General
Preferred name
DOXYCYCLINE
Synonyms
Monodox ()
Doxytetracycline ()
Oracea ()
Vibramycin ()
WC2031 ()
Doxycycline hydrochloride hemiethanolate hemihydrate ()
Doxycycline Hyclate ()
P&D ID
PD051057
CAS
24390-14-5
564-25-0
Tags
available
natural product
drug
Drug indication
Chronic periodontitis
Diabetic foot ulcer
Advanced gum disease
Drug Status
approved
Probe control
Probe control not defined
Orthogonal probes
0
No orthogonal probes found
Similar probes
0
No structurally similar probes found
Structure
P&D probe-likeness score
Structure formats
[[ format ]]
[[ compound[format === 'MOL' ? 'molblock' : format.toLowerCase()] ]]
Description
(extracted from source data)
DESCRIPTION
Doxycycline is a tetracycline based antibacterial. It has been repurposed as a low-potency human metalloprotease inhibitor for periodontitis and is also used as an antimalarial therapy.
There are a number of salt forms in PubChem. The chemical structure we show here matches that of the consensus structure in PubChem, listed in the links table below. The DrugBank, ChEBI, ChEMBL and PDB entries for doxycycline show a different structure.
Doxycycline is one of the key access group antibacterials on the World Health Organization's Model List of Essential Medicines (link provided in the Classification table, under the Summary tab below).
The Malaria tab on this ligand page provides additional curator comments of relevance to the Guide to MALARIA PHARMACOLOGY. (GtoPdb)
There are a number of salt forms in PubChem. The chemical structure we show here matches that of the consensus structure in PubChem, listed in the links table below. The DrugBank, ChEBI, ChEMBL and PDB entries for doxycycline show a different structure.
Doxycycline is one of the key access group antibacterials on the World Health Organization's Model List of Essential Medicines (link provided in the Classification table, under the Summary tab below).
The Malaria tab on this ligand page provides additional curator comments of relevance to the Guide to MALARIA PHARMACOLOGY. (GtoPdb)
DESCRIPTION
Doxycycline is a tetracycline based antibiotic. It has been repurposed as a low-potency human metalloprotease inhibitor for periodontitis and is also used as an antimalarial prophylactic therapy.
There are a number of salt forms in PubChem. The chemical structure we show here matches that of the consensus structure in PubChem, listed in the links table below. The DrugBank, ChEBI and ChEMBL entries for doxycycline show a different structure.
Doxycycline is one of the key antibacterials in the WHO 20th Essential Medicines List (2017).
There are a number of salt forms in PubChem. The chemical structure we show here matches that of the consensus structure in PubChem, listed in the links table below. The DrugBank, ChEBI and ChEMBL entries for doxycycline show a different structure.
Doxycycline is one of the key antibacterials in the WHO 20th Essential Medicines List (2017).
DESCRIPTION
Doxycycline is a tetracycline based antibiotic. It has been repurposed as a low-potency human metalloprotease inhibitor for periodontitis. There are a number of salt forms in PubChem. The chemical structure we show here matches that of the consensus structure in PubChem, linked to above. The DrugBank, ChEBI and ChEMBL entries for doxycycline show a different structure.
Doxycycline is one of the key antibacterials in the WHO 20th Essential Medicines List (2017).
Doxycycline is one of the key antibacterials in the WHO 20th Essential Medicines List (2017).
DESCRIPTION
A tetracycline based antibiotic repurposed as a low-potency human metalloprotease inhibitor for peiodontitis. There are a number of salt forms in PubChem. The chemical structure we show here matches that of the consensus structure in PubChem, linked to above. The DrugBank, ChEBI and ChEMBL entries for doxycycline show a different structure.
[[ p.pathway_name ]]
[[ compound.targets[tid].gene_name ]]
Compound Sets
5
[[ a.name ]]
[[ ligand_id ]]
free of charge
External IDs
12
Molecular Weight
444.15
Hydrogen Bond Acceptors
9
Hydrogen Bond Donors
6
Rotatable Bonds
2
Ring Count
4
Aromatic Ring Count
1
cLogP
-0.5
TPSA
181.62
Fraction CSP3
0.41
Chiral centers
6.0
Largest ring
6.0
QED
0.33
Structural alerts
0
No structural alerts detected
Related compounds
Custom attributes
(extracted from source data)
Pathway
Microbiology&virology
Target
16S ribosome
30S ribosome
Therapeutic Class
Antiinflammatory Agents
Source data
