General
Preferred name
EBSELEN
Synonyms
ML011 ()
Dr-3305 ()
SPI-1005 ()
PZ-51 ()
CCG-39161 ()
Selenium compound 3 ()
DR 3305, SPI-1005, PZ-51, CCG-39161 ()
NSC-639762 ()
Ebselene ()
DR-3305 ()
NSC-757883 ()
DR3305 ()
Ebseleno ()
P&D ID
PD002767
CAS
60940-34-3
Tags
available
probe
covalent binder
obsolete probe
drug
Drug indication
Reperfusion injury and stroke
hearing loss
Coronavirus Disease 2019 (COVID-19)
Reperfusion injury
Drug Status
approved
investigational
Max Phase
3.0
Probe info
Probe type
experimental probe
Probe sources
MLP Probes
Probe targets
[[ compound.targets[t].gene_name ]]
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
Ebselen (SPI-1005), a glutathione peroxidase mimetic, is a potent voltage-dependent calcium channel (VDCC) blocker[1][2]. Ebselen potently inhibits Mpro (IC50=0.67 ¦ÌM) and COVID-19 virus (EC50=4.67 ¦ÌM)[3].Ebselen is an inhibitor of HIV-1 capsid CTD dimerization. Ebselen, an organoselenium compound, can permeate the blood-brain barrier and has anti-inflammatory, antioxidant and anticancer activity[4][5].
PRICE
43
DESCRIPTION
A synthetic organoselenium molecule with anti-inflammatory, anti-oxidant and cytoprotective activity, characterised as a small molecule Gq protein inhibitor.
Ebselen also demonstrates antimicrobial activity. A bioRxiv preprint suggests that ebselen is a low micromolar, covalent, fast-binding inhibitor of papain-like protease (PL-pro) from SARS-CoV-2 . This study also reports that ebselen is less active against SARS-CoV, and binds more slowly to this enzyme homologue. (GtoPdb)
Ebselen also demonstrates antimicrobial activity. A bioRxiv preprint suggests that ebselen is a low micromolar, covalent, fast-binding inhibitor of papain-like protease (PL-pro) from SARS-CoV-2 . This study also reports that ebselen is less active against SARS-CoV, and binds more slowly to this enzyme homologue. (GtoPdb)
DESCRIPTION
To identify small molecule modulators of KvBeta that are cell permeable and have a Km sufficient for in vitro cellular physiology assays.
(MLP Probes)
DESCRIPTION
Antioxidant; inhibits mammalian lipoxygenases and glutathione S-transferase
(LOPAC library)
DESCRIPTION
Adenosine analog; antifungal antibiotic
(Tocris Bioactive Compound Library)
DESCRIPTION
Ebselen (CCG-39161) is a organoselenium compound with anti-inflammatory, anti-oxidant and cytoprotective activity. Ebselen acts as a glutathione peroxidase mimetic and is thereby able to prevent cellular damage induced by reactive oxygen species (ROS). In addition, this agent inhibits the activity of a variety of enzymes including nitric oxide synthase (NOS), 5-lipoxygenase, cyclooxygenase, protein kinase C (PKC), NADPH oxidase and gastric H+/K+-ATPase. Furthermore, ebselen may be neuroprotective due to its ability to neutralize free radicals upon NMDA receptor activation thus, reducing lipoperoxidation mediated by glutamate-induced excitotoxicity.
(TargetMol Bioactive Compound Library)
[[ p.pathway_name ]]
[[ compound.targets[tid].gene_name ]]
Cell lines
13
Organisms
10
Compound Sets
25
A Collection of Useful Nuisance Compounds (CONS) for Interrogation of Bioassay Integrity
Axon Medchem Screening Library
Cayman Chemical Bioactives
ChEMBL Drugs
CovalentInDB
Drug Repurposing Hub
DrugBank
DrugMAP Approved Drugs
DrugMatrix
Enamine Bioactive Compounds
Guide to Pharmacology
LOPAC library
LSP-MoA library (Laboratory of Systems Pharmacology)
MedChem Express Bioactive Compound Library
MLP Probes
MLSMR Probes +
NIH Clinical Collections (NCC)
NPC Screening Collection
Obsolete Compounds
ReFrame library
Selleckchem Bioactive Compound Library
TargetMol Bioactive Compound Library
The Spectrum Collection
Tocris Bioactive Compound Library
[[ a.name ]]
[[ ligand_id ]]
free of charge
External IDs
166
Molecular Weight
274.98
Hydrogen Bond Acceptors
2
Hydrogen Bond Donors
0
Rotatable Bonds
1
Ring Count
3
Aromatic Ring Count
3
cLogP
2.05
TPSA
22.0
Fraction CSP3
0.0
Chiral centers
0.0
Largest ring
6.0
QED
0.72
Structural alerts
2
historic compounds (Chemical Probes.org)
Obsolete
Nonspecific reactivity
Nuisance compounds
Related compounds
Custom attributes
(extracted from source data)
Classification
Probe
Selectivity
.
Lipoxygenases / glutathione S-transferase
Target
Reactive Oxygen Species
Calcium Channel
COX
HIV
phosphatase
Virus Protease
Ferroptosis
ALB
Glutathione peroxidase mimic
COVID-19,HIV
Pathway
NF-¦ÊB
Apoptosis
Anti-infection
Membrane Transporter/Ion Channel
Metabolic Enzyme/Protease
Neuronal Signaling
Immunology/Inflammation
Metabolism
Microbiology/virology
Neuroscience
Proteases/Proteasome
Primary Target
Antioxidants
MOA
cyclooxygenase inhibitor, glutathione peroxidase agonist, H+/K+-ATPase inhibitor, nitric oxide synthase inhibitor
Therapeutic Class
Fibrinolytic Agents
Antiviral Agents
Nuisance MOA
thiol electrophile
Targets
Insulin-degrading enzyme
UDP-glucose 4-epimerase
Toxin B
Source data
