stearic acid 🐶 Veterinary Use | Indications/Contra | FAERs-F | FAERs-M | Orange Bk | PK/Tox | Related Drugs | BioActivity |

Stem definitionDrug idCAS RN
4611 57-11-4

Description:

MoleculeDescription

Molfile Inchi Smiles

Synonyms:

  • stearic acid
  • octadecanoic acid
  • Molecular weight: 284.48
  • Formula: C18H36O2
  • CLOGP: 8.27
  • LIPINSKI: 1
  • HAC: 2
  • HDO: 1
  • TPSA: 37.30
  • ALOGS: -6.63
  • ROTB: 16

Drug dosage:

None

ADMET properties:

None

Predicted pharmacokinetic/toxicological properties (PK-AZ):

PropertyDescriptionValueUnitConfidenceSimilarity
azlogd74 LogD at pH 7.4 5.935 Moderate 0.71
caco2-efflux Caco-2 efflux ratio (BA/AB) 10.162 Moderate 0.71
caco2-intrinsic-papp Caco-2 intrinsic apparent permeability 0.013 10^-6 cm/s Moderate 0.71
dh-clint Dog hepatocyte intrinsic clearance 1358.313 uL/min/10^6 cells Moderate 0.71
dppb Dog plasma protein binding (% unbound) 0 % Moderate 0.71
fcs-ppb Fetal calf serum protein binding (% unbound) 0.010 % Moderate 0.71
herg hERG pIC50 4.499 pIC50 Moderate 0.71
hh-clint Human hepatocyte intrinsic clearance 4325.138 uL/min/10^6 cells Moderate 0.71
hlm-clint Human liver microsomal intrinsic clearance 27.353 uL/min/mg protein Moderate 0.71
hppb Human plasma protein binding (% unbound) 0.090 % Moderate 0.71
kinase-safety-class ACVR2A,ACVR2B,ACVRL1,ALK,AURKA,AXL,BRAF,BTK,CAMK2B,CAMK2D,CDK4,CDK5,CDK9,DDR1,DYRK1B,EGFR,EIF2AK3,EPHB4,ERBB2,FLT3,GRK2,GSK3B,IKBKB,ITK,JAK1,JAK2,JAK3,MAP2K6,MAP3K14,MAP3K21,MAP3K7,MAPK10,MAPK7,MAPK9,MAPKAPK2,MTOR,NTRK2,PDK1,PDK2,PDK4,PDPK1,PIK3CA,PIK3CB,PIK3CD,PIK3CG,PIM2,PLK1,PRKCD,PRKDC,SIK2,SIK3,STK33,SYK,TEK,TGFBR1,TTK,ULK1,ZAP70 58
kinase-selectivity-class AKT2,AXL,BRAF,CAMK2A,CDK4,CSNK2A2,EIF2AK3,EPHB4,GRK2,INSR,MAP2K6,MAPK10,MAPK7,MAPK8,MTOR,PDK4,PLK1,PLK2,PLK3,PLK4,PTK2,SIK2,STK33,TEK,TTK,ZAP70 26
mdck-mdr1-efflux MDCK-MDR1 efflux ratio 0.610 Moderate 0.71
mh-clint Mouse hepatocyte intrinsic clearance 362.243 Moderate 0.71
mppb Mouse plasma protein binding (% unbound) 0.010 Moderate 0.71
nih-mdck-mdr1-efflux NIH MDCK-MDR1 efflux ratio 0.050 Moderate 0.71
pfas-class PFAS structural alert (1 = True, 0 = False) 0
pppb Pig plasma protein binding (% unbound) 0.010 % Moderate 0.71
rh-clint Rat hepatocyte intrinsic clearance 238.232 uL/min/10^6 cells Moderate 0.71
rh-fuinc Rat hepatocyte fraction unbound in incubation 0.010 % Moderate 0.71
rppb Rat plasma protein binding (% unbound) 0.020 % Moderate 0.71
solubility-dd Solubility at pH 7.4 in DMSO 0.222 uM Moderate 0.71

Approvals:

DateAgencyCompanyOrphan
None FDA

FDA Adverse Event Reporting System (Female)

None

FDA Adverse Event Reporting System (Male)

None

FDA Adverse Event Reporting System (Geriatric)

MedDRA adverse event termLikelihood ratioLikelihood ratio thresholdPatients taking drug having adverse eventPatients taking drug not having adverse eventPatients not taking drug having adverse eventPatients not taking drug not having adverse event
Appendicolith 125.80 101.60 32 1789 14223 110573255
Myasthenia gravis 117.28 101.60 33 1788 21478 110566000
Appendicitis 112.44 101.60 34 1787 28430 110559048
Blood phosphorus increased 111.93 101.60 30 1791 16310 110571168
Hyperphosphataemia 107.15 101.60 29 1792 16352 110571126
Blood uric acid increased 103.74 101.60 30 1791 21499 110565979

FDA Adverse Event Reporting System (Pediatric)

None

Pharmacologic Action:

SourceCodeDescription
CHEBI has role CHEBI:76924 plant metabolite
CHEBI has role CHEBI:77746 human metabolite
CHEBI has role CHEBI:83056 <em>Daphnia magna</em> metabolite
CHEBI has role CHEBI:84735 algal metabolite

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 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
Peroxisome proliferator-activated receptor alpha Nuclear hormone receptor IC50 5.96 CHEMBL
Peroxisome proliferator-activated receptor gamma Nuclear hormone receptor IC50 4.52 CHEMBL
Tyrosine-protein phosphatase non-receptor type 1 Enzyme IC50 5.64 CHEMBL
Fatty acid-binding protein, adipocyte Cytosolic other Kd 4.10 CHEMBL
Peroxisome proliferator-activated receptor delta Nuclear hormone receptor IC50 5.22 CHEMBL
Histone deacetylase 11 Enzyme IC50 5.92 CHEMBL
Acetylcholinesterase Enzyme Ki 5.44 CHEMBL

External reference:

IDSource
D00119 KEGG_DRUG
4020443 VUID
N0000178989 NUI
4020443 VANDF
CHEBI:28842 CHEBI
STE PDB_CHEM_ID
CHEMBL46403 ChEMBL_ID
C031183 MESH_SUPPLEMENTAL_RECORD_UI
3377 IUPHAR_LIGAND_ID
DB03193 DRUGBANK_ID
4ELV7Z65AP UNII
1310551 RXNORM
NOCODE MMSL
003887 NDDF
259577009 SNOMEDCT_US
420674004 SNOMEDCT_US
C0038229 UMLSCUI
5281 PUBCHEM_CID
4ELV7Z65AP INXIGHT DRUGS

Pharmaceutical products:

ProductCategoryIngredientsNDCFormQuantityRouteMarketingLabel
ISA KNOX AGELESS SERUM MAKEUP BASE 10 HUMAN OTC DRUG LABEL 6 53208-471 CREAM 0.18 mL TOPICAL OTC monograph not final 5 sections
ISAKNOX AGELESS SERUM MOIST PEARL BASE HUMAN OTC DRUG LABEL 6 53208-478 LIQUID 0.18 mL TOPICAL OTC monograph not final 5 sections
Sha-lem HUMAN OTC DRUG LABEL 5 59862-100 OINTMENT 7.25 g TOPICAL unapproved drug other 10 sections
Jinhwagwangsu Bubble HUMAN OTC DRUG LABEL 1 69871-001 SOAP 120 mg TOPICAL unapproved drug other 7 sections
Obeo Baby Bubble HUMAN OTC DRUG LABEL 1 69871-002 SOAP 120 mg TOPICAL unapproved drug other 7 sections
Jinhwagwangsu Hair HUMAN OTC DRUG LABEL 1 69871-004 SOAP 12 g TOPICAL unapproved drug other 7 sections
ZENOL POWERFULX RECOVERYCREAM HUMAN OTC DRUG LABEL 1 70042-0001 CREAM 1.50 g TOPICAL unapproved drug other 7 sections
RECOVERY HUMAN OTC DRUG LABEL 1 70042-0002 CREAM 1.50 g TOPICAL unapproved drug other 7 sections
Doctor Plus HUMAN OTC DRUG LABEL 1 70042-6001 CREAM 1.50 g TOPICAL unapproved drug other 7 sections
CELLBN FIRST CARE CLEANSER HUMAN OTC DRUG LABEL 1 71450-0006 CREAM 16 g TOPICAL unapproved drug other 7 sections
Anubis Barcelona Spa Line HUMAN OTC DRUG LABEL 22 83021-305 CREAM 1 g TOPICAL OTC monograph final 9 sections
Neck Cream HUMAN OTC DRUG LABEL 1 84575-011 LIQUID 1 g TOPICAL OTC Monograph Drug 7 sections
Body sprays HUMAN OTC DRUG LABEL 1 84575-012 LIQUID 1 g TOPICAL OTC Monograph Drug 7 sections
Himalayan Scrub HUMAN OTC DRUG LABEL 1 84575-016 LIQUID 1 g TOPICAL OTC Monograph Drug 7 sections
Body Scrub HUMAN OTC DRUG LABEL 1 84575-018 LIQUID 1 g TOPICAL OTC Monograph Drug 7 sections
Avocado Candy Scrub HUMAN OTC DRUG LABEL 1 84575-044 LIQUID 1 g TOPICAL OTC Monograph Drug 7 sections
Turmeric Scrub Cream HUMAN OTC DRUG LABEL 1 84575-045 LIQUID 0.86 g TOPICAL OTC Monograph Drug 7 sections
tooth powder HUMAN OTC DRUG LABEL 1 84575-049 LIQUID 1 g TOPICAL OTC Monograph Drug 7 sections
Antiperspirant HUMAN OTC DRUG LABEL 1 84575-053 LIQUID 0.36 g TOPICAL OTC Monograph Drug 7 sections
Turmeric Mud Film Vitamin C HUMAN OTC DRUG LABEL 1 84575-056 LIQUID 0.86 g TOPICAL OTC Monograph Drug 7 sections
BATANA HUMAN OTC DRUG LABEL 1 84575-059 LIQUID 1 g TOPICAL OTC Monograph Drug 7 sections
Body Gel HUMAN OTC DRUG LABEL 1 84575-060 LIQUID 1.50 g TOPICAL OTC Monograph Drug 7 sections
Vaseline Moisturizing Cream HUMAN OTC DRUG LABEL 1 84575-062 LIQUID 1.70 g TOPICAL OTC Monograph Drug 7 sections
Hair Removal Cream For Men HUMAN OTC DRUG LABEL 1 84575-063 LIQUID 1.20 g TOPICAL OTC Monograph Drug 7 sections
Intimate After Shave For Women HUMAN OTC DRUG LABEL 1 84575-064 LIQUID 1.20 g TOPICAL OTC Monograph Drug 7 sections
Papaya Enzyme HUMAN OTC DRUG LABEL 1 84575-065 LIQUID 0.60 g TOPICAL OTC Monograph Drug 7 sections
Turmeric Mud Film Vitamin C HUMAN OTC DRUG LABEL 1 84575-070 LIQUID 1.20 g TOPICAL OTC Monograph Drug 7 sections
Turmeric Scrub Cream HUMAN OTC DRUG LABEL 1 84575-071 LIQUID 1.20 g TOPICAL OTC Monograph Drug 7 sections
iq shield pro 60g goat milk silk HUMAN OTC DRUG LABEL 3 84764-660 SOAP 40 mg TOPICAL OTC Monograph Drug 14 sections
turmeric kojic acid product HUMAN OTC DRUG LABEL 5 84764-705 SOAP 180 mg TOPICAL OTC Monograph Drug 12 sections