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

Stem definitionDrug idCAS RN
selective cyclo-oxygenase inhibitors 5672 169590-41-4

Description:

MoleculeDescription

Molfile Inchi Smiles

Synonyms:

  • deracoxib
  • NSC-758935
  • SC-59046
  • Molecular weight: 397.37
  • Formula: C17H14F3N3O3S
  • CLOGP: 3.23
  • LIPINSKI: 0
  • HAC: 6
  • HDO: 1
  • TPSA: 87.21
  • ALOGS: -4.58
  • ROTB: 5

Drug dosage:

None

ADMET properties:

None

Predicted pharmacokinetic/toxicological properties (PK-AZ):

PropertyDescriptionValueUnitConfidenceSimilarity
azlogd74 LogD at pH 7.4 2.685 High 1
caco2-efflux Caco-2 efflux ratio (BA/AB) 0.729 High 1
caco2-intrinsic-papp Caco-2 intrinsic apparent permeability 76.913 10^-6 cm/s High 1
dh-clint Dog hepatocyte intrinsic clearance 4.487 uL/min/10^6 cells High 1
dppb Dog plasma protein binding (% unbound) 5.070 % High 1
fcs-ppb Fetal calf serum protein binding (% unbound) 15.940 % High 1
herg hERG pIC50 4.692 pIC50 High 1
hh-clint Human hepatocyte intrinsic clearance 3.327 uL/min/10^6 cells High 1
hlm-clint Human liver microsomal intrinsic clearance 5.395 uL/min/mg protein High 1
hppb Human plasma protein binding (% unbound) 3.980 % High 1
mdck-mdr1-efflux MDCK-MDR1 efflux ratio 2.339 High 1
mh-clint Mouse hepatocyte intrinsic clearance 16.106 High 1
mppb Mouse plasma protein binding (% unbound) 4.550 High 1
nih-mdck-mdr1-efflux NIH MDCK-MDR1 efflux ratio 6.310 High 1
pfas-class PFAS structural alert (1 = True, 0 = False) 1
pppb Pig plasma protein binding (% unbound) 11.720 % High 1
rh-clint Rat hepatocyte intrinsic clearance 7.962 uL/min/10^6 cells High 1
rh-fuinc Rat hepatocyte fraction unbound in incubation 39.890 % High 1
rppb Rat plasma protein binding (% unbound) 5.810 % High 1
solubility-dd Solubility at pH 7.4 in DMSO 4.375 uM High 1

Approvals:

DateAgencyCompanyOrphan
None FDA

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
MeSH PA D000700 Analgesics
MeSH PA D000893 Anti-Inflammatory Agents
MeSH PA D000894 Anti-Inflammatory Agents, Non-Steroidal
MeSH PA D004791 Enzyme Inhibitors
MeSH PA D016861 Cyclooxygenase Inhibitors
MeSH PA D018373 Peripheral Nervous System Agents
MeSH PA D018501 Antirheumatic Agents
MeSH PA D018689 Sensory System Agents
MeSH PA D018712 Analgesics, Non-Narcotic
CHEBI has role CHEBI:35475 non-steroidal anti-inflammatory drug
CHEBI has role CHEBI:35481 non-narcotic analgesic
CHEBI has role CHEBI:50629 cyclooxygenase 2 inhibitor

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

None




🐶 Veterinary Drug Use

SpeciesUseRelation
Dogs Postoperative pain and inflammation associated with dental surgery Indication
Dogs Pain and inflammation associated with osteoarthritis Indication
Dogs Postoperative pain and inflammation associated with orthopedic surgery Indication

🐶 Veterinary products

ProductApplicantIngredients
Deramaxx Chewable Tablets Elanco US Inc. 1
Doxidyl Ceva Sante Animale 1
Deracoxib Chewable Tablets Felix Pharmaceuticals Pvt. Ltd. 1

Acid dissociation constants calculated using MoKa v3.0.0

None

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
Prostaglandin G/H synthase 2 Enzyme IC50 7.30 CHEMBL
Prostaglandin G/H synthase 1 Enzyme IC50 4.44 CHEMBL
Cyclooxygenase 2; Prostaglandin G/H synthase-2; Uncharacterized protein Enzyme IC50 6.20 CHEMBL
Prostaglandin G/H synthase 1 Enzyme IC50 4.64 CHEMBL

External reference:

IDSource
CHEBI:73032 CHEBI
CHEMBL28636 ChEMBL_ID
C471996 MESH_SUPPLEMENTAL_RECORD_UI
DB11395 DRUGBANK_ID
423684002 SNOMEDCT_US
424281006 SNOMEDCT_US
C1174840 UMLSCUI
7789 INN_ID
D03689 KEGG_DRUG
3058754 PUBCHEM_CID
017762 NDDF
VX29JB5XWV UNII
356834 RXNORM
VX29JB5XWV INXIGHT DRUGS

Pharmaceutical products:

None