oleic acid Indications/Contra | FAERs-F | FAERs-M | Orange Bk | BioActivity |

Stem definitionDrug idCAS RN
3400 112-80-1

Description:

MoleculeDescription

Molfile Inchi Smiles

Synonyms:

  • oleic acid
  • 9Z-Octadecenoic acid
An unsaturated fatty acid that is the most widely distributed and abundant fatty acid in nature. It is used commercially in the preparation of oleates and lotions, and as a pharmaceutical solvent. (Stedman, 26th ed)
  • Molecular weight: 282.47
  • Formula: C18H34O2
  • CLOGP: 7.79
  • LIPINSKI: 1
  • HAC: 2
  • HDO: 1
  • TPSA: 37.30
  • ALOGS: -6.37
  • ROTB: 15

Drug dosage:

None

ADMET properties:

None

Approvals:

DateAgencyCompanyOrphan
None FDA

FDA Adverse Event Reporting System (Female)

None

FDA Adverse Event Reporting System (Male)

None

Pharmacologic Action:

SourceCodeDescription
CHEBI has role CHEBI:22586 antioxidants
CHEBI has role CHEBI:46787 solvents
CHEBI has role CHEBI:75771 mus musculus metabolite
CHEBI has role CHEBI:76924 plant metabolites
CHEBI has role CHEBI:76971 e.coli metabolites
CHEBI has role CHEBI:78444 carboxylic esterase inhibitors
CHEBI has role CHEBI:83038 daphnia galeata metabolites

Drug Use (View source of the data)

DiseaseRelationSNOMED_IDDOID
Sensation Disturbance of Genitals contraindication

Acid dissociation constants calculated using MoKa v3.0.0

Dissociation levelDissociation constantType (acidic/basic)
pKa1 4.76 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
Free fatty acid receptor 1 GPCR AGONIST EC50 5.70 IUPHAR
Fatty-acid amide hydrolase 1 Enzyme Ki 5.22 CHEMBL
Aromatase Enzyme IC50 4.49 CHEMBL
Peroxisome proliferator-activated receptor gamma Nuclear hormone receptor IC50 5.39 CHEMBL
Fatty acid-binding protein, epidermal Cytosolic other Ki 6.61 CHEMBL
Fatty acid-binding protein, liver Unclassified Kd 6.70 CHEMBL
Peroxisome proliferator-activated receptor delta Nuclear hormone receptor IC50 5.28 CHEMBL
Peroxisome proliferator-activated receptor alpha Nuclear hormone receptor IC50 6.22 CHEMBL
Tissue factor Membrane receptor IC50 4.10 CHEMBL
Fatty acid-binding protein, adipocyte Cytosolic other Ki 6.73 CHEMBL
DNA topoisomerase 1 Enzyme IC50 4.51 CHEMBL
Free fatty acid receptor 4 GPCR AGONIST EC50 4.70 IUPHAR
Telomerase reverse transcriptase Enzyme IC50 5.07 CHEMBL
Fatty acid-binding protein, liver Unclassified Ki 6.74 CHEMBL
Seed linoleate 13S-lipoxygenase-1 Enzyme Ki 4.66 CHEMBL

External reference:

IDSource
4020299 VUID
N0000148167 NUI
4020299 VANDF
C0028928 UMLSCUI
CHEBI:16196 CHEBI
OLA PDB_CHEM_ID
445639 PUBCHEM_CID
CHEMBL8659 ChEMBL_ID
D019301 MESH_DESCRIPTOR_UI
DB04224 DRUGBANK_ID
1054 IUPHAR_LIGAND_ID
2UMI9U37CP UNII
7631 RXNORM
NOCODE MMSL
002530 NDDF
259579007 SNOMEDCT_US
427281002 SNOMEDCT_US

Pharmaceutical products:

ProductCategoryIngredientsNDCFormQuantityRouteMarketingLabel
Sha-lem HUMAN OTC DRUG LABEL 5 59862-100 OINTMENT 14.50 g TOPICAL unapproved drug other 10 sections