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estrone sulphate 🐶 Veterinary Use | Indications/Contra | FAERs-F | FAERs-M | Orange Bk | PK/Tox | Related Drugs | BioActivity |
| Stem definition | Drug id | CAS RN |
|---|---|---|
| estrogens | 4857 | 7280-37-7 |
Description:
| Molecule | Description |
|---|---|
|
Synonyms:
|
used therapeutically in menopausal patients
Legend: OFP - off patent OFM - off market ONP - on patent |
Drug dosage:
None
ADMET properties:
None
Predicted pharmacokinetic/toxicological properties (PK-AZ):
| Property | Description | Value | Unit | Confidence | Similarity |
|---|---|---|---|---|---|
| azlogd74 | LogD at pH 7.4 | 0.210 | High | 1 | |
| caco2-efflux | Caco-2 efflux ratio (BA/AB) | 3.192 | High | 1 | |
| caco2-intrinsic-papp | Caco-2 intrinsic apparent permeability | 27.164 | 10^-6 cm/s | High | 1 |
| dh-clint | Dog hepatocyte intrinsic clearance | 4.169 | uL/min/10^6 cells | High | 1 |
| dppb | Dog plasma protein binding (% unbound) | 2.180 | % | High | 1 |
| fcs-ppb | Fetal calf serum protein binding (% unbound) | 2.110 | % | High | 1 |
| herg | hERG pIC50 | 4.827 | pIC50 | High | 1 |
| hh-clint | Human hepatocyte intrinsic clearance | 13.900 | uL/min/10^6 cells | High | 1 |
| hlm-clint | Human liver microsomal intrinsic clearance | 14.223 | uL/min/mg protein | High | 1 |
| hppb | Human plasma protein binding (% unbound) | 1.660 | % | High | 1 |
| kinase-safety-class | ACVR2A,ACVR2B,AURKA,AXL,BRAF,BTK,CAMK2D,CDK5,CDK9,DYRK1B,EGFR,EIF2AK3,ERBB2,GRK2,IKBKB,ITK,MAP2K6,MAP3K21,MAPK10,MAPK7,MAPKAPK2,NTRK2,PDK1,PDK2,PDK4,PIK3CA,PIK3CB,PIK3CG,PIM2,PRKDC,STK33,SYK,TEK,TGFBR1,ZAP70 | 35 | |||
| kinase-selectivity-class | AXL,ERBB2,GRK2,MAP2K6,STK33,SYK,TEK,ZAP70 | 8 | |||
| mdck-mdr1-efflux | MDCK-MDR1 efflux ratio | 2.825 | High | 1 | |
| mh-clint | Mouse hepatocyte intrinsic clearance | 23.988 | High | 1 | |
| mppb | Mouse plasma protein binding (% unbound) | 2.240 | High | 1 | |
| nih-mdck-mdr1-efflux | NIH MDCK-MDR1 efflux ratio | 2.844 | High | 1 | |
| pfas-class | PFAS structural alert (1 = True, 0 = False) | 0 | |||
| pppb | Pig plasma protein binding (% unbound) | 1.160 | % | High | 1 |
| rh-clint | Rat hepatocyte intrinsic clearance | 30.903 | uL/min/10^6 cells | High | 1 |
| rh-fuinc | Rat hepatocyte fraction unbound in incubation | 67.980 | % | High | 1 |
| rppb | Rat plasma protein binding (% unbound) | 2.080 | % | High | 1 |
| solubility-dd | Solubility at pH 7.4 in DMSO | 920.450 | uM | High | 1 |
Approvals:
| Date | Agency | Company | Orphan |
|---|---|---|---|
| May 19, 1977 | FDA | PHARMACIA AND UPJOHN |
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:
| Source | Code | Description |
|---|---|---|
| MeSH PA | D000080066 | Contraceptive Agents, Hormonal |
| MeSH PA | D003270 | Contraceptive Agents |
| MeSH PA | D012102 | Reproductive Control Agents |
| MeSH PA | D004967 | Estrogens |
| MeSH PA | D006728 | Hormones |
| CHEBI has role | CHEBI:50646 | bone density conservation agent |
| CHEBI has role | CHEBI:35610 | antineoplastic agent |
| CHEBI has role | CHEBI:50114 | estrogen |
| CHEBI has role | CHEBI:74518 | anti-obesity agent |
| CHEBI has role | CHEBI:75771 | mouse metabolite |
| CHEBI has role | CHEBI:77746 | human metabolite |
Drug Use | Suggest Off label Use Form| |View source of the data|
| Disease | Relation | SNOMED_ID | DOID |
|---|---|---|---|
| Female hypogonadism syndrome | indication | 16041008 | |
| Atrophic vaginitis | indication | 52441000 |
🐶 Veterinary Drug Use
None
🐶 Veterinary products
None
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:
| Target | Class | Pharos | UniProt | Action | Type | Activity value (-log[M]) | Mechanism action | Bioact source | MoA source |
|---|---|---|---|---|---|---|---|---|---|
| Estrogen receptor | Nuclear hormone receptor | AGONIST | DRUG LABEL | DRUG LABEL | |||||
| Estrogen receptor beta | Nuclear hormone receptor | AGONIST | DRUG LABEL | DRUG LABEL | |||||
| Steryl-sulfatase | Enzyme | Ki | 4.22 | CHEMBL | |||||
| Solute carrier family 22 member 20 | Transporter | Ki | 4.24 | CHEMBL |
External reference:
| ID | Source |
|---|---|
| D00948 | KEGG_DRUG |
| 4018490 | VUID |
| N0000146812 | NUI |
| 438-67-5 | SECONDARY_CAS_RN |
| 4018489 | VANDF |
| 4018490 | VANDF |
| 4018711 | VANDF |
| 4022631 | VANDF |
| C0059668 | UMLSCUI |
| CHEBI:17474 | CHEBI |
| J3Z | PDB_CHEM_ID |
| CHEMBL494753 | ChEMBL_ID |
| 3001028 | PUBCHEM_CID |
| DB04574 | DRUGBANK_ID |
| CHEMBL2106240 | ChEMBL_ID |
| CHEMBL1200980 | ChEMBL_ID |
| DB00655 | DRUGBANK_ID |
| 33747 | RXNORM |
| 17244 | MMSL |
| 2450 | MMSL |
| 2464 | MMSL |
| 4688 | MMSL |
| 4689 | MMSL |
| d00534 | MMSL |
| d00543 | MMSL |
| 001270 | NDDF |
| 001287 | NDDF |
| 115502007 | SNOMEDCT_US |
| 127381003 | SNOMEDCT_US |
| 395829001 | SNOMEDCT_US |
| 51775003 | SNOMEDCT_US |
| 784234005 | SNOMEDCT_US |
| 90017009 | SNOMEDCT_US |
| C0236379 | UMLSCUI |
| 5870 | PUBCHEM_CID |
| 6K6FDA543A | UNII |
| 407 | INN_ID |
| C009927 | MESH_SUPPLEMENTAL_RECORD_UI |
| D004970 | MESH_DESCRIPTOR_UI |
| CHEBI:17263 | CHEBI |
| 6K6FDA543A | INXIGHT DRUGS |
Pharmaceutical products:
| Product | Category | Ingredients | NDC | Form | Quantity | Route | Marketing | Label |
|---|---|---|---|---|---|---|---|---|
| Esterified Estrogens and Methyltestosterone | HUMAN PRESCRIPTION DRUG LABEL | 2 | 50220-001 | TABLET, FILM COATED | 0.63 mg | ORAL | Unapproved drug other | 13 sections |
| Esterified Estrogens and Methyltestosterone | HUMAN PRESCRIPTION DRUG LABEL | 2 | 50220-002 | TABLET, FILM COATED | 1.25 mg | ORAL | Unapproved drug other | 13 sections |
| Estropipate | HUMAN PRESCRIPTION DRUG LABEL | 1 | 54868-3114 | TABLET | 0.75 mg | ORAL | ANDA | 23 sections |
| Estropipate | HUMAN PRESCRIPTION DRUG LABEL | 1 | 54868-4149 | TABLET | 1.50 mg | ORAL | ANDA | 23 sections |
| Estropipate | HUMAN PRESCRIPTION DRUG LABEL | 1 | 54868-4761 | TABLET | 3 mg | ORAL | ANDA | 23 sections |