Isoprenaline (CED0001429)

Record Information

Version

1.0

Creation Date

2014-10-14 21:18:14 UTC

Update Date

2026-05-14 16:57:08 UTC

SynCED ID

CED0001429

Secondary Accession Numbers

CHEM003933
T3D4979

Identification

Common Name

Isoprenaline

Class

Small Molecule

Description

Isoprenaline is an endogenous compound with the formula C11H17NO3 and an average molecular weight of 211.26 g/mol. It exists as a solid at room temperature. Isoprenaline belongs to the benzenediols, a subclass of phenols within the organic compounds. This compound acts as a biological agonist (PMC3920298 ) and serves as a modulator or stabilization agent for protein targets including the Beta-1, Beta-2, and Beta-3 adrenergic receptors (ADRB1, ADRB2, ADRB3), as well as the Phosphatidylinositol 3-kinase regulatory subunit alpha (PIK3R1) and five other proteins. It is used as a heart stimulant and a bronchodilator. In terms of healthcare and veterinary applications, it is categorized among drugs for obstructive airway diseases and cardiac stimulants excluding cardiac glycosides. Its recorded exposure routes include intravenous, intramuscular, subcutaneous, respiratory, and intracardiac administration. Isoprenaline has been associated with myocardial infarction (PMC4661898 ). Isoprenaline is found in or released from 17 recorded sources. These include healthcare, pharmaceuticals, and veterinary products; food, food processing, and cookware, specifically the treatment of hops and the preparation of wine or sparkling wine, as well as food preservation; and electrical and electronic equipment, including television systems, electrodes, conductive bodies, and electrically stimulated smoking devices. It is also found in building and construction materials such as ladders, and in household cleaning and consumer products, including bleaching agents, perfumes within soaps and detergents, cigar cigarettes, non-electric simulated smoking devices, and other smoking requisites.

Contaminant Type

Adrenergic beta-Agonist
Bronchodilator Agent
Cardiotonic Agent
Drug
Metabolite
Sympathomimetic
Synthetic Compound

Chemical Structure

MOL SDF PDB SMILES InChI

Synonyms

Value	Source
(+-)-Isoprenaline	ChEBI
(+-)-Isoproterenol	ChEBI
1-(3,4-Dihydroxyphenyl)-2-(isopropylamino)ethanol	ChEBI
1-(3,4-Dihydroxyphenyl)-2-isopropylaminoethanol	ChEBI
3,4-Dihydroxy-alpha-[(isopropylamino)methyl]benzyl alcohol	ChEBI
alpha-(Isopropylaminomethyl)protocatechuyl alcohol	ChEBI
Isoprenalina	ChEBI
Isoprenalinum	ChEBI
Isopropyl noradrenaline	ChEBI
N-Isopropyl-beta-dihydroxyphenyl-beta-hydroxyethylamine	ChEBI
N-Isopropylnoradrenaline	ChEBI
N-Isopropylnorepinephrine	ChEBI
Isoprenaline	Kegg
3,4-Dihydroxy-a-[(isopropylamino)methyl]benzyl alcohol	Generator
3,4-Dihydroxy-α-[(isopropylamino)methyl]benzyl alcohol	Generator
a-(Isopropylaminomethyl)protocatechuyl alcohol	Generator
Α-(isopropylaminomethyl)protocatechuyl alcohol	Generator
N-Isopropyl-b-dihydroxyphenyl-b-hydroxyethylamine	Generator
N-Isopropyl-β-dihydroxyphenyl-β-hydroxyethylamine	Generator
Epinephrine isopropyl homolog	HMDB
Isoprenalin	HMDB
Isopropydrin	HMDB
Isopropyladrenaline	HMDB
Isopropylarterenol	HMDB
Isopropylnoradrenaline	HMDB
Isopropylnorepinephrine	HMDB
Isoproterenol chloride	HMDB
L-Isopropylnoradrenaline	HMDB
L-Isoproterenol	HMDB
Euspiran	HMDB
Isuprel	HMDB
Isadrin	HMDB
4-(1-Hydroxy-2-((1-methylethyl)amino)ethyl)-1,2-benzenediol	HMDB
Norisodrine	HMDB
Hydrochloride, isoproterenol	HMDB
Isadrine	HMDB
Isoproterenol hydrochloride	HMDB
Isoproterenol sulfate	HMDB
Izadrin	HMDB
Noradrenaline, isopropyl	HMDB
Novodrin	HMDB
Sulfate, isoproterenol	HMDB
Isoproterenol	ChEBI

Chemical Formula

C₁₁H₁₇NO₃

Average Molecular Mass

211.258 g/mol

Monoisotopic Mass

211.121 g/mol

CAS Registry Number

7683-59-2

IUPAC Name

4-{1-hydroxy-2-[(propan-2-yl)amino]ethyl}benzene-1,2-diol

Traditional Name

isoproterenol

SMILES

CC(C)NCC(O)C1=CC(O)=C(O)C=C1

InChI Identifier

InChI=1S/C11H17NO3/c1-7(2)12-6-11(15)8-3-4-9(13)10(14)5-8/h3-5,7,11-15H,6H2,1-2H3

InChI Key

JWZZKOKVBUJMES-UHFFFAOYSA-N

Chemical Taxonomy

Description

Belongs to the class of organic compounds known as catechols. Catechols are compounds containing a 1,2-benzenediol moiety.

Kingdom

Super Class

Class

Sub Class

Direct Parent

Alternative Parents

Substituents

Catechol
1-hydroxy-4-unsubstituted benzenoid
1-hydroxy-2-unsubstituted benzenoid
Aralkylamine
Monocyclic benzene moiety
1,2-aminoalcohol
Secondary alcohol
Secondary amine
Secondary aliphatic amine
Aromatic alcohol
Alcohol
Organooxygen compound
Organonitrogen compound
Organic oxygen compound
Organic nitrogen compound
Amine
Organopnictogen compound
Hydrocarbon derivative
Aromatic homomonocyclic compound

Molecular Framework

Aromatic homomonocyclic compounds

External Descriptors

secondary alcohol (CHEBI:64317 )
catechols (CHEBI:64317 )
secondary amino compound (CHEBI:64317 )

Biological Properties

Status

Detected and Not Quantified

Origin

Endogenous

Cellular Locations

Cytoplasm
Membrane

Biofluid Locations

Not Available

Tissue Locations

Not Available

Applications

Not Available

Biological Roles

sympathomimetic agent (PMC9775352 )?
beta-adrenergic agonist (PMC13083795 , PMC367869 )?
adrenergic agonist (PMC8198312 )?
agonist (PMC3920298 , PMC5805400 )?
antagonist (PMC11901469 )?Substance that attaches to and blocks cell receptors that normally bind naturally occurring substances.
cardiotoxic agent (PMC9706019 )?A role played by a chemical compound exihibiting itself through the ability to induce damage to the heart and cardiomyocytes.
antioxidant (PMC11901469 )?
farnesoid X receptor agonist (PMC7468124 )?
catecholamine (PMC6472278 , PMC4661898 )?

Chemical Roles

Not Available

Organoleptic Effects

Not Available

Physical Properties

State

Solid

Appearance

Not Available

Experimental Properties

Property	Value
Melting Point	180 °C
Boiling Point	Not Available
Solubility	5.86e+00 g/L

Predicted Properties

Property	Value	Source
Water Solubility	5.86 g/L	ALOGPS
logP	-0.27	ALOGPS
logP	0.24	ChemAxon
logS	-1.6	ALOGPS
pKa (Strongest Acidic)	9.81	ChemAxon
pKa (Strongest Basic)	8.96	ChemAxon
Physiological Charge	1	ChemAxon
Hydrogen Acceptor Count	4	ChemAxon
Hydrogen Donor Count	4	ChemAxon
Polar Surface Area	72.72 Å²	ChemAxon
Rotatable Bond Count	4	ChemAxon
Refractivity	58.4 m³·mol⁻¹	ChemAxon
Polarizability	23.04 Å³	ChemAxon
Number of Rings	1	ChemAxon
Bioavailability	Yes	ChemAxon
Rule of Five	Yes	ChemAxon
Ghose Filter	Yes	ChemAxon
Veber's Rule	No	ChemAxon
MDDR-like Rule	No	ChemAxon

Spectra

Spectrum Type	Description	Splash Key	Deposition Date	View
Predicted GC-MS	Predicted GC-MS Spectrum	splash10-05gr-9700000000-1d8ddbb3b9ecf4bd4e41	Not Available	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum	splash10-001i-4193300000-51704909fccedbd3a27f	Not Available	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum	Not Available	Not Available	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum	Not Available	Not Available	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum	Not Available	Not Available	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum	Not Available	Not Available	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum	Not Available	Not Available	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum	Not Available	Not Available	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum	Not Available	Not Available	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum	Not Available	Not Available	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum	Not Available	Not Available	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum	Not Available	Not Available	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum	Not Available	Not Available	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum	Not Available	Not Available	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum	Not Available	Not Available	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum	Not Available	Not Available	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum	Not Available	Not Available	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum	Not Available	Not Available	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum	Not Available	Not Available	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum	splash10-01ox-0940000000-a69543d0053d7699ab89	Not Available	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum	splash10-0udu-0900000000-6d817d647f12c2387c5b	Not Available	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum	splash10-0zg3-7900000000-4048df303bf76bdeb169	Not Available	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum	splash10-03di-1390000000-f9a4d1db36e6a6829da6	Not Available	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum	splash10-08fu-4940000000-b4ce8517db087019ae02	Not Available	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum	splash10-0a4i-8900000000-70b5626c51c5c776cac0	Not Available	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum	splash10-0006-0920000000-cf36ef242942ec87ce21	Not Available	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum	splash10-0udi-4900000000-5b84f5f51437a459c629	Not Available	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum	splash10-0k9j-8900000000-1d0384f1f487a005b30c	Not Available	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum	splash10-03di-0090000000-840d7dbcf79278e91a76	Not Available	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum	splash10-01w0-0910000000-545a4d1a8047f492d874	Not Available	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum	splash10-0a4u-5900000000-5b03f3b94e0d996de579	Not Available	View Spectrum
1D NMR	¹H NMR Spectrum (1D, D₂O, predicted)	Not Available	Not Available	View Spectrum
1D NMR	¹³C NMR Spectrum (1D, D₂O, predicted)	Not Available	Not Available	View Spectrum

Toxicity Profile

Toxicity Values

Toxicity Value	Organism	Dose Descriptor	Route of Exposure	Predicted or Experimental	Toxicity Rating	Reference
734.0 Log mg/kg [410:1300]	Rat	LD50	oral	predicted	Not Available	Not Available

Toxicity / Toxin Class

Not Available

Mechanism of Toxicity

The pharmacologic effects of isoproterenol are at least in part attributable to stimulation through beta-adrenergic receptors of intracellular adenyl cyclase, the enzyme that catalyzes the conversion of adenosine triphosphate (ATP) to cyclic AMP. Increased cyclic AMP levels are associated with relaxation of bronchial smooth muscle and inhibition of release of mediators of immediate hypersensitivity from cells, especially from mast cells.

Carcinogenicity (IARC Classification)

No indication of carcinogenicity to humans (not listed by IARC).

Minimum Risk Level

Not Available

Symptoms

Not Available

Treatment

Not Available

Health Effects

Health Effect	Relationship	Direction	Description	Reference
inflammation	Associated With?	Not Available	Not Available	PMC9706019
necrosis	Associated With?	Not Available	A disorder characterized as a form of cell injury which results in the premature death of cells in living tissue by autolysis.	PMC4661898 , PMC9706019
myocardial infarction	Associated With?	Not Available	A disorder characterized by gross necrosis of the myocardium; this is due to an interruption of blood supply to the area. (NCI CTCAE)	PMC4661898
edema	Associated With?	Not Available	A disorder characterized by swelling due to an excessive accumulation of fluid (NCI CTCAE)	PMC4661898 , PMC4661898
coronary artery disease	Associated With?	Not Available	An artery disease that is characterized by plaque building up along the inner walls of the arteries of the heart resulting in a narrowing of the arteries and a reduced blood supply to the cardiac muscles. (DO)	PMC4661898
bradycardia	Not Available	Not Available	Not Available	PMC11979624
Oxidative Stress	Associated With?	increase	Not Available	PMC7482027
Oxidative Stress	Associated With?	Not Available	Not Available	PMC7482027 , PMC3490947
Fibrosis	Associated With?	increase	Not Available	PMC9706019
Cardiotoxicity	Associated With?	Not Available	Not Available	PMC6472278 , PMC7482027
Heart Rate	Associated With?	decrease	Not Available	PMC4661898
Hematologic Neoplasms	Associated With?	Not Available	Not Available	PMC11643848
Hypoxia	Associated With?	Not Available	Not Available	PMC3490947
cardiac rhythm disease	Associated With?	Not Available	Not Available	PMC7223859 , PMC8453449
Vascular System Injuries	Associated With?	Not Available	Not Available	PMC9706019
Ventricular Dysfunction	Associated With?	Not Available	Not Available	PMC4661898

Exposure Sources

Source ID	Source	Sector	Reference
CEDs000010	Insecticides?Insecticides are synthetic chemicals designed to control or eliminate insect pests that threaten crops and other agricultural products.	Agriculture & land management	PubChem
CEDs000233	Brushes?Brushes used in personal care and cosmetics can be a source of synthetic chemical contamination due to the materials and coatings used in their manufacturing.	Personal care & cosmetics	PubChem
CEDs000286	Cardiac stimulants excl. cardiac glycosides?Cardiac stimulants, excluding cardiac glycosides, encompass a range of synthetic compounds used to enhance cardiac output and improve heart function.	Healthcare, pharmaceuticals & veterinary products	Not Available
CEDs000391	Drugs for obstructive airway diseases?Drugs for obstructive airway diseases, such as bronchodilators and corticosteroids, are used to manage conditions like asthma and chronic obstructive pulmonary disease (COPD).	Healthcare, pharmaceuticals & veterinary products	Not Available
CEDs000498	Ladders?Ladders, commonly used in various construction and maintenance activities, can become a source of synthetic chemical contamination due to the materials and coatings applied during their manufacture and use.	Building & Construction	PubChem
CEDs000511	Conductors Or Conductive Bodies Characterised By The Conductive Materials?Conductors, or conductive bodies, are materials that allow the flow of electrical current, typically made from metals such as copper, aluminum, or silver.	Electrical & Electronic Equipment	PubChem
CEDs000518	Electrically Stimulated Smoking Devices?Electrically stimulated smoking devices, commonly known as e-cigarettes or vape pens, utilize electrical components to heat a liquid solution, often containing nicotine, flavorings, and other additives, to produce an aerosol for inhalation.	Electrical & Electronic Equipment	PubChem
CEDs000519	Electrodes?Electrodes, used in various electrical and electronic applications, can be a source of synthetic chemical contamination due to the materials from which they are constructed and the processes involved in their manufacturing.	Electrical & Electronic Equipment	PubChem
CEDs000537	Television Systems?Television systems can be a source of synthetic chemical contamination due to the various materials and components used in their manufacture and operation.	Electrical & Electronic Equipment	PubChem
CEDs000545	Food Preservation?Food preservation often involves the use of synthetic chemicals, such as preservatives, flavor enhancers, and color additives, to extend shelf life and enhance the sensory qualities of food products.	Food, food processing & cookware	PubChem
CEDs000549	Preparation Of Wine Or Sparkling Wine?The preparation of wine or sparkling wine involves various stages, including fermentation, aging, and bottling, which can introduce potential sources of synthetic chemical contamination.	Food, food processing & cookware	PubChem
CEDs000553	Treatment Of Hops?Hops, a key ingredient in brewing and food flavoring, can be a source of synthetic chemical contamination due to various agricultural practices.	Food, food processing & cookware	PubChem
CEDs000555	Bleaching Agents?Bleaching agents are chemical substances used to whiten or lighten materials, often employed in various cleaning products for their stain removal and disinfecting properties.	Household cleaning & consumer products	PubChem
CEDs000556	Cigar Cigarettes?Cigar cigarettes are a source of synthetic chemical contamination due to the combustion of various tobacco blends and additives.	Household cleaning & consumer products	PubChem
CEDs000559	Non Electric Simulated Smoking Devices?Non-electric simulated smoking devices, often designed to mimic the experience of smoking without combustion, can be sources of synthetic chemical contamination due to the materials and chemicals used in their construction and operation.	Household cleaning & consumer products	PubChem
CEDs000560	Other Smoking Requisites?Other smoking requisites, including items such as lighters, matches, and rolling papers, can introduce synthetic chemical contamination through various components and additives.	Household cleaning & consumer products	PubChem
CEDs000561	Perfumes Within Detergents And Soaps?Perfumes within detergents and soaps are synthetic fragrance compounds added to enhance the sensory experience of cleaning products.	Household cleaning & consumer products	PubChem
CEDs000563	Soap Detergents?Soap detergents are synthetic surfactants designed to enhance the cleaning efficacy of water by reducing surface tension, allowing for better interaction with dirt and grease.	Household cleaning & consumer products	PubChem
CEDs000569	Tobacco Smoke Filters?Tobacco smoke filters are designed to reduce the inhalation of harmful substances in cigarette smoke, including tar and other particulate matter.	Household cleaning & consumer products	PubChem
CEDs000579	Manufacture Of Iron Or Steel?The manufacture of iron or steel involves various processes, including smelting, refining, and alloying, which can result in the release of synthetic chemicals and contaminants.	Industrial manufacturing & chemical processing	PubChem
CEDs000580	Manufacture Preparation Of Tobacco Products?The manufacture and preparation of tobacco products involve various processes that can result in the introduction of synthetic chemicals into the environment.	Industrial manufacturing & chemical processing	PubChem
CEDs000596	Acaricides?Acaricides are synthetic chemicals specifically designed to target and control mite populations that can damage crops and plants.	Agriculture & land management	PubChem
CEDs000597	Chemosterilants?Chemosterilants are synthetic chemicals designed to induce sterility in target pest populations, thereby controlling their reproduction and mitigating damage to crops.	Agriculture & land management	PubChem
CEDs000600	Herbicides And Algicides?Herbicides and algicides are synthetic chemicals primarily used to control unwanted plants and algae in various environments.	Agriculture & land management	PubChem
CEDs000602	Molluscicides?Molluscicides are synthetic chemicals specifically designed to control and eliminate mollusks, such as snails and slugs, which can be detrimental to crops and agricultural productivity.	Agriculture & land management	PubChem
CEDs000603	Nematocides?Nematocides are synthetic chemicals specifically designed to control nematodes, which are microscopic roundworms that can cause significant damage to crops and plants.	Agriculture & land management	PubChem
CEDs000605	Pest Repellants?Pest repellents, often formulated from synthetic chemicals, are widely used to protect crops from insect infestations and other pests.	Agriculture & land management	PubChem
CEDs000609	Aftershave?Aftershave is a grooming product typically used to soothe and protect the skin following shaving.	Personal care & cosmetics	PubChem
CEDs000610	Aftersun Products?Aftersun products are designed to soothe and hydrate the skin after sun exposure, often containing various synthetic chemicals such as emollients, preservatives, and fragrances.	Personal care & cosmetics	PubChem
CEDs000611	Anti Perspirants Or Body Deoderants?Antiperspirants and body deodorants commonly contain synthetic chemicals such as aluminum compounds, parabens, and synthetic fragrances.	Personal care & cosmetics	PubChem
CEDs000613	Depilatories?Depilatories are products designed to remove unwanted hair through the application of synthetic chemicals that break down the protein structure of hair, facilitating its removal.	Personal care & cosmetics	PubChem
CEDs000614	Essential Oils Or Perfumes?Essential oils and perfumes are complex mixtures of volatile compounds derived from natural or synthetic sources, commonly used for their aromatic properties.	Personal care & cosmetics	PubChem
CEDs000615	Eye Makeup Products?Eye makeup products, including mascaras, eyeliners, and eyeshadows, often contain a variety of synthetic chemicals such as pigments, preservatives, and film-forming agents.	Personal care & cosmetics	PubChem
CEDs000617	Lip Care Products?Lip care products, including lipsticks, balms, and glosses, often contain a variety of synthetic chemicals such as parabens, phthalates, and synthetic fragrances.	Personal care & cosmetics	PubChem
CEDs000618	Lip Makeup Products?Lip makeup products, such as lipsticks, lip glosses, and lip liners, often contain a variety of synthetic chemicals, including pigments, preservatives, and emollients.	Personal care & cosmetics	PubChem
CEDs000619	Manicure Pedicure?Manicure and pedicure procedures often involve the use of various synthetic chemicals, including solvents, nail polishes, and nail adhesives.	Personal care & cosmetics	PubChem
CEDs000632	Apparel?Apparel production often involves the use of various synthetic chemicals, including dyes, finishing agents, and preservatives.	Textiles, leather & furnishings	PubChem
CEDs000633	Azo Dyes?Azo dyes are synthetic organic compounds characterized by the presence of one or more azo groups (-N=N-), which are widely used for coloring textiles, leather, and furnishings.	Textiles, leather & furnishings	PubChem
CEDs000642	Footwear?Footwear production often involves the use of various synthetic chemicals, such as adhesives, dyes, and treatments, which can contribute to environmental contamination.	Textiles, leather & furnishings	PubChem
CEDs000650	Purses Luggage Hand Bags?Purses, luggage, and handbags are often manufactured using synthetic materials such as polyvinyl chloride (PVC), polyurethane, and various types of nylon.	Textiles, leather & furnishings	PubChem
CEDs000651	Purses Money Bags Wallets?Purses, money bags, and wallets are often manufactured using synthetic materials, including plastics, polyurethanes, and various treated fabrics.	Textiles, leather & furnishings	PubChem
CEDs000673	Unmanned Aerial Vehicles?Unmanned Aerial Vehicles (UAVs), commonly known as drones, utilize various synthetic chemicals in their manufacturing, operation, and maintenance processes.	Aviation & Aerospace	PubChem
CEDs000678	Nitrogenous Fertilisers?Nitrogenous fertilizers are synthetic chemical compounds primarily used to enhance plant growth by supplying essential nitrogen, a crucial nutrient for photosynthesis and protein synthesis.	Agriculture & land management	PubChem
CEDs000684	Cements?Cements are a composite material primarily used as a binding agent in construction applications, formed by the calcination of limestone and clay minerals at high temperatures.	Building & Construction	PubChem
CEDs000685	Ceramics?Ceramics can be a source of synthetic chemical contamination through various additives and processing agents used in their production.	Building & Construction	PubChem
CEDs000688	Glass Coatings?Glass coatings are synthetic chemical formulations applied to glass surfaces to enhance properties such as durability, UV resistance, and aesthetic appeal.	Building & Construction	PubChem
CEDs000692	Silica Free Oxide Glass?Silica Free Oxide Glass is a type of glass that is produced using alternative materials to traditional silica-based formulations.	Building & Construction	PubChem
CEDs000693	Silica Glass?Silica glass, primarily composed of silicon dioxide (SiO2), is widely used in various applications, including windows, glass facades, and insulation materials.	Building & Construction	PubChem
CEDs000696	Nanotechnology?Nanotechnology involves the manipulation of materials at the molecular or atomic level, typically within the range of 1 to 100 nanometers.	Industrial manufacturing & chemical processing	PubChem
CEDs000727	Printing Machines Or Presses?Printing machines or presses commonly utilize synthetic chemicals such as inks, solvents, and cleaning agents.	Paper, pulp & fiber products	PubChem
CEDs000734	Coating Compositions?Coating compositions, which include paints, sealants, and varnishes, are formulated with a variety of synthetic chemicals such as solvents, resins, pigments, and additives.	Building & Construction	PubChem
CEDs000738	Cooling Circuit Water?Cooling circuit water is utilized in various industrial processes to absorb and dissipate heat generated during operations.	Industrial manufacturing & chemical processing	PubChem
CEDs000739	Inks?Inks are complex mixtures composed of pigments or dyes, solvents, resins, and additives used primarily for printing and writing applications.	Paper, pulp & fiber products	PubChem
CEDs000740	Paper?Paper production involves the processing of wood fibers and the use of various chemicals, which can lead to synthetic chemical contamination.	Paper, pulp & fiber products	PubChem
CEDs000741	Pigment Pastes?Pigment pastes are concentrated dispersions of pigments used to impart color and properties to materials.	Paper, pulp & fiber products	PubChem
CEDs000744	Water, Wastewater, & Sewage Treatment?Water, wastewater, and sewage treatment processes are critical for managing and mitigating pollutants in water systems.	Wastewater, sanitation & biosolids	PubChem
CEDs01102	Pharmaceutical Preparations	Healthcare, pharmaceuticals & veterinary products	PMC3909396
CEDs01314	Soy Milk	Food, food processing & cookware	PMC11901469
CEDs02589	Air	Air, dust & atmospheric transport	PMC4115325
CEDs02591	Atmosphere	Air, dust & atmospheric transport	PMC1247611

Pathways

2 pathwaysPathway Source: PathBank

Isoprenaline Action Pathway

Isoprenaline B1-Adrenergic Cardiac Muscle Contraction Action Pathway

Targets

Structure	Protein	UniProt ID	Organism	Relationship	Details
Click to view 3D structure	Cytochrome P450 1A1	P00185	Rat	Known	Not Available
Click to view 3D structure	Cytochrome P450 1B1	Q16678	Humans	Known	Not Available
Click to view 3D structure	Cytochrome P450 2E1	P05181	Humans	Known	Not Available
Click to view 3D structure	Sulfotransferase 1A3	P0DMM9	Humans	Known	Not Available
Click to view 3D structure	Catechol O-methyltransferase	P21964	Humans	Known	Not Available
Click to view 3D structure	Estrogen receptor	P03372	Humans	Known	Not Available
Click to view 3D structure	Taste receptor type 2 member 50	P59544	Humans	Predicted (SEA)	Prediction Confidence Score 1.0 Applicability Domain 1.0 Statistical Significance 1.00e-05 Supporting Reference Compounds 1 E-value 0.0778492
Click to view 3D structure	Taste receptor type 2 member 45	P59539	Humans	Predicted (SEA)	Prediction Confidence Score 1.0 Applicability Domain 1.0 Statistical Significance 1.00e-05 Supporting Reference Compounds 1 E-value 0.0778492
Click to view 3D structure	Taste receptor type 2 member 42	Q7RTR8	Humans	Predicted (SEA)	Prediction Confidence Score 1.0 Applicability Domain 1.0 Statistical Significance 1.00e-05 Supporting Reference Compounds 1 E-value 0.0778492
Click to view 3D structure	Taste receptor type 2 member 41	P59536	Humans	Predicted (SEA)	Prediction Confidence Score 1.0 Applicability Domain 1.0 Statistical Significance 1.00e-05 Supporting Reference Compounds 1 E-value 0.0778492
Click to view 3D structure	Taste receptor type 2 member 7	Q9NYW3	Humans	Predicted (SEA)	Prediction Confidence Score 1.0 Applicability Domain 1.0 Statistical Significance 1.00e-05 Supporting Reference Compounds 1 E-value 0.0778492
Click to view 3D structure	Taste receptor type 2 member 30	P59541	Humans	Predicted (SEA)	Prediction Confidence Score 1.0 Applicability Domain 1.0 Statistical Significance 1.00e-05 Supporting Reference Compounds 1 E-value 0.0778492
Click to view 3D structure	Taste receptor type 2 member 60	P59551	Humans	Predicted (SEA)	Prediction Confidence Score 1.0 Applicability Domain 1.0 Statistical Significance 1.00e-05 Supporting Reference Compounds 1 E-value 0.0778492
Click to view 3D structure	Taste receptor type 2 member 19	P59542	Humans	Predicted (SEA)	Prediction Confidence Score 1.0 Applicability Domain 1.0 Statistical Significance 1.00e-05 Supporting Reference Compounds 1 E-value 0.0778492
Click to view 3D structure	Taste receptor type 2 member 20	P59543	Humans	Predicted (SEA)	Prediction Confidence Score 1.0 Applicability Domain 1.0 Statistical Significance 1.00e-05 Supporting Reference Compounds 1 E-value 0.0778492
Click to view 3D structure	Taste receptor type 2 member 1	Q9NYW7	Humans	Predicted (SEA)	Prediction Confidence Score 1.0 Applicability Domain 1.0 Statistical Significance 1.00e-05 Supporting Reference Compounds 1 E-value 0.0778492
Click to view 3D structure	Taste receptor type 2 member 40	P59535	Humans	Predicted (SEA)	Prediction Confidence Score 1.0 Applicability Domain 1.0 Statistical Significance 1.00e-05 Supporting Reference Compounds 1 E-value 0.0778492
Click to view 3D structure	Taste receptor type 2 member 3	Q9NYW6	Humans	Predicted (SEA)	Prediction Confidence Score 1.0 Applicability Domain 1.0 Statistical Significance 1.00e-05 Supporting Reference Compounds 1 E-value 0.0778492
Click to view 3D structure	Taste receptor type 2 member 13	Q9NYV9	Humans	Predicted (SEA)	Prediction Confidence Score 1.0 Applicability Domain 1.0 Statistical Significance 1.00e-05 Supporting Reference Compounds 1 E-value 0.0778492
Click to view 3D structure	Taste receptor type 2 member 39	P59534	Humans	Predicted (SEA)	Prediction Confidence Score 1.0 Applicability Domain 1.0 Statistical Significance 1.00e-05 Supporting Reference Compounds 1 E-value 0.0778492
Click to view 3D structure	Taste receptor type 2 member 5	Q9NYW4	Humans	Predicted (SEA)	Prediction Confidence Score 1.0 Applicability Domain 1.0 Statistical Significance 1.00e-05 Supporting Reference Compounds 1 E-value 0.0778492
Click to view 3D structure	Taste receptor type 2 member 9	Q9NYW1	Humans	Predicted (SEA)	Prediction Confidence Score 1.0 Applicability Domain 1.0 Statistical Significance 1.00e-05 Supporting Reference Compounds 1 E-value 0.0778492
Click to view 3D structure	Taste receptor type 2 member 43	P59537	Humans	Predicted (SEA)	Prediction Confidence Score 1.0 Applicability Domain 1.0 Statistical Significance 1.00e-05 Supporting Reference Compounds 1 E-value 0.0778492
Click to view 3D structure	Beta-2 adrenergic receptor	P07550	Humans	Predicted (SEA)	Prediction Confidence Score 0.891 Applicability Domain 1.0 Statistical Significance 1.00e-05 Supporting Reference Compounds 258 E-value 0.0778492
Click to view 3D structure	Beta-1 adrenergic receptor	B0FL73	Cavia porcellus	Predicted (SEA)	Prediction Confidence Score 0.772 Applicability Domain 1.0 Statistical Significance 3.00e-05 Supporting Reference Compounds 37 E-value 0.233548
Click to view 3D structure	Beta-2 adrenergic receptor	Q8K4Z4	Cavia porcellus	Predicted (SEA)	Prediction Confidence Score 0.772 Applicability Domain 1.0 Statistical Significance 1.00e-05 Supporting Reference Compounds 48 E-value 0.0778492
Click to view 3D structure	Beta-3 adrenergic receptor	P13945	Humans	Predicted (SEA)	Prediction Confidence Score 0.728 Applicability Domain 1.0 Statistical Significance 3.00e-05 Supporting Reference Compounds 145 E-value 0.233548
Click to view 3D structure	Beta-1 adrenergic receptor	P08588	Humans	Predicted (SEA)	Prediction Confidence Score 0.728 Applicability Domain 1.0 Statistical Significance 2.00e-05 Supporting Reference Compounds 180 E-value 0.155698
Click to view 3D structure	Beta-2 adrenergic receptor	Q28044	Bos taurus	Predicted (SEA)	Prediction Confidence Score 0.666 Applicability Domain 1.0 Statistical Significance 1.00e-05 Supporting Reference Compounds 16 E-value 0.0778492
Click to view 3D structure	Beta-1 adrenergic receptor	P18090	Rattus norvegicus	Predicted (SEA)	Prediction Confidence Score 0.644 Applicability Domain 1.0 Statistical Significance 6.00e-05 Supporting Reference Compounds 43 E-value 0.467095
Click to view 3D structure	Beta-1 adrenergic receptor	P34971	Mus musculus	Predicted (SEA)	Prediction Confidence Score 0.614 Applicability Domain 1.0 Statistical Significance 1.00e-05 Supporting Reference Compounds 13 E-value 0.0778492
Click to view 3D structure	Beta-2 adrenergic receptor	P07550	Humans	Known	Not Available
Click to view 3D structure	Mitogen-activated protein kinase 1	P28482	Humans	Known	Not Available
Click to view 3D structure	Beta-1 adrenergic receptor	P08588	Humans	Known	Not Available
Click to view 3D structure	Phosphatidylinositol 3-kinase regulatory subunit alpha	P27986	Humans	Known	Not Available
Click to view 3D structure	Phosphatidylinositol 3-kinase regulatory subunit beta	O00459	Humans	Known	Not Available
Click to view 3D structure	Beta-3 adrenergic receptor	P13945	Humans	Known	Not Available
Click to view 3D structure	Phosphatidylinositol 3-kinase regulatory subunit gamma	Q92569	Humans	Known	Not Available