Copper(II) sulfate (CED0001015)

Record Information
Version1.0
Creation Date2009-06-19 21:58:27 UTC
Update Date2026-05-14 18:24:20 UTC
SynCED IDCED0001015
Secondary Accession Numbers
  • CHEM001039
  • T3D1215
Identification
Common NameCopper(II) sulfate
ClassSmall Molecule
Description
Copper(II) sulfate belongs to the transition metal sulfates, a subclass of transition metal oxoanionic compounds within the inorganic compounds. It is a solid at room temperature with the formula CuO4S and an average molecular weight of 159.61 g/mol. This exogenous compound is classified as a mixed metal/non-metal compound. Its industrial roles and uses include serving as a softener and conditioner, biocide, catalyst (PMC10421532 ), flavouring and nutrient (PMC10421532 ), and processing aids not otherwise specified (PMC10421532 ). Biologically, it is used as a fungicide (PMC12665592 ). The compound is found in or released from 30 recorded sources, including household cleaning and consumer products such as bleaching agents and smoking requisites; food, food processing and cookware, specifically the processing of fish and the preparation of vinegar, wine, or sparkling wine; electrical and electronic equipment such as antennas, communication cables, and adjustable resistors; building and construction materials like sunshades, awnings, or outside screens; healthcare, pharmaceuticals and veterinary products; and household items such as watch chains. Recorded exposure routes include oral, topical, intravenous, and cutaneous. Copper(II) sulfate interacts with six recorded protein targets. It binds to alpha-synuclein (SNCA), initiating protein aggregation and likely contributing to the development of Alzheimer's disease and Parkinson's disease. It also binds the N-terminal region of amyloid precursor protein (APP), promoting the generation of β-amyloid, which is believed to contribute to these same neurodegenerative disorders. Additionally, copper inhibits sulfhydryl group enzymes, including serum paraoxonase/lactonase 3 (PON3), serum paraoxonase/arylesterase 1 (PON1), mitochondrial glutathione reductase (GSR), and glucose-6-phosphate 1-dehydrogenase (G6PD).
Contaminant Type
  • Copper Compound
  • Food Toxin
  • Household Toxin
  • Industrial/Workplace Toxin
  • Inorganic Compound
  • Natural Compound
  • Pesticide
Chemical Structure
Synonyms
ValueSource
Copper sulfateChEBI
Cupric sulfate anhydrousChEBI
CuSO4ChEBI
Copper(II) sulfateKegg
Copper sulfuric acidGenerator
Copper sulphateGenerator
Copper sulphuric acidGenerator
Cupric sulfuric acid anhydrousGenerator
Cupric sulphate anhydrousGenerator
Cupric sulphuric acid anhydrousGenerator
Copper(II) sulfuric acidGenerator
Copper(II) sulphateGenerator
Copper(II) sulphuric acidGenerator
Cupric sulfuric acidGenerator
Cupric sulphateGenerator
Cupric sulphuric acidGenerator
Cupric sulfateChEBI
Sulfate, copperMeSH
Sulfate, cupricMeSH
Vitriol, blueMeSH
Blue vitriolMeSH
Chemical FormulaCuO4S
Average Molecular Mass159.609 g/mol
Monoisotopic Mass158.881 g/mol
CAS Registry Number7758-98-7
IUPAC Namecopper(2+) ion sulfate
Traditional Namecopper(2+) ion sulfate
SMILES[Cu++].[O-]S([O-])(=O)=O
InChI IdentifierInChI=1S/Cu.H2O4S/c;1-5(2,3)4/h;(H2,1,2,3,4)/q+2;/p-2
InChI KeyARUVKPQLZAKDPS-UHFFFAOYSA-L
Chemical Taxonomy
Description Belongs to the class of inorganic compounds known as transition metal sulfates. These are inorganic compounds in which the largest oxoanion is sulfate, and in which the heaviest atom not in an oxoanion is a transition metal.
KingdomInorganic compounds
Super ClassMixed metal/non-metal compounds
ClassTransition metal oxoanionic compounds
Sub ClassTransition metal sulfates
Direct ParentTransition metal sulfates
Alternative Parents
Substituents
  • Transition metal sulfate
  • Inorganic copper salt
  • Inorganic oxide
  • Inorganic salt
Molecular FrameworkNot Available
External Descriptors
Biological Properties
StatusDetected and Not Quantified
OriginExogenous
Cellular Locations
  • Cytoplasm
  • Extracellular
Biofluid LocationsNot Available
Tissue LocationsNot Available
ApplicationsNot Available
Biological Roles
Chemical RolesNot Available
Organoleptic Effects
  • blue colour ?
  • light blue colour ?
Physical Properties
StateSolid
AppearanceBlue crystals.
Experimental Properties
PropertyValue
Melting Point560°C
Boiling PointNot Available
SolubilityNot Available
Predicted Properties
PropertyValueSource
logP-0.84ChemAxon
pKa (Strongest Acidic)-3ChemAxon
Physiological Charge-2ChemAxon
Hydrogen Acceptor Count4ChemAxon
Hydrogen Donor Count0ChemAxon
Polar Surface Area80.26 ŲChemAxon
Rotatable Bond Count0ChemAxon
Refractivity11.53 m³·mol⁻¹ChemAxon
Polarizability5.81 ųChemAxon
Number of Rings0ChemAxon
BioavailabilityYesChemAxon
Rule of FiveYesChemAxon
Ghose FilterNoChemAxon
Veber's RuleNoChemAxon
MDDR-like RuleNoChemAxon
Spectra
Spectra
Spectrum TypeDescriptionSplash KeyDeposition DateView
Predicted LC-MS/MSPredicted LC-MS/MS Spectrumsplash10-0a4i-0900000000-f7e7ac5e002a4e57c3bbNot AvailableView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrumsplash10-0a4i-0900000000-f7e7ac5e002a4e57c3bbNot AvailableView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrumsplash10-0a4i-0900000000-f7e7ac5e002a4e57c3bbNot AvailableView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrumsplash10-0a4i-0900000000-d4358abc03f58bdf9ac0Not AvailableView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrumsplash10-0a4i-0900000000-d4358abc03f58bdf9ac0Not AvailableView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrumsplash10-0a4i-0900000000-d4358abc03f58bdf9ac0Not AvailableView Spectrum
Toxicity Profile
Toxicity Values
Toxicity ValueOrganismDose DescriptorRoute of ExposurePredicted or ExperimentalToxicity RatingReference
300.0 mg/kg RatLD50OralexperimentalNot Available9
20.0 mg/kg RabbitLD50IntraperitonealexperimentalNot Available9
43.0 mg/kg RatLD50SubcutaneousexperimentalNot Available9
49.0 mg/kg RatLD50IntravenousexperimentalNot Available9
55.1 mg/kg dry food RatNOELoralexperimentalNot AvailableECOTOX - EPA ORD
200.0 ppm European RabbitNOELoralexperimentalNot AvailableECOTOX - EPA ORD
0.12 mg/L MouseLOELoralexperimentalNot AvailableECOTOX - EPA ORD
5.0 % European RabbitNOELenvironmentalexperimentalNot AvailableECOTOX - EPA ORD
3.0 mg/kg-day RatNOELinjectionexperimentalNot AvailableECOTOX - EPA ORD
172.8 mg/kg-day RatNOELoralexperimentalNot AvailableECOTOX - EPA ORD
125.0 ppm European RabbitNOELoralexperimentalNot AvailableECOTOX - EPA ORD
250.0 ppm European RabbitLOELoralexperimentalNot AvailableECOTOX - EPA ORD
901.5 ppm European RabbitNOELoralexperimentalNot AvailableECOTOX - EPA ORD
100.0 ppm European RabbitNOELoralexperimentalNot AvailableECOTOX - EPA ORD
150.0 ppm European RabbitLOELoralexperimentalNot AvailableECOTOX - EPA ORD
3.0 mg/kg-day RatNOELinjectionexperimentalNot AvailableECOTOX - EPA ORD
3.0 mg/kg-day RatLOELinjectionexperimentalNot AvailableECOTOX - EPA ORD
375.0 ppm European RabbitNOELoralexperimentalNot AvailableECOTOX - EPA ORD
200.0 mg/L MouseNOELoralexperimentalNot AvailableECOTOX - EPA ORD
450.0 ppm European RabbitNOELoralexperimentalNot AvailableECOTOX - EPA ORD
219.22 ppm European RabbitNOELoralexperimentalNot AvailableECOTOX - EPA ORD
250.0 ppm European RabbitNOELoralexperimentalNot AvailableECOTOX - EPA ORD
450.0 mg/L RatNOELoralexperimentalNot AvailableECOTOX - EPA ORD
100.0 ppm European RabbitLOELoralexperimentalNot AvailableECOTOX - EPA ORD
200.0 ppm European RabbitNOELoralexperimentalNot AvailableECOTOX - EPA ORD
125.0 ppm European RabbitLOELoralexperimentalNot AvailableECOTOX - EPA ORD
100.0 ppm European RabbitLOELoralexperimentalNot AvailableECOTOX - EPA ORD
0.45 % European RabbitLOELenvironmentalexperimentalNot AvailableECOTOX - EPA ORD
123.08 ppm European RabbitLOELoralexperimentalNot AvailableECOTOX - EPA ORD
100.0 ppm European RabbitNOELoralexperimentalNot AvailableECOTOX - EPA ORD
0.45 % European RabbitLOELenvironmentalexperimentalNot AvailableECOTOX - EPA ORD
0.125 % RatNOELoralexperimentalNot AvailableECOTOX - EPA ORD
227.4 ppm European RabbitNOELoralexperimentalNot AvailableECOTOX - EPA ORD
224.4 ppm European RabbitNOELoralexperimentalNot AvailableECOTOX - EPA ORD
821.6 ppm European RabbitNOELoralexperimentalNot AvailableECOTOX - EPA ORD
75.0 ppm European RabbitLOELoralexperimentalNot AvailableECOTOX - EPA ORD
100.0 ppm European RabbitNOELoralexperimentalNot AvailableECOTOX - EPA ORD
5.0 % European RabbitNOELenvironmentalexperimentalNot AvailableECOTOX - EPA ORD
413.0 mg/kg-day MouseLOELoralexperimentalNot AvailableECOTOX - EPA ORD
200.0 mg/kg-day MouseNOELoralexperimentalNot AvailableECOTOX - EPA ORD
0.45 % European RabbitLOELenvironmentalexperimentalNot AvailableECOTOX - EPA ORD
450.0 mg/L RatLOELoralexperimentalNot AvailableECOTOX - EPA ORD
150.0 mg/L RatNOELoralexperimentalNot AvailableECOTOX - EPA ORD
5.0 % European RabbitNOELenvironmentalexperimentalNot AvailableECOTOX - EPA ORD
200.0 ppm European RabbitLOELoralexperimentalNot AvailableECOTOX - EPA ORD
3.0 mg/kg-day RatLOELinjectionexperimentalNot AvailableECOTOX - EPA ORD
100.0 ppm European RabbitLOELoralexperimentalNot AvailableECOTOX - EPA ORD
0.12 mg/L European RabbitNOELoralexperimentalNot AvailableECOTOX - EPA ORD
123.08 ppm European RabbitNOELoralexperimentalNot AvailableECOTOX - EPA ORD
227.4 ppm European RabbitLOELoralexperimentalNot AvailableECOTOX - EPA ORD
172.8 mg/kg-day RatLOELoralexperimentalNot AvailableECOTOX - EPA ORD
75.0 ppm European RabbitNOELoralexperimentalNot AvailableECOTOX - EPA ORD
150.0 ppm European RabbitLOELoralexperimentalNot AvailableECOTOX - EPA ORD
75.0 umol/kg/day RatLOELinjectionexperimentalNot AvailableECOTOX - EPA ORD
38.0 umol/kg/day RatNOELinjectionexperimentalNot AvailableECOTOX - EPA ORD
126.52 ppm European RabbitLOELoralexperimentalNot AvailableECOTOX - EPA ORD
821.6 ppm European RabbitLOELoralexperimentalNot AvailableECOTOX - EPA ORD
117.6 ppm European RabbitLOELoralexperimentalNot AvailableECOTOX - EPA ORD
12.7 mg/org-day RatLOECoralexperimentalNot AvailableECOTOX - EPA ORD
12.7 mg/org-day RatLOECoralexperimentalNot AvailableECOTOX - EPA ORD
901.5 ppm European RabbitLOELoralexperimentalNot AvailableECOTOX - EPA ORD
0.125 % RatLOELoralexperimentalNot AvailableECOTOX - EPA ORD
150.0 mg/L RatLOELoralexperimentalNot AvailableECOTOX - EPA ORD
12.7 mg/org-day RatLOECoralexperimentalNot AvailableECOTOX - EPA ORD
150.0 mg/L RatLOELoralexperimentalNot AvailableECOTOX - EPA ORD
450.0 mg/L RatNOELoralexperimentalNot AvailableECOTOX - EPA ORD
25.0 ug/org-day RatLOELoralexperimentalNot AvailableECOTOX - EPA ORD
25.0 ug/org-day RatNOELoralexperimentalNot AvailableECOTOX - EPA ORD
10.0 ug/org-day RatNOELoralexperimentalNot AvailableECOTOX - EPA ORD
10.0 ug/org-day RatLOELoralexperimentalNot AvailableECOTOX - EPA ORD
55.1 mg/kg dry food RatLOELoralexperimentalNot AvailableECOTOX - EPA ORD
12.7 mg/org-day RatLOECoralexperimentalNot AvailableECOTOX - EPA ORD
126.52 ppm European RabbitNOELoralexperimentalNot AvailableECOTOX - EPA ORD
219.22 ppm European RabbitLOELoralexperimentalNot AvailableECOTOX - EPA ORD
12.7 mg/org-day RatLOECoralexperimentalNot AvailableECOTOX - EPA ORD
0.21 mg/L European RabbitLOELoralexperimentalNot AvailableECOTOX - EPA ORD
2000.0 ppm RatLOELoralexperimentalNot AvailableECOTOX - EPA ORD
16.0 umol/kg/day RatNOELinjectionexperimentalNot AvailableECOTOX - EPA ORD
33.0 umol/kg/day RatLOELinjectionexperimentalNot AvailableECOTOX - EPA ORD
12.7 mg/org-day RatLOECoralexperimentalNot AvailableECOTOX - EPA ORD
500.0 ppm RatNOELoralexperimentalNot AvailableECOTOX - EPA ORD
1500.0 ppm RatLOELoralexperimentalNot AvailableECOTOX - EPA ORD
500.0 ppm RatLOELoralexperimentalNot AvailableECOTOX - EPA ORD
500.0 ppm RatNOELoralexperimentalNot AvailableECOTOX - EPA ORD
1000.0 ppm RatNOELoralexperimentalNot AvailableECOTOX - EPA ORD
1000.0 ppm RatLOELoralexperimentalNot AvailableECOTOX - EPA ORD
1000.0 ppm RatLOELoralexperimentalNot AvailableECOTOX - EPA ORD
450.0 mg/L RatLOELoralexperimentalNot AvailableECOTOX - EPA ORD
150.0 mg/L RatNOELoralexperimentalNot AvailableECOTOX - EPA ORD
40.0 umol/kg/day MouseLOELinjectionexperimentalNot AvailableECOTOX - EPA ORD
2.4 mg/kg-day RatNOELoralexperimentalNot AvailableECOTOX - EPA ORD
150.0 ppm European RabbitNOELoralexperimentalNot AvailableECOTOX - EPA ORD
200.0 ppm European RabbitLOELoralexperimentalNot AvailableECOTOX - EPA ORD
80.0 ppm MouseLOELoralexperimentalNot AvailableECOTOX - EPA ORD
150.0 ppm MouseNOELoralexperimentalNot AvailableECOTOX - EPA ORD
48.0 mg/kg-day RatLOELoralexperimentalNot AvailableECOTOX - EPA ORD
117.0 mg/kg-day RatNOELoralexperimentalNot AvailableECOTOX - EPA ORD
500.0 mg/kg-day RatLOELoralexperimentalNot AvailableECOTOX - EPA ORD
1600.0 ppm MouseNOELoralexperimentalNot AvailableECOTOX - EPA ORD
394.0 mg/kg-day MouseNOELoralexperimentalNot AvailableECOTOX - EPA ORD
156.0 mg/kg-day RatLOELoralexperimentalNot AvailableECOTOX - EPA ORD
1000.0 ppm RatNOELoralexperimentalNot AvailableECOTOX - EPA ORD
192.0 mg/kg-day RatLOELoralexperimentalNot AvailableECOTOX - EPA ORD
7.5 mg/kg-day MouseNOELoralexperimentalNot AvailableECOTOX - EPA ORD
14.4 mg/kg-day RatLOELoralexperimentalNot AvailableECOTOX - EPA ORD
117.0 mg/kg-day RatLOELoralexperimentalNot AvailableECOTOX - EPA ORD
740.0 mg/kg-day MouseNOELoralexperimentalNot AvailableECOTOX - EPA ORD
500.0 mg/kg-day RatLOELoralexperimentalNot AvailableECOTOX - EPA ORD
96.0 mg/kg-day RatNOELoralexperimentalNot AvailableECOTOX - EPA ORD
100.0 mg/kg-day RatLOELoralexperimentalNot AvailableECOTOX - EPA ORD
480.0 mg/kg-day RatNOELoralexperimentalNot AvailableECOTOX - EPA ORD
78.0 mg/kg-day RatLOELoralexperimentalNot AvailableECOTOX - EPA ORD
78.0 mg/kg-day RatNOELoralexperimentalNot AvailableECOTOX - EPA ORD
7.8 mg/kg-day RatNOELoralexperimentalNot AvailableECOTOX - EPA ORD
16000.0 ppm MouseNOELoralexperimentalNot AvailableECOTOX - EPA ORD
3000.0 ppm RatLOELoralexperimentalNot AvailableECOTOX - EPA ORD
185.0 mg/kg-day MouseLOELoralexperimentalNot AvailableECOTOX - EPA ORD
197.0 mg/kg-day MouseNOELoralexperimentalNot AvailableECOTOX - EPA ORD
3000.0 ppm RatLOELoralexperimentalNot AvailableECOTOX - EPA ORD
10.0 mg/kg-day RatLOELoralexperimentalNot AvailableECOTOX - EPA ORD
100.0 mg/kg-day RatLOELoralexperimentalNot AvailableECOTOX - EPA ORD
1000.0 ppm RatNOELoralexperimentalNot AvailableECOTOX - EPA ORD
192.0 mg/kg-day RatLOELoralexperimentalNot AvailableECOTOX - EPA ORD
100.0 mg/kg-day MouseLOELoralexperimentalNot AvailableECOTOX - EPA ORD
100.0 mg/kg-day RatLOELoralexperimentalNot AvailableECOTOX - EPA ORD
200.0 mg/kg-day RatLOELoralexperimentalNot AvailableECOTOX - EPA ORD
Toxicity / Toxin ClassNot Available
Mechanism of ToxicityExcess copper is sequestered within hepatocyte lysosomes, where it is complexed with metallothionein. Copper hepatotoxicity is believed to occur when the lysosomes become saturated and copper accumulates in the nucleus, causing nuclear damage. This damage is possibly a result of oxidative damage, including lipid peroxidation. Copper inhibits the sulfhydryl group enzymes such as glucose-6-phosphate 1-dehydrogenase, glutathione reductase, and paraoxonases, which protect the cell from free oxygen radicals. It also influences gene expression and is a co-factor for oxidative enzymes such as cytochrome C oxidase and lysyl oxidase. In addition, the oxidative stress induced by copper is thought to activate acid sphingomyelinase, which lead to the production of ceramide, an apoptotic signal, as well as cause hemolytic anemia. Copper-induced emesis results from stimulation of the vagus nerve. (4, 11, 1, 7)
Carcinogenicity (IARC Classification)No indication of carcinogenicity to humans (not listed by IARC).
Minimum Risk LevelAcute Oral: 0.01 mg/kg/day (3) Intermediate Oral: 0.01 mg/kg/day (3)
SymptomsBreathing high levels of copper can cause irritation of the nose and throat. Ingesting high levels of copper can cause nausea, vomiting, diarrhea, headache, dizziness, and respiratory difficulty. (5, 6)
TreatmentEYES: irrigate opened eyes for several minutes under running water. INGESTION: do not induce vomiting. Rinse mouth with water (never give anything by mouth to an unconscious person). Seek immediate medical advice. SKIN: should be treated immediately by rinsing the affected parts in cold running water for at least 15 minutes, followed by thorough washing with soap and water. If necessary, the person should shower and change contaminated clothing and shoes, and then must seek medical attention. INHALATION: supply fresh air. If required provide artificial respiration.
Health Effects
Health EffectRelationshipDirectionDescriptionReference
diabetes mellitusAssociated With?positiveA glucose metabolism disease characterized by chronic hyperglycaemia with disturbances of carbohydrate, fat and protein metabolism resulting from defects in insulin secretion, insulin action, or both. (DO)PMC5787249
nauseaAssociated With?Not AvailableA disorder characterized by a queasy sensation and/or the urge to vomit. (NCI CTCAE)PMC10798145
vomitingAssociated With?Not AvailableA disorder characterized by the reflexive act of ejecting the contents of the stomach through the mouth. (NCI CTCAE)PMC10798145
Cell DeathAssociated With?Not AvailableNot AvailablePMC12817343
Oxidative StressAssociated With?Not AvailableNot AvailablePMC11443738
Oxidative StressHas Therapeutic Effect OnNot AvailableNot AvailablePMC13232620
RestlessnessNot AvailableNot AvailableNot AvailablePMC12649313
loss of balanceNot AvailableNot AvailableNot AvailablePMC12649313
Exposure Sources
Source IDSourceSectorReference
CEDs000003Irrigation water?Irrigation water can serve as a vector for synthetic chemical contamination due to its potential exposure to agricultural inputs such as fertilizers, pesticides, and herbicides.Agriculture & land managementPMC11247616
CEDs000010Insecticides?Insecticides are synthetic chemicals designed to control or eliminate insect pests that threaten crops and other agricultural products.Agriculture & land managementPubChem
CEDs000013Soil?Soil serves as a critical medium for plant growth and sustains various ecological functions; however, it can become a reservoir for synthetic chemical contamination.Agriculture & land managementPMC6301197 , PMC6301197
CEDs000050Groundwater?Groundwater serves as a vital resource for drinking water and agricultural irrigation but is increasingly susceptible to contamination from synthetic chemicals.Aquatic systems & sedimentsPMC10059074
CEDs000070Stormwater runoff?Stormwater runoff refers to the flow of rainwater or melted snow that does not soak into the ground and instead collects pollutants as it travels over impervious surfaces such as roads and parking lots.Automotive & urban infrastructurePubChem
CEDs000116Tap water?Tap water can be a potential source of synthetic chemical contamination due to various industrial processes and agricultural runoff.Drinking water & water supplyPMC1566323
CEDs000181Ballast water?Ballast water, taken on by ships to maintain stability and balance, often contains a diverse array of microorganisms, including bacteria, viruses, and plankton.Marine, shipping & aquaculturePubChem
CEDs000182Bilge water?Bilge water is a byproduct generated from the accumulation of water in the lowest part of a ship's hull, which may include a mixture of seawater, oil, fuel residues, and various contaminants.Marine, shipping & aquaculturePubChem
CEDs000233Brushes?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 & cosmeticsPubChem
CEDs000409Unclassified therapeutic products?Unclassified therapeutic products encompass a range of substances used in medical and veterinary contexts that have not undergone formal classification processes.Healthcare, pharmaceuticals & veterinary productsNot Available
CEDs000452Fabrics?Fabrics can be a significant source of synthetic chemical contamination due to the use of various chemicals during their production, treatment, and finishing processes.Textiles, leather & furnishingsPMC8347515
CEDs000464Leachate?Leachate is a liquid that forms when water percolates through waste material, dissolving soluble compounds and carrying various contaminants.Waste management, landfill & incinerationPMC12714966
CEDs000501Sunshades Awnings Or Outside Screens?Sunshades, awnings, and outside screens are often constructed using synthetic materials such as polyvinyl chloride (PVC), polyester, or acrylic fabrics.Building & ConstructionPubChem
CEDs000502Sunshades Awnings Or Outside Screens?Sunshades, awnings, and outside screens are commonly used in construction to enhance energy efficiency and provide shade.Building & ConstructionPubChem
CEDs000504Adjustable Resistors?Adjustable resistors, commonly used in various electronic devices, can contribute to synthetic chemical contamination through the materials and substances used in their manufacturing and disposal.Electrical & Electronic EquipmentPubChem
CEDs000506Antennas?Antennas, commonly used in communication technologies, can be a source of synthetic chemical contamination through the materials and coatings used in their construction.Electrical & Electronic EquipmentPubChem
CEDs000507Auxiliary Devices?Auxiliary devices, such as capacitors, transformers, and circuit breakers, are integral components in various electronic systems.Electrical & Electronic EquipmentPubChem
CEDs000510Communication Cables Or Conductors?Communication cables or conductors are essential components in the transmission of data and signals in various applications, including telecommunications and networking.Electrical & Electronic EquipmentPubChem
CEDs000511Conductors 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 EquipmentPubChem
CEDs000513Cores Yokes Or Armatures?Cores, yokes, or armatures are components commonly found in electrical devices, used to facilitate the magnetic and electrical functions within motors, transformers, and generators.Electrical & Electronic EquipmentPubChem
CEDs000514Discharge Lamps?Discharge lamps, including fluorescent and high-intensity discharge (HID) lamps, are commonly used for lighting applications due to their energy efficiency and brightness.Electrical & Electronic EquipmentPubChem
CEDs000517Electric Switches?Electric switches, integral components in numerous devices, can be a source of synthetic chemical contamination due to the materials and manufacturing processes involved in their production.Electrical & Electronic EquipmentPubChem
CEDs000518Electrically 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 EquipmentPubChem
CEDs000519Electrodes?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 EquipmentPubChem
CEDs000520Emergency Protective Devices?Emergency protective devices, such as circuit breakers and surge protectors, are essential components in electrical systems designed to prevent damage from overcurrent and surges.Electrical & Electronic EquipmentPubChem
CEDs000521Fixed Capacitors And Their Manufacture?Fixed capacitors are passive electronic components used to store and release electrical energy, playing a critical role in various circuits.Electrical & Electronic EquipmentPubChem
CEDs000524Hybrid Capacitors?Hybrid capacitors are energy storage devices that combine the properties of electrolytic and supercapacitors, utilizing a combination of electrochemical principles to achieve higher energy density and power density.Electrical & Electronic EquipmentPubChem
CEDs000527Magnets?Magnets, commonly used in various electrical and electronic applications, can be a source of synthetic chemical contamination due to the materials used in their production.Electrical & Electronic EquipmentPubChem
CEDs000529Power Cables?Power cables are used to transmit electrical energy and are typically composed of conductive materials, insulation, and protective coatings.Electrical & Electronic EquipmentPubChem
CEDs000535Superconducting Magnets And Superconducting Coils?Superconducting magnets and coils are utilized in various applications that require strong magnetic fields, such as magnetic resonance imaging (MRI) and particle accelerators.Electrical & Electronic EquipmentPubChem
CEDs000536Superconductive Or Hyperconductive Conductors Cables Or Transmission Lines?Superconductive or hyperconductive conductors, including cables and transmission lines, are materials that exhibit zero electrical resistance under specific conditions, typically at low temperatures.Electrical & Electronic EquipmentPubChem
CEDs000537Television 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 EquipmentPubChem
CEDs000538Thin Magnetic Films?Thin magnetic films are layers of magnetic material ranging from a few nanometers to several micrometers in thickness, commonly used in applications such as magnetic sensors, data storage devices, and electronic components.Electrical & Electronic EquipmentPubChem
CEDs000545Food 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 & cookwarePubChem
CEDs000548Preparation Of Vinegar?Vinegar is produced through the fermentation of ethanol by acetic acid bacteria, resulting in a solution that typically contains 4-8% acetic acid.Food, food processing & cookwarePubChem
CEDs000549Preparation 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 & cookwarePubChem
CEDs000551Processing Fish?Processing fish can lead to synthetic chemical contamination through various stages of production and preservation.Food, food processing & cookwarePubChem
CEDs000555Bleaching 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 productsPubChem
CEDs000556Cigar Cigarettes?Cigar cigarettes are a source of synthetic chemical contamination due to the combustion of various tobacco blends and additives.Household cleaning & consumer productsPubChem
CEDs000559Non 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 productsPubChem
CEDs000560Other 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 productsPubChem
CEDs000561Perfumes 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 productsPubChem
CEDs000562Pipe Accessories?Pipe accessories, such as fittings, connectors, and seals, are components used in plumbing systems to facilitate the flow of liquids and gases.Household cleaning & consumer productsPubChem
CEDs000563Soap 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 productsPubChem
CEDs000566Tobacco Pipes?Tobacco pipes, often made from materials such as plastic, wood, or metal, can serve as sources of synthetic chemical contamination due to the residues left by tobacco products.Household cleaning & consumer productsPubChem
CEDs000569Tobacco 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 productsPubChem
CEDs000577Watch Chains?Watch chains, often made from various metals and synthetic materials, can be a source of chemical contamination due to the presence of coatings, adhesives, and plasticizers used in their manufacturing.Household itemsPubChem
CEDs000578Making Cigars?The process of making cigars involves several steps, including the cultivation of tobacco, fermentation, and the application of various additives to enhance flavor and preservation.Industrial manufacturing & chemical processingPubChem
CEDs000579Manufacture 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 processingPubChem
CEDs000580Manufacture 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 processingPubChem
CEDs000581Paper Making Machines?Paper making machines utilize various synthetic chemicals throughout the production process, including additives, coatings, and bleaching agents.Industrial manufacturing & chemical processingPubChem
CEDs000583Anchoring Equipment?Anchoring equipment, commonly used in marine applications, can be a source of synthetic chemical contamination due to the materials and coatings utilized in their manufacturing.Marine, shipping & aquaculturePubChem
CEDs000584Buoys?Buoys, often used for navigation and marine monitoring, can be sources of synthetic chemical contamination due to the materials and coatings employed in their construction.Marine, shipping & aquaculturePubChem
CEDs000595Ships?Ships, as vehicles for international trade and transportation, can be significant sources of synthetic chemical contamination in marine environments.Marine, shipping & aquaculturePubChem
CEDs000596Acaricides?Acaricides are synthetic chemicals specifically designed to target and control mite populations that can damage crops and plants.Agriculture & land managementPubChem
CEDs000598Fertiliser Distributors?Fertiliser distributors play a critical role in the supply of synthetic fertilizers, which are widely used to enhance soil fertility and crop yield.Agriculture & land managementPubChem
CEDs000600Herbicides And Algicides?Herbicides and algicides are synthetic chemicals primarily used to control unwanted plants and algae in various environments.Agriculture & land managementPubChem
CEDs000602Molluscicides?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 managementPubChem
CEDs000603Nematocides?Nematocides are synthetic chemicals specifically designed to control nematodes, which are microscopic roundworms that can cause significant damage to crops and plants.Agriculture & land managementPubChem
CEDs000604Pest Attractants?Pest attractants are synthetic chemicals designed to lure specific pests for monitoring or control purposes.Agriculture & land managementPubChem
CEDs000605Pest Repellants?Pest repellents, often formulated from synthetic chemicals, are widely used to protect crops from insect infestations and other pests.Agriculture & land managementPubChem
CEDs000606Plant Growth Regulators?Plant Growth Regulators (PGRs) are synthetic chemicals designed to influence the growth and development of plants.Agriculture & land managementPubChem
CEDs000607Rodenticides(1)?Rodenticides are synthetic chemicals specifically formulated to control rodent populations, serving as a crucial tool in managing pests that can damage crops and spread diseases.Agriculture & land managementPubChem
CEDs000608Rodenticides?Rodenticides are chemical substances specifically designed to control rodent populations by causing death through various mechanisms, including anticoagulation or neurotoxicity.Agriculture & land managementPubChem
CEDs000610Aftersun 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 & cosmeticsPubChem
CEDs000611Anti Perspirants Or Body Deoderants?Antiperspirants and body deodorants commonly contain synthetic chemicals such as aluminum compounds, parabens, and synthetic fragrances.Personal care & cosmeticsPubChem
CEDs000614Essential 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 & cosmeticsPubChem
CEDs000615Eye 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 & cosmeticsPubChem
CEDs000617Lip 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 & cosmeticsPubChem
CEDs000618Lip 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 & cosmeticsPubChem
CEDs000631Anthraquinone Dyes?Anthraquinone dyes are a class of synthetic organic compounds characterized by their vibrant colors and stability, making them widely used in various applications, particularly in coloring textiles and leather.Textiles, leather & furnishingsPubChem
CEDs000632Apparel?Apparel production often involves the use of various synthetic chemicals, including dyes, finishing agents, and preservatives.Textiles, leather & furnishingsPubChem
CEDs000633Azo 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 & furnishingsPubChem
CEDs000635Buttons?Buttons, often made from synthetic materials such as polyester, nylon, or polycarbonate, can be a source of synthetic chemical contamination during their production, use, and disposal.Textiles, leather & furnishingsPubChem
CEDs000638Decorating Textiles?Decorating textiles often involves the use of synthetic chemicals such as dyes, finishes, and coatings.Textiles, leather & furnishingsPubChem
CEDs000642Footwear?Footwear production often involves the use of various synthetic chemicals, such as adhesives, dyes, and treatments, which can contribute to environmental contamination.Textiles, leather & furnishingsPubChem
CEDs000643Headwear?Headwear made from synthetic materials often incorporates chemicals used in the manufacturing and finishing processes, such as dyes, flame retardants, and water repellents.Textiles, leather & furnishingsPubChem
CEDs000645Inorganic Fibres?Inorganic fibres, such as asbestos, glass wool, and ceramic fibres, are used in various applications due to their thermal resistance, strength, and durability.Textiles, leather & furnishingsPubChem
CEDs000648Nitro Dyes?Nitro dyes are synthetic colorants that contain nitro groups (-NO2) in their chemical structure.Textiles, leather & furnishingsPubChem
CEDs000650Purses 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 & furnishingsPubChem
CEDs000652Ropes?Ropes manufactured from synthetic fibers, such as polypropylene, nylon, and polyester, are widely used in various applications, including marine, construction, and outdoor activities.Textiles, leather & furnishingsPubChem
CEDs000655Slide Fasteners?Slide fasteners, commonly known as zippers, are mechanical devices used to join two edges of fabric or other materials.Textiles, leather & furnishingsPubChem
CEDs000657Surface Finishing Of Leather?Surface finishing of leather often involves the use of various synthetic chemicals, including dyes, resins, and finishing agents.Textiles, leather & furnishingsPubChem
CEDs000659Transfer Printing?Transfer printing is a process used to apply designs and patterns onto various substrates, commonly utilizing synthetic dyes and inks that can contain hazardous chemicals.Textiles, leather & furnishingsPubChem
CEDs000662Yarns Or Threads?Yarns or threads used in textiles can be a source of synthetic chemical contamination due to the production processes and treatments they undergo.Textiles, leather & furnishingsPubChem
CEDs000663Sanitary Equipment?Sanitary equipment, including toilets, sinks, and drainage systems, can serve as conduits for synthetic chemical contamination.Wastewater, sanitation & biosolidsPubChem
CEDs000664Fire Fighting Gels?Fire fighting gels are synthetic chemical formulations designed to enhance fire suppression effectiveness by creating a protective barrier against heat and flames.Fire suppression systems & agentsPubChem
CEDs000668Non-PFAS Fire Fighting Foam?Non-PFAS fire fighting foam refers to fire suppression agents that do not contain per- and polyfluoroalkyl substances (PFAS), which are synthetic chemicals known for their water- and grease-resistant properties.Fire suppression systems & agentsPubChem
CEDs000670Solid Fire Fighting Substances?Solid fire fighting substances, such as certain types of dry chemical powders, are used in fire suppression applications to extinguish flames and prevent fire spread.Fire suppression systems & agentsPubChem
CEDs000671Airplanes And Helicopters?Airplanes and helicopters are significant sources of synthetic chemical contamination primarily through the use of aviation fuels, lubricants, and de-icing agents.Aviation & AerospacePubChem
CEDs000673Unmanned Aerial Vehicles?Unmanned Aerial Vehicles (UAVs), commonly known as drones, utilize various synthetic chemicals in their manufacturing, operation, and maintenance processes.Aviation & AerospacePubChem
CEDs000678Nitrogenous 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 managementPubChem
CEDs000679Phosphatic Fertilisers?Phosphatic fertilizers are synthetic chemical products primarily composed of phosphorus, which is essential for plant growth.Agriculture & land managementPubChem
CEDs000684Cements?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 & ConstructionPubChem
CEDs000685Ceramics?Ceramics can be a source of synthetic chemical contamination through various additives and processing agents used in their production.Building & ConstructionPubChem
CEDs000686Clay Wares?Clay wares are ceramic products made from natural clay, often utilized in various construction applications such as tiles, bricks, and sanitary ware.Building & ConstructionPubChem
CEDs000688Glass Coatings?Glass coatings are synthetic chemical formulations applied to glass surfaces to enhance properties such as durability, UV resistance, and aesthetic appeal.Building & ConstructionPubChem
CEDs000690Lime?Lime, primarily comprised of calcium oxide (CaO) or calcium hydroxide (Ca(OH)₂), is widely used in various applications, including as a key ingredient in mortars, plasters, and cement.Building & ConstructionPubChem
CEDs000692Silica Free Oxide Glass?Silica Free Oxide Glass is a type of glass that is produced using alternative materials to traditional silica-based formulations.Building & ConstructionPubChem
CEDs000693Silica Glass?Silica glass, primarily composed of silicon dioxide (SiO2), is widely used in various applications, including windows, glass facades, and insulation materials.Building & ConstructionPubChem
CEDs000696Nanotechnology?Nanotechnology involves the manipulation of materials at the molecular or atomic level, typically within the range of 1 to 100 nanometers.Industrial manufacturing & chemical processingPubChem
CEDs000697Submarines?Submarines, while essential for military and research purposes, can be a source of synthetic chemical contamination due to their use of various industrial chemicals.Marine, shipping & aquaculturePubChem
CEDs000698Jewellery?Jewellery production often involves the use of various synthetic chemicals during the extraction and processing of metals.Mining & metal processingPubChem
CEDs000699Mining Or Quarrying?Mining and quarrying operations can lead to synthetic chemical contamination through the release of various pollutants associated with the extraction and processing of minerals.Mining & metal processingPubChem
CEDs000727Printing Machines Or Presses?Printing machines or presses commonly utilize synthetic chemicals such as inks, solvents, and cleaning agents.Paper, pulp & fiber productsPubChem
CEDs000734Coating 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 & ConstructionPubChem
CEDs000735Explosives?Explosives are chemical compounds or mixtures designed to undergo rapid decomposition, releasing energy in the form of gas and heat.Defense & military infrastructurePubChem
CEDs000736Fuses?Fuses are safety devices designed to protect electrical circuits by breaking the circuit when excessive current flows through.Electrical & Electronic EquipmentPubChem
CEDs000738Cooling Circuit Water?Cooling circuit water is utilized in various industrial processes to absorb and dissipate heat generated during operations.Industrial manufacturing & chemical processingPubChem
CEDs000739Inks?Inks are complex mixtures composed of pigments or dyes, solvents, resins, and additives used primarily for printing and writing applications.Paper, pulp & fiber productsPubChem
CEDs000740Paper?Paper production involves the processing of wood fibers and the use of various chemicals, which can lead to synthetic chemical contamination.Paper, pulp & fiber productsPubChem
CEDs000741Pigment Pastes?Pigment pastes are concentrated dispersions of pigments used to impart color and properties to materials.Paper, pulp & fiber productsPubChem
CEDs000742Leather Tanning?Leather tanning is a process that transforms raw animal hides into durable leather through the application of various chemicals, including chromium salts, aldehydes, and vegetable tannins.Textiles, leather & furnishingsPubChem
CEDs000743Sludge Treatment?Sludge treatment involves the processing of waste materials generated from wastewater treatment plants, which often contain a variety of organic and inorganic substances.Wastewater, sanitation & biosolidsPubChem
CEDs000744Water, Wastewater, & Sewage Treatment?Water, wastewater, and sewage treatment processes are critical for managing and mitigating pollutants in water systems.Wastewater, sanitation & biosolidsPubChem
CEDs00812FieldAgriculture & land managementPMC9550036
CEDs01020Chicken FeedAgriculture & land managementPMC10334572
CEDs01231WinesFood, food processing & cookwarePMC11631397
CEDs02255WaterAquatic systems & sedimentsPMC5785506 , PMC5695812
CEDs02261Sea WaterAquatic systems & sedimentsPMC8748922 , PMC10675469
CEDs02297ReservoirAquatic systems & sedimentsPMC3020984
CEDs02299Fresh Water BodyAquatic systems & sedimentsPMC9853361
CEDs02345Lake SedimentAquatic systems & sedimentsPMC8306311
CEDs02490Artificial Sea WaterAquatic systems & sedimentsPMC8357792
CEDs03009Waste WaterWastewater, sanitation & biosolidsPMC11165625
CEDs03026Industrial EffluentWastewater, sanitation & biosolidsPMC11625160
Pathways
1 pathwayPathway Source: PathBank
Targets
StructureProteinUniProt IDOrganismRelationshipDetails
Carbonic anhydrase 2 structureClick to view 3D structureCarbonic anhydrase 2P00918HumansPredicted (SEA)
Prediction Confidence Score
0.228
Applicability Domain
0.3
Statistical Significance
0.3038
Supporting Reference Compounds
472
E-value
2364.83
Carbonic anhydrase 7 structureClick to view 3D structureCarbonic anhydrase 7P43166HumansPredicted (SEA)
Prediction Confidence Score
0.228
Applicability Domain
0.3
Statistical Significance
0.1771
Supporting Reference Compounds
242
E-value
1378.48
Carbonic anhydrase 1 structureClick to view 3D structureCarbonic anhydrase 1P00915HumansPredicted (SEA)
Prediction Confidence Score
0.228
Applicability Domain
0.3
Statistical Significance
0.2593
Supporting Reference Compounds
407
E-value
2018.4
Carbonic anhydrase 9 structureClick to view 3D structureCarbonic anhydrase 9Q16790HumansPredicted (SEA)
Prediction Confidence Score
0.226
Applicability Domain
0.3
Statistical Significance
0.2665
Supporting Reference Compounds
372
E-value
2074.6
Click to view 3D structureAlpha carbonic anhydraseB5SU02Stylophora pistillataPredicted (SEA)
Prediction Confidence Score
0.224
Applicability Domain
0.3
Statistical Significance
0.0162
Supporting Reference Compounds
43
E-value
125.882
Click to view 3D structureCarbonic anhydraseC0IX24Stylophora pistillataPredicted (SEA)
Prediction Confidence Score
0.224
Applicability Domain
0.3
Statistical Significance
0.0162
Supporting Reference Compounds
41
E-value
125.882
Carbonic anhydrase 6 structureClick to view 3D structureCarbonic anhydrase 6P23280HumansPredicted (SEA)
Prediction Confidence Score
0.223
Applicability Domain
0.3
Statistical Significance
0.1158
Supporting Reference Compounds
151
E-value
901.416
Carbonic anhydrase 4 structureClick to view 3D structureCarbonic anhydrase 4P22748HumansPredicted (SEA)
Prediction Confidence Score
0.22
Applicability Domain
0.3
Statistical Significance
0.1728
Supporting Reference Compounds
193
E-value
1345.08
Carbonic anhydrase structureClick to view 3D structureCarbonic anhydraseP40881Methanosarcina thermophilaPredicted (SEA)
Prediction Confidence Score
0.22
Applicability Domain
0.3
Statistical Significance
0.0106
Supporting Reference Compounds
22
E-value
82.7537
Click to view 3D structureAstrosclerin-3A6YCJ1Astrosclera willeyanaPredicted (SEA)
Prediction Confidence Score
0.208
Applicability Domain
0.3
Statistical Significance
0.0265
Supporting Reference Compounds
44
E-value
206.223
Dual specificity protein phosphatase 5 structureClick to view 3D structureDual specificity protein phosphatase 5Q16690HumansPredicted (SEA)
Prediction Confidence Score
0.2
Applicability Domain
0.2 Low confidence
Statistical Significance
1.00e-03
Supporting Reference Compounds
1
E-value
7.78492
Carbonic anhydrase structureClick to view 3D structureCarbonic anhydraseP53615Saccharomyces cerevisiae S288cPredicted (SEA)
Prediction Confidence Score
0.196
Applicability Domain
0.3
Statistical Significance
0.0313
Supporting Reference Compounds
34
E-value
243.902
Carbonic anhydrase 2 structureClick to view 3D structureCarbonic anhydrase 2P00921Bos taurusPredicted (SEA)
Prediction Confidence Score
0.19
Applicability Domain
0.2 Low confidence
Statistical Significance
0.048
Supporting Reference Compounds
22
E-value
374.066
Carbonic anhydrase 12 structureClick to view 3D structureCarbonic anhydrase 12O43570HumansPredicted (SEA)
Prediction Confidence Score
0.188
Applicability Domain
0.2 Low confidence
Statistical Significance
0.6263
Supporting Reference Compounds
332
E-value
4875.46
Carbonic anhydrase structureClick to view 3D structureCarbonic anhydraseQ5AJ71Candida albicans (strain SC5314 / ATCC MYA-2876) (Yeast)Predicted (SEA)
Prediction Confidence Score
0.187
Applicability Domain
0.2 Low confidence
Statistical Significance
0.2034
Supporting Reference Compounds
68
E-value
1583.76
Beta-carbonic anhydrase 1 structureClick to view 3D structureBeta-carbonic anhydrase 1P9WPJ7Mycobacterium tuberculosisPredicted (SEA)
Prediction Confidence Score
0.186
Applicability Domain
0.2 Low confidence
Statistical Significance
0.1565
Supporting Reference Compounds
55
E-value
1218.11
Carbonic anhydrase 2 structureClick to view 3D structureCarbonic anhydrase 2Q3I4V7Cryptococcus neoformansPredicted (SEA)
Prediction Confidence Score
0.185
Applicability Domain
0.2 Low confidence
Statistical Significance
0.2029
Supporting Reference Compounds
60
E-value
1579.48
Click to view 3D structureDelta carbonic anhydraseQ5U9J1Conticribra weissflogiiPredicted (SEA)
Prediction Confidence Score
0.184
Applicability Domain
0.2 Low confidence
Statistical Significance
0.0472
Supporting Reference Compounds
35
E-value
367.37
Click to view 3D structureCarbonic anhydraseQ6FTL6Candida glabrata CBS 138Predicted (SEA)
Prediction Confidence Score
0.182
Applicability Domain
0.2 Low confidence
Statistical Significance
0.1265
Supporting Reference Compounds
46
E-value
984.87
Click to view 3D structureCarbonate dehydrataseB2V8E3Sulfurihydrogenibium sp. (strain YO3AOP1)Predicted (SEA)
Prediction Confidence Score
0.181
Applicability Domain
0.2 Low confidence
Statistical Significance
0.0571
Supporting Reference Compounds
40
E-value
444.597
Click to view 3D structureCarbonic anhydraseO24855Helicobacter pylori (strain ATCC 700392 / 26695) (Campylobacterpylori)Predicted (SEA)
Prediction Confidence Score
0.181
Applicability Domain
0.2 Low confidence
Statistical Significance
0.0711
Supporting Reference Compounds
38
E-value
553.43
Carbonic anhydrase, alpha family structureClick to view 3D structureCarbonic anhydrase, alpha familyQ31FD6Thiomicrospira crunogenaPredicted (SEA)
Prediction Confidence Score
0.181
Applicability Domain
0.2 Low confidence
Statistical Significance
0.0571
Supporting Reference Compounds
41
E-value
444.675
Click to view 3D structureCarbonic anhydrase 15Q99N23Mus musculusPredicted (SEA)
Prediction Confidence Score
0.181
Applicability Domain
0.2 Low confidence
Statistical Significance
0.3323
Supporting Reference Compounds
78
E-value
2586.85
Click to view 3D structureCarbonic anhydrase 5B, mitochondrialQ9Y2D0HumansPredicted (SEA)
Prediction Confidence Score
0.18
Applicability Domain
0.2 Low confidence
Statistical Significance
0.4753
Supporting Reference Compounds
157
E-value
3700.33
Click to view 3D structureCarbonic anhydrase 4Q95323Bos taurusPredicted (SEA)
Prediction Confidence Score
0.176
Applicability Domain
0.2 Low confidence
Statistical Significance
0.2307
Supporting Reference Compounds
64
E-value
1796.29
Tyrosinase structureClick to view 3D structureTyrosinaseP14679HumansKnownNot Available
Glucose-6-phosphate 1-dehydrogenase structureClick to view 3D structureGlucose-6-phosphate 1-dehydrogenaseP11413HumansKnownExcess copper is sequestered within hepatocyte lysosomes, where it is complexed with metallothionein. Copper hepatotoxicity is believed to occur when the lysosomes become saturated and copper accumulates in the nucleus, causing nuclear damage. This damage is possibly a result of oxidative damage, including lipid peroxidation. Copper inhibits the sulfhydryl group enzymes such as glucose-6-phosphate 1-dehydrogenase, glutathione reductase, and paraoxonases, which protect the cell from free oxygen radicals. It also influences gene expression and is a co-factor for oxidative enzymes such as cytochrome C oxidase and lysyl oxidase. In addition, the oxidative stress induced by copper is thought to activate acid sphingomyelinase, which lead to the production of ceramide, an apoptotic signal, as well as cause hemolytic anemia. (L277, T49, A174, L280)
Glutathione reductase, mitochondrial structureClick to view 3D structureGlutathione reductase, mitochondrialP00390HumansKnownExcess copper is sequestered within hepatocyte lysosomes, where it is complexed with metallothionein. Copper hepatotoxicity is believed to occur when the lysosomes become saturated and copper accumulates in the nucleus, causing nuclear damage. This damage is possibly a result of oxidative damage, including lipid peroxidation. Copper inhibits the sulfhydryl group enzymes such as glucose-6-phosphate 1-dehydrogenase, glutathione reductase, and paraoxonases, which protect the cell from free oxygen radicals. It also influences gene expression and is a co-factor for oxidative enzymes such as cytochrome C oxidase and lysyl oxidase. In addition, the oxidative stress induced by copper is thought to activate acid sphingomyelinase, which lead to the production of ceramide, an apoptotic signal, as well as cause hemolytic anemia. (L277, T49, A174, L280)
Serum paraoxonase/arylesterase 1 structureClick to view 3D structureSerum paraoxonase/arylesterase 1P27169HumansKnownExcess copper is sequestered within hepatocyte lysosomes, where it is complexed with metallothionein. Copper hepatotoxicity is believed to occur when the lysosomes become saturated and copper accumulates in the nucleus, causing nuclear damage. This damage is possibly a result of oxidative damage, including lipid peroxidation. Copper inhibits the sulfhydryl group enzymes such as glucose-6-phosphate 1-dehydrogenase, glutathione reductase, and paraoxonases, which protect the cell from free oxygen radicals. It also influences gene expression and is a co-factor for oxidative enzymes such as cytochrome C oxidase and lysyl oxidase. In addition, the oxidative stress induced by copper is thought to activate acid sphingomyelinase, which lead to the production of ceramide, an apoptotic signal, as well as cause hemolytic anemia. (L277, T49, A174, L280)
Click to view 3D structureSerum paraoxonase/lactonase 3Q15166HumansKnownExcess copper is sequestered within hepatocyte lysosomes, where it is complexed with metallothionein. Copper hepatotoxicity is believed to occur when the lysosomes become saturated and copper accumulates in the nucleus, causing nuclear damage. This damage is possibly a result of oxidative damage, including lipid peroxidation. Copper inhibits the sulfhydryl group enzymes such as glucose-6-phosphate 1-dehydrogenase, glutathione reductase, and paraoxonases, which protect the cell from free oxygen radicals. It also influences gene expression and is a co-factor for oxidative enzymes such as cytochrome C oxidase and lysyl oxidase. In addition, the oxidative stress induced by copper is thought to activate acid sphingomyelinase, which lead to the production of ceramide, an apoptotic signal, as well as cause hemolytic anemia. (L277, T49, A174, L280)
Alpha-synuclein structureClick to view 3D structureAlpha-synucleinP37840HumansKnownCopper binds to alpha-synuclein, initiating protein aggregation and likely contributing to the development of the neurodegenerative disorders Parkinson's disease and Alzheimer's disease. (A173)
Amyloid-beta precursor protein structureClick to view 3D structureAmyloid-beta precursor proteinP05067HumansKnownCopper binds the N-terminal region of amyloid precursor protein, promoting the generation of _-amyloid from the protein. This is believed to contribute to the development of the neurodegenerative disorders Parkinson's disease and Alzheimer's disease. (A173)
Concentrations
Not Available
External Links
DrugBank IDDB06778
HMDB IDHMDB0303469
FooDB IDFDB014051
Phenol Explorer IDNot Available
KNApSAcK IDNot Available
BiGG IDNot Available
BioCyc IDNot Available
METLIN IDNot Available
PDB IDNot Available
Wikipedia LinkCopper(II)_sulfate
Chemspider ID22870
ChEBI ID23414
PubChem Compound ID24462
Kegg Compound IDC18713
YMDB IDNot Available
ECMDB IDNot Available
References
Synthesis ReferenceNot Available
MSDSNot Available
General References
  1. Brewer GJ: A brand new mechanism for copper toxicity. J Hepatol. 2007 Oct;47(4):621-2. Epub 2007 Jul 23. [PubMed: 17697726]
  2. Bardsley PA, Howard P, DeBacker W, Vermeire P, Mairesse M, Ledent C, Radermecker M, Bury T, Ansquer J: Two years treatment with almitrine bismesylate in patients with hypoxic chronic obstructive airways disease. Eur Respir J. 1991 Mar;4(3):308-10. [PubMed: 1907566]
  3. ATSDR - Agency for Toxic Substances and Disease Registry (2001). Minimal Risk Levels (MRLs) for Hazardous Substances. U.S. Public Health Service in collaboration with U.S. Environmental Protection Agency (EPA). - http://www.atsdr.cdc.gov/mrls/
  4. Wikipedia. Copper. Last Updated 29 May 2009. - http://en.wikipedia.org/wiki/Copper
  5. ATSDR - Agency for Toxic Substances and Disease Registry (2004). Toxicological profile for copper. U.S. Public Health Service in collaboration with U.S. Environmental Protection Agency (EPA). - http://www.atsdr.cdc.gov/toxprofiles/tp132.html
  6. International Programme on Chemical Safety (IPCS) INCHEM (1998). Environmental Health Criteria for Copper. - http://www.inchem.org/documents/ehc/ehc/ehc200.htm
  7. US Environmental Protection Agency (2008). Drinking Water Health Advisory for 2,4-Dinitrotoluene and 2,6-Dinitrotoluene. - http://www.epa.gov/OGWDW/ccl/pdfs/reg_determine2/healthadvisory_ccl2-reg2_dinitrotoluenes.pdf
  8. Wikipedia. Copper(II) sulfate. Last Updated 28 May 2009. - http://en.wikipedia.org/wiki/Copper(II)_sulfate
  9. The Physical and Theoretical Chemistry Laboratory of Oxford University (2009). Material Safety Data Sheet (MSDS) for copper (II) sulfate. - http://msds.chem.ox.ac.uk/CO/copper_II_sulfate.html
  10. Baselt RC (2000). Disposition of Toxic Drugs and Chemicals in Man, 5th ed. Foster City, CA: Chemical Toxicology Institute.
  11. Baxter PJ, Adams PH, & Aw TC (2000). Hunter's Diseases of Occupations. 9th ed. New York, NY: Oxford University Press Inc.