
Chiral centers
0.0
Largest ring
6.0
QED
0.63
Structural alerts
4
aggregator (Aggregator Advisor)
Aggregators
aggregator (ZINC)
Aggregators
Nonspecific/NOS
Flavonoid
Nuisance compounds in cellular assays
historic compounds (Chemical Probes.org)
Obsolete
Related compounds
Custom attributes
(extracted from source data)
Pathway
Metabolism
Autophagy
Metabolic Enzyme/Protease
Target
CYP2C9
AKR1B1, AR, CDK6, CFTR, CYP19A1, CYP1B1, HSD17B1
Cytochrome P450
Endogenous Metabolite
P450 (e.g. CYP17)
Primary Target
Broad Spectrum Protein Kinase Inhibitors
MOA
Inhibitor
casein kinase inhibitor, cell proliferation inhibitor
Source data
