Zinc chloride (CED0003142)

Record Information
Version1.0
Creation Date2009-03-27 00:41:40 UTC
Update Date2026-05-14 19:43:01 UTC
SynCED IDCED0003142
Secondary Accession Numbers
  • CHEM000653
  • T3D0726
Identification
Common NameZinc chloride
ClassSmall Molecule
Description
Zinc chloride (Cl2Zn) is an exogenous inorganic compound with an average molecular weight of 136.31 g/mol. Zinc chloride belongs to the transition metal chlorides, a subclass of transition metal salts within the inorganic compounds. It is classified as a mixed metal/non-metal compound and exists as a solid at room temperature. The compound serves several industrial, biological, and chemical roles, acting as a Lewis acid (PMC10342298 , PMC9919330 ), a catalyst (PMC9632252 ), a humectant, a corrosion inhibitor, a disinfectant, and an astringent. It is also used as an industrial flavouring and nutrient. In the production of plastics, it is utilized in polyamide and polyethylene terephthalate. Zinc chloride is released from 36 recorded sources, including electrical and electronic equipment such as antennas and communication cables, household cleaning and consumer products like soap detergents and bleaching agents, and building and construction materials including tents, canopies, and fencing. It is also found in healthcare products such as vasoprotectives and IV solution additives, as well as in food processing activities including the preparation of vinegar, wine, wort, and beer fermentation processes. Recorded exposure routes include oral, dental, topical, oropharyngeal, and intravenous. Zinc chloride interacts with 97 recorded protein targets, including the B1 bradykinin receptor (BDKRB1), Fructose-bisphosphate aldolase A (ALDOA), and Methylated-DNA--protein-cysteine methyltransferase (MGMT). It also targets Superoxide dismutase [Cu-Zn] (SOD1), where it may act as a ligand, inhibitor, regulator, cofactor, chaperone, or chelator. Unbalanced levels of zinc and copper binding to SOD1 have been linked to amyotrophic lateral sclerosis (ALS).
Contaminant Type
  • Cosmetic Toxin
  • Food Toxin
  • Household Toxin
  • Industrial/Workplace Toxin
  • Inorganic Compound
  • Metabolite
  • Synthetic Compound
  • Zinc Compound
Chemical Structure
Synonyms
ValueSource
Butter OF zincChEBI
Chlorure de zincChEBI
DichlorozincChEBI
Zinc chloride, anhydrousChEBI
ZinkchloridChEBI
ZNCL2ChEBI
HexiteMeSH
Zinc chloride, (65)ZN-labeledMeSH
Chemical FormulaCl2Zn
Average Molecular Mass136.315 g/mol
Monoisotopic Mass133.867 g/mol
CAS Registry Number7646-85-7
IUPAC Namezinc(2+) ion dichloride
Traditional Namezinc(2+) ion dichloride
SMILES[Cl-].[Cl-].[Zn++]
InChI IdentifierInChI=1S/2ClH.Zn/h2*1H;/q;;+2/p-2
InChI KeyJIAARYAFYJHUJI-UHFFFAOYSA-L
Chemical Taxonomy
Description Belongs to the class of inorganic compounds known as transition metal chlorides. These are inorganic compounds in which the largest halogen atom is Chlorine, and the heaviest metal atom is a transition metal.
KingdomInorganic compounds
Super ClassMixed metal/non-metal compounds
ClassTransition metal salts
Sub ClassTransition metal chlorides
Direct ParentTransition metal chlorides
Alternative Parents
Substituents
  • Transition metal chloride
  • Inorganic chloride salt
  • Inorganic salt
Molecular FrameworkNot Available
External Descriptors
Biological Properties
StatusDetected and Not Quantified
OriginExogenous
Cellular Locations
  • Cytoplasm
  • Extracellular
Biofluid LocationsNot Available
Tissue LocationsNot Available
Applications
Biological Roles
Chemical Roles
Organoleptic Effects
  • colorless colour ?
Physical Properties
StateSolid
AppearanceWhite crystals.
Experimental Properties
PropertyValue
Melting Point318°C
Boiling Point732°C (1349.6°F)
SolubilityNot Available
Predicted Properties
PropertyValueSource
Water Solubility46.1 g/LALOGPS
logP0.91ALOGPS
logP0.61ChemAxon
logS-0.47ALOGPS
pKa (Strongest Acidic)-7ChemAxon
Physiological Charge-1ChemAxon
Hydrogen Acceptor Count0ChemAxon
Hydrogen Donor Count0ChemAxon
Polar Surface Area0 ŲChemAxon
Rotatable Bond Count0ChemAxon
Refractivity5.62 m³·mol⁻¹ChemAxon
Polarizability2.39 ųChemAxon
Number of Rings0ChemAxon
BioavailabilityYesChemAxon
Rule of FiveYesChemAxon
Ghose FilterNoChemAxon
Veber's RuleYesChemAxon
MDDR-like RuleNoChemAxon
Spectra
Spectra
Spectrum TypeDescriptionSplash KeyDeposition DateView
Predicted LC-MS/MSPredicted LC-MS/MS Spectrumsplash10-001i-0900000000-af8226cbc0f4547e5fc1Not AvailableView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrumsplash10-001i-0900000000-af8226cbc0f4547e5fc1Not AvailableView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrumsplash10-001i-0900000000-af8226cbc0f4547e5fc1Not AvailableView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrumsplash10-001i-0900000000-b91e9cd9af0982c421c6Not AvailableView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrumsplash10-001i-0900000000-b91e9cd9af0982c421c6Not AvailableView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrumsplash10-001i-0900000000-b91e9cd9af0982c421c6Not AvailableView Spectrum
Toxicity Profile
Toxicity Values
Toxicity ValueOrganismDose DescriptorRoute of ExposurePredicted or ExperimentalToxicity RatingReference
350.0 mg/kg RatLD50OralexperimentalNot Available7
58.0 mg/kg RatLD50IntraperitonealexperimentalNot Available7
330.0 mg/kg MouseLD50SubcutaneousexperimentalNot Available8
1975.0 mg/m3 RatLC50Inhalation (10 minutes)experimentalNot Available8
1.0 mg/kg-day RatNOELinjectionexperimentalNot AvailableECOTOX - EPA ORD
2.0 mg/kg-day RatLOELinjectionexperimentalNot AvailableECOTOX - EPA ORD
2.0 mg/kg-day RatNOELinjectionexperimentalNot AvailableECOTOX - EPA ORD
2.0 mg/kg-day RatNOELinjectionexperimentalNot AvailableECOTOX - EPA ORD
5.0 mg/kg-day RatNOELinjectionexperimentalNot AvailableECOTOX - EPA ORD
5.0 % RatNOELdermalexperimentalNot AvailableECOTOX - EPA ORD
13.0 mg/kg-day RatNOELinjectionexperimentalNot AvailableECOTOX - EPA ORD
8.5 mg/org-day RatNOELoralexperimentalNot AvailableECOTOX - EPA ORD
2.0 mg/kg-day RatNOELinjectionexperimentalNot AvailableECOTOX - EPA ORD
0.1 mmol/kg RatNOELinjectionexperimentalNot AvailableECOTOX - EPA ORD
13.4 mg/L RatNOELoralexperimentalNot AvailableECOTOX - EPA ORD
5.0 % RatNOELdermalexperimentalNot AvailableECOTOX - EPA ORD
100.0 mg/L MouseNOELoralexperimentalNot AvailableECOTOX - EPA ORD
13.0 mg/kg-day RatLOELinjectionexperimentalNot AvailableECOTOX - EPA ORD
8.0 mg/org-day RatNOELoralexperimentalNot AvailableECOTOX - EPA ORD
1550.0 ppm RatLOELoralexperimentalNot AvailableECOTOX - EPA ORD
0.05 mmol/kg MouseNOELinjectionexperimentalNot AvailableECOTOX - EPA ORD
0.1 mmol/kg MouseLOELinjectionexperimentalNot AvailableECOTOX - EPA ORD
1.0 % w/v MouseLOELdermalexperimentalNot AvailableECOTOX - EPA ORD
5.0 mg/kg-day RatLOELinjectionexperimentalNot AvailableECOTOX - EPA ORD
1.0 mg/kg-day RatLOELinjectionexperimentalNot AvailableECOTOX - EPA ORD
400.0 ppm RatLOELoralexperimentalNot AvailableECOTOX - EPA ORD
0.5 mg/kg-day RatNOELinjectionexperimentalNot AvailableECOTOX - EPA ORD
0.5 mg/kg-day RatNOELinjectionexperimentalNot AvailableECOTOX - EPA ORD
20000.0 ppm MouseNOELoralexperimentalNot AvailableECOTOX - EPA ORD
100.0 mg/L MouseNOELoralexperimentalNot AvailableECOTOX - EPA ORD
28.0 mg/kg-day MouseLOELinjectionexperimentalNot AvailableECOTOX - EPA ORD
1150.0 ppm RatNOELoralexperimentalNot AvailableECOTOX - EPA ORD
0.12 mg/kg-day MouseLOELinjectionexperimentalNot AvailableECOTOX - EPA ORD
2.0 mg/kg-day RatNOELinjectionexperimentalNot AvailableECOTOX - EPA ORD
10000.0 ppm MouseLOELoralexperimentalNot AvailableECOTOX - EPA ORD
400.0 umol/kg/day MouseLOELinjectionexperimentalNot AvailableECOTOX - EPA ORD
5.0 % RatNOELdermalexperimentalNot AvailableECOTOX - EPA ORD
0.2 mmol/kg RatLOELinjectionexperimentalNot AvailableECOTOX - EPA ORD
250.0 umol/kg bw RatNOELinjectionexperimentalNot AvailableECOTOX - EPA ORD
60.0 mg/L RatLOELoralexperimentalNot AvailableECOTOX - EPA ORD
30.0 mg/L RatNOELoralexperimentalNot AvailableECOTOX - EPA ORD
500.0 mg/L RatNOELoralexperimentalNot AvailableECOTOX - EPA ORD
100.0 umol/g org European RabbitNOELinjectionexperimentalNot AvailableECOTOX - EPA ORD
100.0 mg/L MouseLOELoralexperimentalNot AvailableECOTOX - EPA ORD
100.0 mg/L MouseLOELoralexperimentalNot AvailableECOTOX - EPA ORD
5.0 mg/kg-day RatNOELinjectionexperimentalNot AvailableECOTOX - EPA ORD
1150.0 ppm RatLOELoralexperimentalNot AvailableECOTOX - EPA ORD
0.12 mg/kg-day MouseNOELinjectionexperimentalNot AvailableECOTOX - EPA ORD
1.0 mmol/kg RatLOELinjectionexperimentalNot AvailableECOTOX - EPA ORD
30.0 mg/L RatNOELoralexperimentalNot AvailableECOTOX - EPA ORD
8.0 mg/org-day RatLOELoralexperimentalNot AvailableECOTOX - EPA ORD
500.0 mg/L RatNOELoralexperimentalNot AvailableECOTOX - EPA ORD
0.0014 mol/kg bw MouseLOELoralexperimentalNot AvailableECOTOX - EPA ORD
14.0 mg/kg-day MouseLOELinjectionexperimentalNot AvailableECOTOX - EPA ORD
2.0 mg/kg-day RatLOELinjectionexperimentalNot AvailableECOTOX - EPA ORD
2.0 mg/kg-day RatLOELinjectionexperimentalNot AvailableECOTOX - EPA ORD
1000.0 ppm RatLOELoralexperimentalNot AvailableECOTOX - EPA ORD
28.0 mg/kg-day MouseLOELinjectionexperimentalNot AvailableECOTOX - EPA ORD
13.4 mg/L RatLOELoralexperimentalNot AvailableECOTOX - EPA ORD
100.0 mg/L MouseLOELoralexperimentalNot AvailableECOTOX - EPA ORD
2.0 mg/kg-day RatNOELinjectionexperimentalNot AvailableECOTOX - EPA ORD
400.0 umol/kg/day MouseNOELinjectionexperimentalNot AvailableECOTOX - EPA ORD
8.0 mg/kg-day MouseNOELinjectionexperimentalNot AvailableECOTOX - EPA ORD
10.0 mg/kg-day RatNOELinjectionexperimentalNot AvailableECOTOX - EPA ORD
27.0 mg/kg-day RatNOELinjectionexperimentalNot AvailableECOTOX - EPA ORD
0.5 % MouseLOELoralexperimentalNot AvailableECOTOX - EPA ORD
28.0 mg/kg-day MouseNOELinjectionexperimentalNot AvailableECOTOX - EPA ORD
240.0 mg/L RatLOELoralexperimentalNot AvailableECOTOX - EPA ORD
0.5 % MouseNOELoralexperimentalNot AvailableECOTOX - EPA ORD
4.6 mmol RatLOELoralexperimentalNot AvailableECOTOX - EPA ORD
5.0 mg/kg-day RatLOELinjectionexperimentalNot AvailableECOTOX - EPA ORD
1150.0 ppm RatLOELoralexperimentalNot AvailableECOTOX - EPA ORD
20.0 mg/kg-day RatLOELinjectionexperimentalNot AvailableECOTOX - EPA ORD
200.0 umol/kg/day RatNOELinjectionexperimentalNot AvailableECOTOX - EPA ORD
3.2 mg/kg-day RatNOELinjectionexperimentalNot AvailableECOTOX - EPA ORD
0.0014 mol/kg bw MouseNOELoralexperimentalNot AvailableECOTOX - EPA ORD
2.0 mg/kg-day RatNOELinjectionexperimentalNot AvailableECOTOX - EPA ORD
100.0 mg/L MouseNOELoralexperimentalNot AvailableECOTOX - EPA ORD
3.2 mg/kg-day RatLOELinjectionexperimentalNot AvailableECOTOX - EPA ORD
4.0 mg/kg-day RatLOELinjectionexperimentalNot AvailableECOTOX - EPA ORD
500.0 mg/L MouseNOELoralexperimentalNot AvailableECOTOX - EPA ORD
27.0 mg/kg-day RatNOELinjectionexperimentalNot AvailableECOTOX - EPA ORD
28.0 mg/kg-day MouseLOELinjectionexperimentalNot AvailableECOTOX - EPA ORD
250.0 umol/kg bw RatLOELinjectionexperimentalNot AvailableECOTOX - EPA ORD
0.1 mmol/kg RatLOELinjectionexperimentalNot AvailableECOTOX - EPA ORD
4.6 mmol RatNOELoralexperimentalNot AvailableECOTOX - EPA ORD
28.0 mg/kg-day MouseNOELinjectionexperimentalNot AvailableECOTOX - EPA ORD
0.01 mM RatLOELinjectionexperimentalNot AvailableECOTOX - EPA ORD
0.5 mg/kg-day RatNOELinjectionexperimentalNot AvailableECOTOX - EPA ORD
6.5 mg/kg-day RatLOELinjectionexperimentalNot AvailableECOTOX - EPA ORD
3.2 mg/kg-day RatNOELinjectionexperimentalNot AvailableECOTOX - EPA ORD
27.0 mg/kg-day RatLOELinjectionexperimentalNot AvailableECOTOX - EPA ORD
1150.0 ppm RatNOELoralexperimentalNot AvailableECOTOX - EPA ORD
1150.0 ppm RatLOELoralexperimentalNot AvailableECOTOX - EPA ORD
240.0 mg/L RatNOELoralexperimentalNot AvailableECOTOX - EPA ORD
1550.0 ppm RatLOELoralexperimentalNot AvailableECOTOX - EPA ORD
59.1 umol/kg bw MouseNOELinjectionexperimentalNot AvailableECOTOX - EPA ORD
20.0 mg/kg-day RatNOELinjectionexperimentalNot AvailableECOTOX - EPA ORD
4.6 mmol RatNOELoralexperimentalNot AvailableECOTOX - EPA ORD
1.0 mg/kg-day RatNOELinjectionexperimentalNot AvailableECOTOX - EPA ORD
1550.0 ppm RatNOELoralexperimentalNot AvailableECOTOX - EPA ORD
30.0 mg/L RatLOELoralexperimentalNot AvailableECOTOX - EPA ORD
100.0 mg/L MouseNOELoralexperimentalNot AvailableECOTOX - EPA ORD
15.0 umol/kg bw MouseNOELoralexperimentalNot AvailableECOTOX - EPA ORD
15.0 umol/kg bw MouseLOELoralexperimentalNot AvailableECOTOX - EPA ORD
4.6 mmol RatLOELoralexperimentalNot AvailableECOTOX - EPA ORD
100.0 mg/L MouseNOELoralexperimentalNot AvailableECOTOX - EPA ORD
1150.0 ppm RatLOELoralexperimentalNot AvailableECOTOX - EPA ORD
530.0 ppm RatLOELoralexperimentalNot AvailableECOTOX - EPA ORD
530.0 ppm RatNOELoralexperimentalNot AvailableECOTOX - EPA ORD
100.0 mg/L MouseLOELoralexperimentalNot AvailableECOTOX - EPA ORD
4.0 mg/kg-day RatNOELinjectionexperimentalNot AvailableECOTOX - EPA ORD
8.0 mg/kg-day RatLOELinjectionexperimentalNot AvailableECOTOX - EPA ORD
14.0 mg/kg-day MouseNOELinjectionexperimentalNot AvailableECOTOX - EPA ORD
2.5 % RatNOELdermalexperimentalNot AvailableECOTOX - EPA ORD
5.0 % RatLOELdermalexperimentalNot AvailableECOTOX - EPA ORD
1150.0 ppm RatNOELoralexperimentalNot AvailableECOTOX - EPA ORD
1150.0 ppm RatLOELoralexperimentalNot AvailableECOTOX - EPA ORD
400.0 ppm RatNOELoralexperimentalNot AvailableECOTOX - EPA ORD
8.5 mg/org-day RatLOELoralexperimentalNot AvailableECOTOX - EPA ORD
1550.0 ppm RatNOELoralexperimentalNot AvailableECOTOX - EPA ORD
1.0 mM MouseNOELoralexperimentalNot AvailableECOTOX - EPA ORD
60.0 mg/L RatNOELoralexperimentalNot AvailableECOTOX - EPA ORD
1000.0 ppm RatNOELoralexperimentalNot AvailableECOTOX - EPA ORD
100.0 mg/L MouseNOELoralexperimentalNot AvailableECOTOX - EPA ORD
1150.0 ppm RatNOELoralexperimentalNot AvailableECOTOX - EPA ORD
27.0 mg/kg-day RatLOELinjectionexperimentalNot AvailableECOTOX - EPA ORD
13.0 umol/kg/day RatLOELinjectionexperimentalNot AvailableECOTOX - EPA ORD
1150.0 ppm RatLOELoralexperimentalNot AvailableECOTOX - EPA ORD
37.5 mg/kg-day RatNOELinjectionexperimentalNot AvailableECOTOX - EPA ORD
37.5 mg/kg-day RatLOELinjectionexperimentalNot AvailableECOTOX - EPA ORD
20.0 mg/kg-day RatLOELoralexperimentalNot AvailableECOTOX - EPA ORD
7.5 mg/kg-day RatLOELoralexperimentalNot AvailableECOTOX - EPA ORD
7.5 mg/kg-day RatLOELoralexperimentalNot AvailableECOTOX - EPA ORD
100.0 mg/kg-day RatLOELoralexperimentalNot AvailableECOTOX - EPA ORD
7.5 mg/kg-day RatLOELoralexperimentalNot AvailableECOTOX - EPA ORD
7.5 mg/kg-day RatLOELoralexperimentalNot AvailableECOTOX - EPA ORD
16.5 mg/kg-day MouseLOELoralexperimentalNot AvailableECOTOX - EPA ORD
5.5 mg/kg-day RatLOELoralexperimentalNot AvailableECOTOX - EPA ORD
Toxicity / Toxin ClassNot Available
Mechanism of ToxicityAnaemia results from the excessive absorption of zinc suppressing copper and iron absorption, most likely through competitive binding of intestinal mucosal cells. Unbalanced levels of copper and zinc binding to Cu,Zn-superoxide dismutase has been linked to amyotrophic lateral sclerosis (ALS). Stomach acid dissolves metallic zinc to give corrosive zinc chloride, which can cause damage to the stomach lining. Metal fume fever is thought to be an immune response to inhaled zinc. (2, 3, 1)
Carcinogenicity (IARC Classification)No indication of carcinogenicity to humans (not listed by IARC).
Minimum Risk LevelIntermediate Oral: 0.3 mg/kg/day (6) Chronic Oral: 0.3 mg/kg/day (6)
SymptomsIngestion of large doses of zinc causes stomach cramps, nausea, and vomiting. Acute inhalation of large amounts of zinc causes metal fume fever, which is characterized by chills, fever, headache, weakness, dryness of the nose and throat, chest pain, and coughing. Dermal contact with zinc results in skin irritation. (3)
TreatmentZinc poisoning is treated symptomatically, often by administering fluids such as water or milk, or with gastric lavage. (3)
Health Effects
Health EffectRelationshipDirectionDescriptionReference
periodontal diseaseNot AvailableNot AvailableA disorder in the gingival tissue around the teeth. (NCI CTCAE)PMC10005605
Toxic encephalopathyHas Therapeutic Effect OnNot AvailableNot AvailablePMC9566368
Oxidative StressHas Therapeutic Effect OnNot AvailableNot AvailablePMC9566368
HalitosisNot AvailableNot AvailableNot AvailablePMC10005605
Exposure Sources
Source IDSourceSectorReference
CEDs000010Insecticides?Insecticides are synthetic chemicals designed to control or eliminate insect pests that threaten crops and other agricultural products.Agriculture & land managementPubChem
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
CEDs000115Drinking water?Drinking water can be a medium for synthetic chemical contamination, often originating from various industrial processes and agricultural practices.Drinking water & water supplyPMC9566368 , PMC9566368
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
CEDs000281IV solution additives?IV solution additives are substances incorporated into intravenous fluids to enhance therapeutic effects, such as electrolytes, vitamins, and medications.Healthcare, pharmaceuticals & veterinary productsNot Available
CEDs000292Vasoprotectives?Vasoprotectives are synthetic compounds designed to enhance vascular health and improve blood circulation.Healthcare, pharmaceuticals & veterinary productsNot Available
CEDs000496Fencing?Fencing materials, particularly those used in construction and landscaping, can be a source of synthetic chemical contamination due to the treatments and coatings applied for durability and weather resistance.Building & ConstructionPubChem
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
CEDs000503Tents Or Canopies?Tents and canopies used in various applications can be a source of synthetic chemical contamination primarily due to the materials from which they are made.Building & ConstructionPubChem
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
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
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
CEDs000530Radio Transmission Systems?Radio transmission systems utilize a variety of synthetic chemicals in their manufacturing and maintenance processes.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
CEDs000544Fermentation Processes For Beer?Fermentation processes for beer involve the conversion of sugars into alcohol and carbon dioxide by yeast.Food, food processing & cookwarePubChem
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
CEDs000550Preparation Of Wort?The preparation of wort involves the extraction of sugars from malted grains, a crucial step in the brewing process.Food, food processing & cookwarePubChem
CEDs000552Processing Meats?Processing meats can lead to synthetic chemical contamination primarily through the use of additives and preservatives.Food, food processing & cookwarePubChem
CEDs000553Treatment 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 & 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
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
CEDs000564Soap Dispensers?Soap dispensers, commonly used for dispensing liquid soaps and sanitizers, can become a source of synthetic chemical contamination due to the materials used in their construction and the products they dispense.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
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
CEDs000596Acaricides?Acaricides are synthetic chemicals specifically designed to target and control mite populations that can damage crops and plants.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
CEDs000601Lawn Mowers?Lawn mowers, particularly those powered by gasoline, can be a source of synthetic chemical contamination due to the combustion of fossil fuels and the use of engine oils.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
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
CEDs000609Aftershave?Aftershave is a grooming product typically used to soothe and protect the skin following shaving.Personal care & cosmeticsPubChem
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
CEDs000613Depilatories?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 & 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
CEDs000616Face Mask Cosmetics?Face mask cosmetics often contain a variety of synthetic chemicals, including preservatives, emulsifiers, and fragrances, which can contribute to chemical contamination.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
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
CEDs000640Embroidering And Tufting?Embroidering and tufting processes often involve the use of synthetic chemicals such as dyes, adhesives, and finishing agents.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
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
CEDs000647Multicolour Dyeing?Multicolour dyeing involves the application of multiple synthetic dyes to textiles and other materials to achieve vibrant, diverse color patterns.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
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
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
CEDs000667Gaseous Fire Fighting?Gaseous fire fighting systems utilize synthetic chemicals, such as halocarbons and inert gases, to suppress fires through chemical and physical processes.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
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
CEDs000689Glass Fibres?Glass fibres are composed of fine strands of glass, commonly utilized for their tensile strength and lightweight properties.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
CEDs000691Non Oxide Glass?Non-oxide glass refers to a category of glasses primarily composed of materials other than silicon dioxide, such as boron oxide or phosphorous oxide.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
CEDs000698Jewellery?Jewellery production often involves the use of various synthetic chemicals during the extraction and processing of metals.Mining & metal processingPubChem
CEDs000714Embossing Machines?Embossing machines are industrial devices used to create raised patterns or designs on materials, including paper and fiber products.Paper, pulp & fiber productsPubChem
CEDs000716Erasers?Erasers, commonly used in writing and drawing applications, are often made from synthetic rubber or thermoplastic materials, which can contain various additives such as plasticizers, fillers, and colorants.Paper, pulp & fiber productsPubChem
CEDs000727Printing Machines Or Presses?Printing machines or presses commonly utilize synthetic chemicals such as inks, solvents, and cleaning agents.Paper, pulp & fiber productsPubChem
CEDs000729Stamps?Stamps, particularly those produced using synthetic inks and adhesives, can contribute to chemical contamination when disposed of improperly.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
CEDs00754BiocharAgriculture & land managementPMC11639365 , PMC13060624
CEDs00835Corn CobAgriculture & land managementPMC12198968
CEDs01143DietFood, food processing & cookwarePMC9314993
CEDs01804Glass BottlePackagingPMC12804339
CEDs02255WaterAquatic systems & sedimentsPMC5860638 , PMC6036969
CEDs03009Waste WaterWastewater, sanitation & biosolidsPMC6717656 , PMC8806354
Pathways
1 pathwayPathway Source: PathBank
Targets
StructureProteinUniProt IDOrganismRelationshipDetails
Click to view 3D structureProtein Gpr39A6QR73Rattus norvegicusPredicted (SEA)
Prediction Confidence Score
0.264
Applicability Domain
1.0
Statistical Significance
3.00e-05
Supporting Reference Compounds
4
E-value
0.233548
Epidermal growth factor receptor structureClick to view 3D structureEpidermal growth factor receptorP00533HumansPredicted (SEA)
Prediction Confidence Score
0.229
Applicability Domain
1.0
Statistical Significance
0.6293
Supporting Reference Compounds
1301
E-value
4899.29
Tyrosine-protein kinase Fyn structureClick to view 3D structureTyrosine-protein kinase FynP06241HumansPredicted (SEA)
Prediction Confidence Score
0.227
Applicability Domain
1.0
Statistical Significance
0.5351
Supporting Reference Compounds
707
E-value
4165.48
Carbonic anhydrase 2 structureClick to view 3D structureCarbonic anhydrase 2P00918HumansPredicted (SEA)
Prediction Confidence Score
0.227
Applicability Domain
1.0
Statistical Significance
0.3134
Supporting Reference Compounds
472
E-value
2439.87
Sodium-dependent noradrenaline transporter structureClick to view 3D structureSodium-dependent noradrenaline transporterP23975HumansPredicted (SEA)
Prediction Confidence Score
0.226
Applicability Domain
1.0
Statistical Significance
0.359
Supporting Reference Compounds
451
E-value
2794.55
Androgen receptor structureClick to view 3D structureAndrogen receptorP15207Rattus norvegicusPredicted (SEA)
Prediction Confidence Score
0.222
Applicability Domain
1.0
Statistical Significance
0.0251
Supporting Reference Compounds
73
E-value
195.324
Click to view 3D structureG-protein coupled receptor 39O43194HumansPredicted (SEA)
Prediction Confidence Score
0.216
Applicability Domain
1.0
Statistical Significance
0.0011
Supporting Reference Compounds
6
E-value
8.64126
Protein phosphatase 3 catalytic subunit alpha structureClick to view 3D structureProtein phosphatase 3 catalytic subunit alphaQ08209HumansPredicted (SEA)
Prediction Confidence Score
0.2
Applicability Domain
1.0
Statistical Significance
5.80e-04
Supporting Reference Compounds
7
E-value
4.51525
Click to view 3D structurePhospholipase BQ9P8P2Cryptococcus neoformansPredicted (SEA)
Prediction Confidence Score
0.067
Applicability Domain
0.067 Low confidence
Statistical Significance
0.0558
Supporting Reference Compounds
1
E-value
434.477
C-C chemokine receptor type 8 structureClick to view 3D structureC-C chemokine receptor type 8P51685HumansPredicted (SEA)
Prediction Confidence Score
0.049
Applicability Domain
0.059 Low confidence
Statistical Significance
0.9998
Supporting Reference Compounds
17
E-value
7783.44
C-C chemokine receptor type 1 structureClick to view 3D structureC-C chemokine receptor type 1P32246HumansPredicted (SEA)
Prediction Confidence Score
0.047
Applicability Domain
0.059 Low confidence
Statistical Significance
0.9999
Supporting Reference Compounds
54
E-value
7784.53
Click to view 3D structureNonstructural protein 1Q194T2Influenza A virusPredicted (SEA)
Prediction Confidence Score
0.046
Applicability Domain
0.059 Low confidence
Statistical Significance
1.0
Supporting Reference Compounds
104
E-value
7784.61
Click to view 3D structureBeta-lactamaseQ44079Aeromonas hydrophilaPredicted (SEA)
Prediction Confidence Score
0.046
Applicability Domain
0.048 Low confidence
Statistical Significance
0.9936
Supporting Reference Compounds
2
E-value
7735.41
Dual specificity tyrosine-phosphorylation-regulated kinase 1A structureClick to view 3D structureDual specificity tyrosine-phosphorylation-regulated kinase 1AQ13627HumansPredicted (SEA)
Prediction Confidence Score
0.045
Applicability Domain
0.071 Low confidence
Statistical Significance
1.0
Supporting Reference Compounds
906
E-value
7784.69
Glycogen synthase kinase-3 beta structureClick to view 3D structureGlycogen synthase kinase-3 betaP49841HumansPredicted (SEA)
Prediction Confidence Score
0.045
Applicability Domain
0.071 Low confidence
Statistical Significance
1.0
Supporting Reference Compounds
1157
E-value
7784.77
Cytochrome P450 3A4 structureClick to view 3D structureCytochrome P450 3A4P08684HumansPredicted (SEA)
Prediction Confidence Score
0.044
Applicability Domain
0.053 Low confidence
Statistical Significance
1.0
Supporting Reference Compounds
1538
E-value
7784.69
Click to view 3D structureAdvanced glycosylation end product-specific receptorQ63495Rattus norvegicusPredicted (SEA)
Prediction Confidence Score
0.043
Applicability Domain
0.043 Low confidence
Statistical Significance
0.9932
Supporting Reference Compounds
1
E-value
7731.75
Cytochrome P450 2A6 structureClick to view 3D structureCytochrome P450 2A6P11509HumansPredicted (SEA)
Prediction Confidence Score
0.043
Applicability Domain
0.063 Low confidence
Statistical Significance
1.0
Supporting Reference Compounds
68
E-value
7784.61
Prothrombin structureClick to view 3D structureProthrombinP00734HumansPredicted (SEA)
Prediction Confidence Score
0.043
Applicability Domain
0.059 Low confidence
Statistical Significance
1.0
Supporting Reference Compounds
331
E-value
7784.69
Acrosin structureClick to view 3D structureAcrosinP08001Sus scrofaPredicted (SEA)
Prediction Confidence Score
0.042
Applicability Domain
0.059 Low confidence
Statistical Significance
0.9927
Supporting Reference Compounds
8
E-value
7728.25
Ribosomal protein S6 kinase alpha-5 structureClick to view 3D structureRibosomal protein S6 kinase alpha-5O75582HumansPredicted (SEA)
Prediction Confidence Score
0.041
Applicability Domain
0.059 Low confidence
Statistical Significance
1.0
Supporting Reference Compounds
389
E-value
7784.69
Acetylcholinesterase structureClick to view 3D structureAcetylcholinesteraseP22303HumansPredicted (SEA)
Prediction Confidence Score
0.041
Applicability Domain
0.05 Low confidence
Statistical Significance
1.0
Supporting Reference Compounds
406
E-value
7784.77
Muscarinic acetylcholine receptor M5 structureClick to view 3D structureMuscarinic acetylcholine receptor M5P08912HumansPredicted (SEA)
Prediction Confidence Score
0.04
Applicability Domain
0.048 Low confidence
Statistical Significance
1.0
Supporting Reference Compounds
266
E-value
7784.77
Botulinum neurotoxin type A structureClick to view 3D structureBotulinum neurotoxin type AP0DPI0Clostridium botulinumPredicted (SEA)
Prediction Confidence Score
0.04
Applicability Domain
0.059 Low confidence
Statistical Significance
0.9998
Supporting Reference Compounds
17
E-value
7783.75
Coagulation factor X structureClick to view 3D structureCoagulation factor XP00742HumansPredicted (SEA)
Prediction Confidence Score
0.04
Applicability Domain
0.059 Low confidence
Statistical Significance
1.0
Supporting Reference Compounds
284
E-value
7784.61
Acetylcholinesterase structureClick to view 3D structureAcetylcholinesteraseP22303HumansKnownNot Available
Catalase structureClick to view 3D structureCatalaseP04040HumansKnownNot Available
Superoxide dismutase [Cu-Zn] structureClick to view 3D structureSuperoxide dismutase [Cu-Zn]P00441HumansKnownUnbalanced levels of copper and zinc binding to Cu,Zn-superoxide dismutase has been linked to amyotrophic lateral sclerosis (ALS). (A49)
Utrophin structureClick to view 3D structureUtrophinP46939HumansKnownNot Available
Concentrations
Not Available
External Links
DrugBank IDDBSALT001307
HMDB IDHMDB0034904
FooDB IDFDB013485
Phenol Explorer IDNot Available
KNApSAcK IDNot Available
BiGG IDNot Available
BioCyc IDNot Available
METLIN IDNot Available
PDB IDNot Available
Wikipedia LinkZinc_Chloride
Chemspider IDNot Available
ChEBI ID49976
PubChem Compound IDNot Available
Kegg Compound IDNot Available
YMDB IDNot Available
ECMDB IDNot Available
References
Synthesis ReferenceNot Available
MSDSLink
General References
  1. Vonk WI, Klomp LW: Role of transition metals in the pathogenesis of amyotrophic lateral sclerosis. Biochem Soc Trans. 2008 Dec;36(Pt 6):1322-8. doi: 10.1042/BST0361322. [PubMed: 19021549]
  2. Wikipedia. Zinc. Last Updated 24 March 2009. - http://en.wikipedia.org/wiki/Zinc
  3. ATSDR - Agency for Toxic Substances and Disease Registry (2005). Toxicological profile for zinc. U.S. Public Health Service in collaboration with U.S. Environmental Protection Agency (EPA). - http://www.atsdr.cdc.gov/toxprofiles/tp60.html
  4. Wikipedia. Zinc chloride. Last Updated 16 March 2009. - http://en.wikipedia.org/wiki/Zinc_chloride
  5. Wikipedia. Metallothionein. Last Updated 20 December 2008. - http://en.wikipedia.org/wiki/Metallothionein
  6. 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/
  7. Lewis RJ Sr. (ed) (2004). Sax's Dangerous Properties of Industrial Materials. 11th Edition. Hoboken, NJ: Wiley-Interscience, Wiley & Sons, Inc.
  8. European Chemicals Bureau (2004). EU Risk Assessment Report- Zinc chloride, Vol.45.
  9. Yannai, Shmuel. (2004) Dictionary of food compounds with CD-ROM: Additives, flavors, and ingredients. Boca Raton: Chapman & Hall/CRC.