HYDROCORTISONE
ID: CHEMBL389621
Name: HYDROCORTISONE
Max Phase:
Approved
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First Approval: 1952
Molecular Formula: C21H30O5
Molecular Weight: 362.47
Molecule Type: Small molecule
Synonyms and Trade Names:
Cor-Oticin
Cortifoam
CORTISOL
FLEXICORT
HIDROCORTISONA
Molfile:
Canonical SMILES:
Standard InChI:
Standard InChI Key:
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Scientific Literature
TP-search Transporter Database
PubChem BioAssays
FDA Orange Book Drugs
DrugMatrix
SARS-CoV-2 Screening Data
United States Adopted Names (USAN)
Clinical Candidate Compounds
British National Formulary (BNF)
IMI-CARE SARS-CoV-2 Data
CO-ADD Antimicrobial Screening
WHO Anatomical Therapeutic Chemical (ATC) Classification of Drugs
Fraunhofer Institute HDAC6 screening
Active Ingredient of a Prodrug
European Medicines Agency (EMA)
Karolinska Institute dNTPase SAMHD1 screening
Alternative forms of compound CHEMBL389621
5
Showing 1-5
out of 88 records
# | MESH ID | MESH Heading | EFO IDs | EFO Terms | Max Phase for Indication | References |
---|---|---|---|---|---|---|
1. |
Herpes Labialis
|
Herpes Labialis
| 4 | |||
2. |
Lymphoma
|
lymphoma
| 4 | |||
3. |
Nasal Obstruction
|
Nasal congestion
| 4 | |||
4. |
Pneumonia
|
pneumonia
| 4 | |||
5. |
Colitis, Ulcerative
|
ulcerative colitis
| 4 |
Showing 1-5
out of 88 records
5
Showing 1-1
out of 1 records
# | Mechanism of Action | Action Type | Target ChEMBL ID | Target Name | Target Type | Target Organism | Binding Site Name | References |
---|---|---|---|---|---|---|---|---|
1. |
Glucocorticoid receptor agonist
|
AGONIST
|
Glucocorticoid receptor
|
SINGLE PROTEIN
|
Homo sapiens
|
---
|
Showing 1-1
out of 1 records
Compounds similar to CHEMBL389621
Compounds with at least 85% similarity.
1
2
3
4
1 - 4 out of 6
Bioactivity Summary
Total
1499
Tissue Severity Score
IC50
Ki
Activity
AC50
Inhibition
permeability
GI50
Potency
Peff
ED50
ID50
LogD
RBA
Relative amount
ALB
ALP
ALT
AST
BASO
Other
Assay Summary
Total
918
F - Functional
B - Binding
A - ADME
P - Physicochemical
T - Toxicity
Target Summary
Total
276
N/A
Membrane receptor
Enzyme
Transcription factor
Transporter
Ion channel
Unclassified protein
Epigenetic regulator
Secreted protein
Other cytosolic protein
Histogram Settings
|
Total
240
Journal:
J Med Chem
Eur J Med Chem
Bioorg Med Chem Lett
J Nat Prod
Bioorg Med Chem
N/A
Drug Metab Dispos
Medchemcomm
ACS Med Chem Lett
Pharm Res
Mol Pharmacol
Nat Chem Biol
J Biol Chem
Am J Physiol
Biochem J
J Pharmacol Exp Ther
Annu Rev Pharmacol Toxicol
Endocrinology
J Neuroendocrinol
Gastroenterol Clin Biol
Antimicrob Agents Chemother
Chem Res Toxicol
J Agric Food Chem
PLoS Comput Biol
Drug Discov Today
RSC Med Chem
Nat Commun
iScience
The table below displays ChEMBL targets which are predicted to interact with HYDROCORTISONE (CHEMBL389621). The target prediction returns four classes: ‘active’ or ‘inactive’ depending on whether or not HYDROCORTISONE (CHEMBL389621) is predicted to interact or not with the target. The value returned can also be 'empty' if the model was not able to predict the compound or 'both' if it could not conclude. The predictions are given at three different confidence levels. More information on the methodology is available at: https://jcheminf.biomedcentral.com/articles/10.1186/s13321-018-0325-4
Target | Target Pref. Name | Confidence 70% | Confidence 80% | Confidence 90% | Activity Threshold |
---|---|---|---|---|---|
CHEMBL2902 | Dihydrofolate reductase | inactive | inactive | inactive | 6 |
CHEMBL2725 | Beta-lactamase | inactive | inactive | both | 6 |
CHEMBL5062 | Coagulation factor X | empty | empty | active | 6.5 |
CHEMBL1947 | Thyroid hormone receptor beta-1 | empty | empty | inactive | 7 |
CHEMBL2157850 | Ubiquitin carboxyl-terminal hydrolase 7 | empty | empty | inactive | 6 |
Molecular Weight:
362.47
Molecular Weight (Monoisotopic):
362.2093
AlogP:
1.78
#Rotatable Bonds:
2
Polar Surface Area:
94.83
Molecular Species:
NEUTRAL
HBA:
5
HBD:
3
#RO5 Violations:
0
HBA (Lipinski):
5
HBD (Lipinski):
3
#RO5 Violations (Lipinski):
0
CX Acidic pKa:
12.59
CX Basic pKa:
--
CX LogP:
1.28
CX LogD:
1.28
Aromatic Rings:
0
Heavy Atoms:
26
QED Weighted:
0.70
Np Likeness Score:
2.41
D -
DERMATOLOGICALS
D07XA01 -
hydrocortisone
S -
SENSORY ORGANS
S01 -
OPHTHALMOLOGICALS
S01B -
ANTIINFLAMMATORY AGENTS
S01BA -
Corticosteroids, plain
S01BA02 -
hydrocortisone
D -
DERMATOLOGICALS
D07A -
CORTICOSTEROIDS, PLAIN
D07AA -
Corticosteroids, weak (group I)
D07AA02 -
hydrocortisone
A01A -
STOMATOLOGICAL PREPARATIONS
A01AC03 -
hydrocortisone
S -
SENSORY ORGANS
S02 -
OTOLOGICALS
S02B -
CORTICOSTEROIDS
S02BA -
Corticosteroids
S02BA01 -
hydrocortisone
UniChem Connectivity Layer Cross References for
CHEMBL389621
Columns Legend:
- S: stereochemical difference.
- I: isotopic difference.
- P: protonation differences identified.
Match | Identical Component | S | I | P |
---|---|---|---|---|
CHEMBL3237442 | ||||
24V | ||||
ZINC000087493449 | ||||
SCHEMBL1976824 | ||||
84985131 |

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