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Compound InformationSONAR Target prediction
Name:

FLUNISOLIDE

Unique Identifier:SPE01501187
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:
Molecular Weight:403.252 g/mol
X log p:3.921  (online calculus)
Lipinksi Failures0
TPSA52.6
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptors Count:6
Rotatable Bond Count:2
Canonical Smiles:CC1(C)OC2CC3C4CC(F)C5=CC(=O)C=CC5(C)C4C(O)CC3(C)C2(O1)C(=O)CO
Source:semisynthetic
Therapeutics:antiinflammatory
Generic_name:Flunisolide
Drug_type:Approved Drug
Pharmgkb_id:PA449661
Kegg_compound_id:D00324
Drugbank_id:APRD00976
Melting_point:245 oC
H2o_solubility:Practically insoluble
Logp:2.9
Cas_registry_number:03/03/3385
Drug_category:Anti-Asthmatic Agents; Anti-Inflammatory Agents; ATC:R01AD04; ATC:R03BA03
Indication:For the maintenance treatment of asthma as a prophylactic therapy.
Pharmacology:Flunisolide is a synthetic corticosteroid. It is administered either as an oral
metered-dose inhaler for the treatment of asthma or as a nasal spray for treating
allergic rhinitis. Corticosteroids are naturally occurring hormones that prevent or
suppress inflammation and immune responses. When given as an intranasal spray,
flunisolide reduces watery nasal discharge (rhinorrhea), nasal congestion, postnasal
drip, sneezing, and itching oat the back of the throat that are common allergic
symptoms.
Mechanism_of_action:Flunisolide is a glucocorticoid receptor agonist. The antiinflammatory actions of
corticosteroids are thought to involve lipocortins, phospholipase A2 inhibitory
proteins which, through inhibition arachidonic acid, control the biosynthesis of
prostaglandins and leukotrienes. The immune system is suppressed by corticosteroids
due to a decrease in the function of the lymphatic system, a reduction in
immunoglobulin and complement concentrations, the precipitation of lymphocytopenia,
and interference with antigen-antibody binding. Flunisolide binds to plasma
transcortin, and it becomes active when it is not bound to transcortin.
Organisms_affected:Humans and other mammals

Found: 205 nonactive as graph: single | with analogs [1] << Back 141 142 143 144 145 146 147 148 149 150  Next >> [205]
Species: 4932
Condition: IDH2
Replicates: 2
Raw OD Value: r im 0.5928±0.0142128
Normalized OD Score: sc h 0.9938±0.0103008
Z-Score: -0.3157±0.523743
p-Value: 0.724552
Z-Factor: -14.5874
Fitness Defect: 0.3222
Bioactivity Statement: Nonactive
Experimental Conditions
Library:Spectrum
Plate Number and Position:15|F8
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:25.50 Celcius
Date:2007-10-19 YYYY-MM-DD
Plate CH Control (+):0.040825±0.00089
Plate DMSO Control (-):0.589675±0.01398
Plate Z-Factor:0.9183
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DBLink | Rows returned: 92 Next >> 
3379
53655
53656
82153
441210
5282377

internal high similarity DBLink | Rows returned: 3
SPE01501175 0.9043
SPE01500587 0.9076
SPE01500302 0.9417

active | Cluster 2095 | Additional Members: 14 | Rows returned: 0

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