methylparaben 🐶 Veterinary Use | Indications/Contra | FAERs-F | FAERs-M | Orange Bk | BioActivity |

Stem definitionDrug idCAS RN
1766 99-76-3

Description:

MoleculeDescription

Molfile Inchi Smiles

Synonyms:

  • methyl parahydroxybenzoate
  • methylparaben
  • maseptol
  • p-carbomethoxyphenol
  • p-hydroxybenzoic acid methyl ester
  • p-methoxycarbonylphenol
used as a preservative in cosmetics but potentiates UV-induced damage of skin; RN given refers to parent cpd
  • Molecular weight: 152.15
  • Formula: C8H8O3
  • CLOGP: 1.99
  • LIPINSKI: 0
  • HAC: 3
  • HDO: 1
  • TPSA: 46.53
  • ALOGS: -1.62
  • ROTB: 2

Drug dosage:

None

ADMET properties:

PropertyValueReference
S (Water solubility) 2 mg/mL Bocci G, Oprea TI, Benet LZ
BDDCS (Biopharmaceutical Drug Disposition Classification System) 1 Bocci G, Oprea TI, Benet LZ

Approvals:

None

FDA Adverse Event Reporting System (Female)

None

FDA Adverse Event Reporting System (Male)

None

FDA Adverse Event Reporting System (Geriatric)

None

FDA Adverse Event Reporting System (Pediatric)

None

Pharmacologic Action:

SourceCodeDescription
FDA CS M0000728 Allergens
MeSH PA D010592 Pharmaceutic Aids
MeSH PA D011310 Preservatives, Pharmaceutical
FDA PE N0000175629 Increased Histamine Release
FDA PE N0000184306 Cell-mediated Immunity
FDA EPC N0000185508 Standardized Chemical Allergen
CHEBI has role CHEBI:35718 antifungal agents
CHEBI has role CHEBI:63726 neuroprotective agents
CHEBI has role CHEBI:65256 antimicrobial food preservatives
CHEBI has role CHEBI:76924 plant metabolites

Drug Use | Suggest Off label Use Form| |View source of the data|

None




🐶 Veterinary Drug Use

None

🐶 Veterinary products

None

Acid dissociation constants calculated using MoKa v3.0.0

Dissociation levelDissociation constantType (acidic/basic)
pKa1 8.41 acidic

Orange Book patent data (new drug applications)

None

Orange Book exclusivity data (new drug applications)

None

Bioactivity Summary:

TargetClassPharosUniProtActionTypeActivity value
(-log[M])
Mechanism
action
Bioact sourceMoA source
Carbonic anhydrase 2 Enzyme Ki 5.47 CHEMBL
Carbonic anhydrase 1 Enzyme Ki 5.59 CHEMBL
Carbonic anhydrase 9 Enzyme Ki 5.26 CHEMBL
Carbonic anhydrase 12 Enzyme Ki 6.09 CHEMBL
Carbonic anhydrase 7 Enzyme Ki 6.11 CHEMBL
Carbonic anhydrase 14 Enzyme Ki 5.39 CHEMBL

External reference:

IDSource
4017838 VUID
N0000179191 NUI
D01400 KEGG_DRUG
4017413 VANDF
4017838 VANDF
C0066415 UMLSCUI
CHEBI:31835 CHEBI
MPB PDB_CHEM_ID
CHEMBL325372 ChEMBL_ID
DB14212 DRUGBANK_ID
7456 PUBCHEM_CID
C015358 MESH_SUPPLEMENTAL_RECORD_UI
A2I8C7HI9T UNII
29903 RXNORM
NOCODE MMSL
003195 NDDF
255868004 SNOMEDCT_US
411204003 SNOMEDCT_US

Pharmaceutical products:

ProductCategoryIngredientsNDCFormQuantityRouteMarketingLabel
isLeaf Long Lasting Waterproof Eyeliner Black HUMAN OTC DRUG LABEL 1 70818-003 LIQUID 0.30 g TOPICAL unapproved drug other 7 sections
isLeaf Tattoo Eyebrow Brown HUMAN OTC DRUG LABEL 1 70818-007 GEL 0.30 g TOPICAL unapproved drug other 7 sections
isLeaf Long Lasting Waterproof Eyeliner Brown HUMAN OTC DRUG LABEL 1 70818-008 GEL 0.30 g TOPICAL unapproved drug other 7 sections
Anubis Barcelona Regul Oil HUMAN OTC DRUG LABEL 31 83021-300 CREAM 0.48 g TOPICAL OTC monograph final 9 sections
Anubis Barcelona Regul Oil HUMAN OTC DRUG LABEL 31 83021-300 CREAM 0.48 g TOPICAL OTC monograph final 9 sections
Anubis Barcelona HUMAN OTC DRUG LABEL 27 83021-617 CONCENTRATE 0.01 g TOPICAL OTC monograph final 9 sections
Anubis Barcelona HUMAN OTC DRUG LABEL 27 83021-617 CONCENTRATE 0.01 g TOPICAL OTC monograph final 9 sections
Anubis Barcelona Regul OIl HUMAN OTC DRUG LABEL 27 83021-624 CONCENTRATE 0.01 g TOPICAL OTC monograph final 9 sections
Anubis Barcelona Regul OIl HUMAN OTC DRUG LABEL 27 83021-624 CONCENTRATE 0.01 g TOPICAL OTC monograph final 9 sections
Anubis Barcelona Regul Oil HUMAN OTC DRUG LABEL 17 83021-740 LOTION 0.50 g TOPICAL OTC monograph final 9 sections
Anubis Barcelona Regul Oil HUMAN OTC DRUG LABEL 17 83021-740 LOTION 0.50 g TOPICAL OTC monograph final 9 sections
Anubis Barcelona Regul Oil HUMAN OTC DRUG LABEL 38 83021-742 CREAM 0.60 g TOPICAL OTC monograph final 9 sections
Anubis Barcelona Regul Oil HUMAN OTC DRUG LABEL 38 83021-742 CREAM 0.60 g TOPICAL OTC monograph final 9 sections