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Compound Detail

CHEMBL1091

HYDROCORTISONE ACETATE
💊 Approved Drug
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💊 Approved Drug
CC(=O)OCC(=O)[C@@]1(O)CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3[C@@H](O)C[C@@]21C
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1091
Name HYDROCORTISONE ACETATE
Phase Approved
Structure Type MOL
InChI Key ALEXXDVDDISNDU-JZYPGELDSA-N
Therapeutic ✓ Yes

Known Names

Barquinol hc Chloromycetin hydrocort Colifoam Cortef acetate Cortifoam Cortisol 21-acetate Cortril Cortucid Dricort Epifoam Framycort Fucidin h +18 more
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
20
Publications
30
Known Names
7
Indications
1
Mechanisms

Molecular Properties

404.5
MW (Da)
2.35
ALogP
6
HBA
2
HBD
100.9
PSA (Ų)
0.70
QED
0
Ro5 Violations
3
Rot. Bonds

Drug Information

Molecule Type Small molecule
First Approval 1951
Availability Prescription
Chirality Single Enantiomer

Routes of Administration

Parenteral Topical

Flags

Natural Product
USAN Stem -cort-

Extended Properties

Molecular Formula C23H32O6
MW 404.50
Aromatic Rings 0
Heavy Atoms 29
NP-Likeness 2.17

Mechanism of Action

Mechanism Action Type Target Direct Efficacy
Glucocorticoid receptor agonist AGONIST Glucocorticoid receptor ✓ ✓

Indications

Inflammation Pruritus Skin Diseases Dermatitis, Atopic Hemorrhoids Vitiligo Depressive Disorder

Activity Summary

Ki 1 meas. best 7.55

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Corticosteroid-binding globulin
CHEMBL2421
 Ki 7.55 7.55 28.2 1

Activity Data Samples

Top measurements by pChEMBL value

Target Type Rel. Value Units pChEMBL Assay PubMed
Corticosteroid-binding globulin Ki = 28.18 nM 7.55 Binding affinity to human CBG receptor (corticosteroid-binding globulins) 15139751

Literature References

PubMed DOI Target Context # Activities
2897467 10.1021/jm00401a015 Glucocorticoid receptor 7
20014752 10.1021/tx900326k Hepatotoxicity 3
- 10.6019/CHEMBL4495565 SARS-CoV-2 2
- 10.6019/CHEMBL4651402 SARS-CoV-2 2
18666772 10.1021/jm8005228 No relevant target 2
37468498 10.1038/s41467-023-40064-9 Thromboxane A2 receptor 2
37468498 10.1038/s41467-023-40064-9 Alpha-1A adrenergic receptor 2
10956200 10.1021/jm0000822 No relevant target 2
37468498 10.1038/s41467-023-40064-9 Prostaglandin G/H synthase 1 2
37468498 10.1038/s41467-023-40064-9 Muscarinic acetylcholine receptor M1 2
6827553 10.1021/jm00357a003 Homo sapiens 1
6827553 10.1021/jm00357a003 Rattus norvegicus 1
11448232 10.1021/jm0100990 No relevant target 1
3783574 10.1021/jm00161a001 Homo sapiens 1
15139751 10.1021/jm030364c Corticosteroid-binding globulin 1
10966742 10.1021/jm000941m Corticosteroid-binding globulin 1
18396854 10.1021/jm701587d No relevant target 1
2897467 10.1021/jm00401a015 Mineralocorticoid receptor 1
38318365 10.1016/j.isci.2024.108907 Deoxynucleoside triphosphate triphosphohydrolase SAMHD1 1
2897467 10.1021/jm00401a015 Progesterone receptor 1

Data from ChEMBL 36 via Core Engine