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ChEMBL Statistics
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Compound Report Card

Compound Name and Classification

Compound ID CHEMBL103
CHEMBL103
Compound Name PROGESTERONE
ChEMBL Synonyms UTROGESTAN | PROGESTERONE | PROMETRIUM | PROGESTA-CARE | PROGESTASERT | SERENITY FOR WOMEN | Progestin | Regumate | CYCLOGEST | ENDOMETRIN | Gesterol | PROCHIEVE | LUTIGEST | CRINONE | Syngestrone
Max Phase 4 (Approved)
Trade Names CRINONE | Syngestrone | UTROGESTAN | LUTIGEST | CYCLOGEST | ENDOMETRIN | Gesterol | PROCHIEVE | Progestin | Regumate | PROGESTA-CARE | PROGESTASERT | SERENITY FOR WOMEN | PROGESTERONE | PROMETRIUM
Molecular Formula C21H30O2

Additional synonyms for CHEMBL103 found using NCI Chemical Identifier Resolver

Compound Representations

Molfile Download MolFile
Canonical SMILES CC(=O)[C@H]1CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@] ...
Download SMILES
Standard InChI InChI=1S/C21H30O2/c1-13(22)17-6-7-18-16-5-4-14-12-15(23)8-10 ...
Download InChI
Standard InChI Key RJKFOVLPORLFTN-LEKSSAKUSA-N

Sources

  • AstraZeneca Deposited Data
  • British National Formulary
  • DrugMatrix
  • Orange Book
  • PubChem BioAssays
  • Scientific Literature
  • TP-search Transporter Database
  • USP Dictionary of USAN and International Drug Names
  • WHO Anatomical Therapeutic Chemical Classification

Alternate Forms of Compound in ChEMBL


CHEMBL103

Molecule Features

CHEMBL103 compound icon
Drug Type:Natural Product-derived Rule of Five:Y First In Class:N Chirality:Single Stereoisomer Prodrug:N Oral:Y Parenteral:Y Topical:Y Black Box:Y Availability Type:Prescription-only

Mechanism of Action

Mechanism of Action ChEMBL Target References
Progesterone receptor agonist Progesterone receptor PubMed

Indications

MESH Heading MESH ID EFO ID EFO Term Max phase for indication References
Alzheimer DiseaseD000544EFO:0000249Alzheimers disease2ClinicalTrials
MenopauseD008593EFO:0003922menopause3ClinicalTrials
Orthostatic IntoleranceD054971EFO:1000645orthostatic intolerance2ClinicalTrials
Breast NeoplasmsD001943EFO:0000305breast carcinoma3ClinicalTrials
LeiomyomaD007889EFO:0000731uterine fibroid3ClinicalTrials
PregnancyD011247EFO:0002950pregnancy3ClinicalTrials
AmenorrheaD0005683ClinicalTrials
ClinicalTrials
Anorexia NervosaD000856EFO:0004215anorexia nervosa2ClinicalTrials
AtherosclerosisD050197EFO:0003914atherosclerosis2ClinicalTrials
Coronary Artery DiseaseD003324EFO:0000378coronary artery disease2ClinicalTrials
HIV InfectionsD015658EFO:0000180HIV-1 infection2ClinicalTrials
Ovarian Hyperstimulation SyndromeD016471Orphanet:64739Ovarian hyperstimulation syndrome3ClinicalTrials
Premature BirthD047928EFO:0003917premature birth3ClinicalTrials
Wounds and InjuriesD014947EFO:0000546injury3ClinicalTrials
Cocaine-Related DisordersD019970EFO:0002610cocaine dependence2ClinicalTrials
EpilepsyD004827EFO:0000474epilepsy3ClinicalTrials
Polycystic Ovary SyndromeD011085EFO:0000660polycystic ovary syndrome2ClinicalTrials
Vulvar Lichen SclerosusD007724EFO:1000623Vulvar Lichen Sclerosus2ClinicalTrials
Breast NeoplasmsD001943EFO:0003869breast neoplasm3ClinicalTrials
Diabetes Mellitus, Type 1D003922EFO:0001359type I diabetes mellitus1ClinicalTrials
Endometrial NeoplasmsD016889EFO:0004230endometrial neoplasm2ClinicalTrials
Migraine DisordersD008881EFO:0003821migraine disorder1ClinicalTrials
Pre-EclampsiaD011225EFO:0000668preeclampsia2ClinicalTrials
Tobacco Use DisorderD014029EFO:0003768nicotine dependence2ClinicalTrials
Marijuana AbuseD002189EFO:0004218marijuana dependence0ClinicalTrials
Uterine Cervical DysplasiaD002578EFO:1000910dysplasia of cervix2ClinicalTrials
InfertilityD007246EFO:0000545infertility3ClinicalTrials

Clinical Data

ClinicalTrials.gov PROGESTERONE
The Cochrane Collaboration PROGESTERONE

Compound Bioactivity Summary

Compound Assay Summary

Compound Target Summary

Target Predictions

The two tables below display ChEMBL single-protein targets which are predicted to interact with CHEMBL103. A 1uM and 10 uM cut-off have been applied to ChEMBL bioactivity data used to generate the respective models and the yellow coloured rows correspond to genuine predictions, i.e. targets not included in the original training set for this compound.


1uM


ChEMBL_ID Target Name Organism Score
CHEMBL3072 Androgen Receptor Rattus norvegicus 1.000
CHEMBL1978 Cytochrome P450 19A1 Homo sapiens 1.000
CHEMBL1787 Steroid 5-alpha-reductase 1 Homo sapiens 1.000
CHEMBL1856 Steroid 5-alpha-reductase 2 Homo sapiens 1.000
CHEMBL3522 Cytochrome P450 17A1 Homo sapiens 1.000
CHEMBL4430 Cytochrome P450 17A1 Rattus norvegicus 1.000
CHEMBL3056 Androgen Receptor Mus musculus 1.000
CHEMBL4261 Hypoxia-inducible factor 1 alpha Homo sapiens 1.000
CHEMBL3746 11-beta-hydroxysteroid dehydrogenase 2 Homo sapiens 1.000
CHEMBL1871 Androgen Receptor Homo sapiens 1.000
CHEMBL4234 Estradiol 17-beta-dehydrogenase 3 Homo sapiens 1.000
CHEMBL3368 Glucocorticoid receptor Rattus norvegicus 1.000
CHEMBL3251 Nuclear factor NF-kappa-B p105 subunit Homo sapiens 1.000
CHEMBL3456 Progesterone receptor Oryctolagus cuniculus 1.000
CHEMBL3559 Steryl-sulfatase Homo sapiens 1.000
CHEMBL2034 Glucocorticoid receptor Homo sapiens 1.000
CHEMBL1994 Mineralocorticoid receptor Homo sapiens 0.998
CHEMBL1293237 Bloom syndrome protein Homo sapiens 0.995
CHEMBL4931 3-beta-hydroxysteroid-delta(8),delta(7)-isomerase Homo sapiens 0.941



10uM


ChEMBL_ID Target Name Organism Score
CHEMBL3072 Androgen Receptor Rattus norvegicus 1.000
CHEMBL1978 Cytochrome P450 19A1 Homo sapiens 1.000
CHEMBL3056 Androgen Receptor Mus musculus 1.000
CHEMBL3746 11-beta-hydroxysteroid dehydrogenase 2 Homo sapiens 1.000
CHEMBL4430 Cytochrome P450 17A1 Rattus norvegicus 1.000
CHEMBL3522 Cytochrome P450 17A1 Homo sapiens 1.000
CHEMBL1856 Steroid 5-alpha-reductase 2 Homo sapiens 1.000
CHEMBL1787 Steroid 5-alpha-reductase 1 Homo sapiens 1.000
CHEMBL2027 Niemann-Pick C1-like protein 1 Homo sapiens 1.000
CHEMBL1871 Androgen Receptor Homo sapiens 1.000
CHEMBL4234 Estradiol 17-beta-dehydrogenase 3 Homo sapiens 1.000
CHEMBL3368 Glucocorticoid receptor Rattus norvegicus 1.000
CHEMBL3456 Progesterone receptor Oryctolagus cuniculus 1.000
CHEMBL2034 Glucocorticoid receptor Homo sapiens 1.000
CHEMBL5409 G-protein coupled bile acid receptor 1 Homo sapiens 1.000
CHEMBL4261 Hypoxia-inducible factor 1 alpha Homo sapiens 1.000
CHEMBL1697668 Solute carrier organic anion transporter family member 1B1 Homo sapiens 1.000
CHEMBL3251 Nuclear factor NF-kappa-B p105 subunit Homo sapiens 1.000
CHEMBL1743121 Solute carrier organic anion transporter family member 1B3 Homo sapiens 1.000
CHEMBL1828 DNA polymerase alpha subunit Homo sapiens 1.000

Calculated Compound Parent Properties

Mol. Weight Mol. Weight Monoisotopic ALogP #Rotatable Bonds Polar Surface Area Molecular Species
314.5 314.2246 4.72 1 34.14 -


HBA HBD #Ro5 Violations HBA (Lipinski) HBD (Lipinski) #Ro5 Violations (Lipinski)
2 0 0 2 0 0


ACD Acidic pKa ACD Basic pKa ACD LogP ACD LogD pH7.4 Aromatic Rings Heavy Atoms QED Weighted
- - 3.83 3.83 0 23 0.7

Structural Alerts

There are 2 structural alerts for CHEMBL103. To view alerts please click here.

Compound Cross References

ATC G - GENITO URINARY SYSTEM AND SEX HORMONES
G03 - SEX HORMONES AND MODULATORS OF THE GENITAL SYSTEM
G03D - PROGESTOGENS
G03DA - Pregnen (4) derivatives
G03DA04 - progesterone

ChemSpider ChemSpider:RJKFOVLPORLFTN-LEKSSAKUSA-N
DailyMed progesterone
PubChem SID: 144206708 SID: 144208990 SID: 144210627 SID: 17388760 SID: 17389514 SID: 26719639 SID: 26751485 SID: 26751486 SID: 50104004 SID: 50104005 SID: 50104007 SID: 56424141 SID: 75083 SID: 855688 SID: 90340816
Wikipedia Progesterone

UniChem Cross References

View the UniChem Connectivity matches for CHEMBL103



ACToR 257630-50-5
Atlas progesterone
BindingDB 8903
Brenda 94796 5917 286 20023 127076 94795 11588 34377 13473
ChEBI 17026
ChemicalBook CB4224484
DrugBank DB00396
DrugCentral 2279
eMolecules 511682 29549914
EPA CompTox Dashboard DTXSID3022370
FDA SRS 4G7DS2Q64Y
Guide to Pharmacology 2377
Human Metabolome Database HMDB0001830
IBM Patent System 8DD614152427A9BDC945D630BCFFEEB3
KEGG Ligand C00410
LINCS LSM-3452
LipidMaps LMST02030159
Metabolights MTBLC17026
MolPort MolPort-001-794-643
NIH Clinical Collection SAM001247039
Nikkaji J2.329I
PDBe STR
PharmGKB PA451123
PubChem 5994
PubChem: Drugs of the Future 12015027
PubChem: Thomson Pharma 14850243 14874443
Recon prgstrn
Rhea 17026
Selleck Progesterone(Prometrium)
SureChEMBL SCHEMBL7671
ZINC ZINC000004428529

UniChem REST Service Call:
https://www.ebi.ac.uk/unichem/rest/verbose_inchikey/RJKFOVLPORLFTN-LEKSSAKUSA-N spacer
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