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ChEMBL Statistics
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Compound Report Card

Compound Name and Classification

Compound ID CHEMBL1201048
CHEMBL1201048
Compound Name DROMOSTANOLONE PROPIONATE
ChEMBL Synonyms MASTERIL | DROSTANOLONE PROPIONATE | DROLBAN | DROMOSTANOLONE PROPIONATE | 32379 | DROSTANOLONE
Max Phase 4 (Approved)
Trade Names MASTERIL | DROLBAN
Molecular Formula C23H36O3

Additional synonyms for CHEMBL1201048 found using NCI Chemical Identifier Resolver

Compound Representations

Molfile Download MolFile
Canonical SMILES CCC(=O)O[C@H]1CC[C@H]2[C@@H]3CC[C@H]4CC(=O)[C@H](C)C[C@]4(C) ...
Download SMILES
Standard InChI InChI=1S/C23H36O3/c1-5-21(25)26-20-9-8-17-16-7-6-15-12-19(24 ...
Download InChI
Standard InChI Key NOTIQUSPUUHHEH-UXOVVSIBSA-N

Sources

  • British National Formulary
  • Orange Book
  • Scientific Literature
  • USP Dictionary of USAN and International Drug Names

Alternate Forms of Compound in ChEMBL


CHEMBL1201048

Molecule Features

CHEMBL1201048 compound icon
Drug Type:Natural Product-derived Rule of Five:N First In Class:N Chirality:Single Stereoisomer Prodrug:Y Oral:N Parenteral:Y Topical:N Black Box:N Availability Type:Discontinued

Mechanism of Action

Mechanism of Action ChEMBL Target References
Androgen Receptor agonist Androgen Receptor PubMed PubMed

Clinical Data

ClinicalTrials.gov DROMOSTANOLONE PROPIONATE
The Cochrane Collaboration DROMOSTANOLONE PROPIONATE

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 CHEMBL1201048. 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
CHEMBL1787 Steroid 5-alpha-reductase 1 Homo sapiens 1.000
CHEMBL1856 Steroid 5-alpha-reductase 2 Homo sapiens 1.000
CHEMBL3056 Androgen Receptor Mus musculus 1.000
CHEMBL3522 Cytochrome P450 17A1 Homo sapiens 1.000
CHEMBL1871 Androgen Receptor Homo sapiens 0.999
CHEMBL4261 Hypoxia-inducible factor 1 alpha Homo sapiens 0.998
CHEMBL4027 Neurokinin 1 receptor Rattus norvegicus 0.975
CHEMBL3072 Androgen Receptor Rattus norvegicus 0.951
CHEMBL3041 Mu opioid receptor Bos taurus 0.908
CHEMBL1978 Cytochrome P450 19A1 Homo sapiens 0.860
CHEMBL4931 3-beta-hydroxysteroid-delta(8),delta(7)-isomerase Homo sapiens 0.759
CHEMBL1293237 Bloom syndrome protein Homo sapiens 0.742
CHEMBL3251 Nuclear factor NF-kappa-B p105 subunit Homo sapiens 0.725
CHEMBL3559 Steryl-sulfatase Homo sapiens 0.453
CHEMBL4430 Cytochrome P450 17A1 Rattus norvegicus 0.382
CHEMBL1963 Thyroid stimulating hormone receptor Homo sapiens 0.243



10uM


ChEMBL_ID Target Name Organism Score
CHEMBL1787 Steroid 5-alpha-reductase 1 Homo sapiens 1.000
CHEMBL1856 Steroid 5-alpha-reductase 2 Homo sapiens 1.000
CHEMBL3056 Androgen Receptor Mus musculus 1.000
CHEMBL3522 Cytochrome P450 17A1 Homo sapiens 1.000
CHEMBL2027 Niemann-Pick C1-like protein 1 Homo sapiens 1.000
CHEMBL3072 Androgen Receptor Rattus norvegicus 1.000
CHEMBL5409 G-protein coupled bile acid receptor 1 Homo sapiens 1.000
CHEMBL1871 Androgen Receptor Homo sapiens 1.000
CHEMBL1978 Cytochrome P450 19A1 Homo sapiens 0.999
CHEMBL4780 Acetylcholinesterase Torpedo californica 0.998
CHEMBL4027 Neurokinin 1 receptor Rattus norvegicus 0.996
CHEMBL1697668 Solute carrier organic anion transporter family member 1B1 Homo sapiens 0.994
CHEMBL4430 Cytochrome P450 17A1 Rattus norvegicus 0.985
CHEMBL1743121 Solute carrier organic anion transporter family member 1B3 Homo sapiens 0.978
CHEMBL3041 Mu opioid receptor Bos taurus 0.924
CHEMBL1828 DNA polymerase alpha subunit Homo sapiens 0.885
CHEMBL3746 11-beta-hydroxysteroid dehydrogenase 2 Homo sapiens 0.863
CHEMBL4931 3-beta-hydroxysteroid-delta(8),delta(7)-isomerase Homo sapiens 0.828
CHEMBL4370 UDP-glucuronosyltransferase 2B7 Homo sapiens 0.793
CHEMBL237 Kappa opioid receptor Homo sapiens 0.727

Calculated Compound Parent Properties

Mol. Weight Mol. Weight Monoisotopic ALogP #Rotatable Bonds Polar Surface Area Molecular Species
360.5 360.2664 5.17 2 43.37 -


HBA HBD #Ro5 Violations HBA (Lipinski) HBD (Lipinski) #Ro5 Violations (Lipinski)
3 0 1 3 0 1


ACD Acidic pKa ACD Basic pKa ACD LogP ACD LogD pH7.4 Aromatic Rings Heavy Atoms QED Weighted
- - 5.94 5.94 0 26 0.64

Structural Alerts

There are 2 structural alerts for CHEMBL1201048. To view alerts please click here.

Compound Cross References

ChemSpider ChemSpider:NOTIQUSPUUHHEH-UXOVVSIBSA-N

UniChem Cross References

View the UniChem Connectivity matches for CHEMBL1201048



ACToR 521-12-0
ChEBI 31523
ChemicalBook CB0239590
DrugCentral 965
eMolecules 3715884
EPA CompTox Dashboard DTXSID1022972
FDA SRS X20UZ57G4O
Guide to Pharmacology 6947
IBM Patent System 24DAD0C60B6D18ED808E0E864A4C3660
Nikkaji J6.610I
PharmGKB PA164760855
PubChem 224004
SureChEMBL SCHEMBL3173
ZINC ZINC000004213057

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