Page last updated: 2024-11-07

isodibut

Description Research Excerpts Clinical Trials Roles Classes Pathways Study Profile Bioassays Related Drugs Related Conditions Protein Interactions Research Growth

Description

virstatin: structure in first source [Medical Subject Headings (MeSH), National Library of Medicine, extracted Dec-2023]

Cross-References

ID SourceID
PubMed CID145949
CHEMBL ID403272
CHEBI ID189759
SCHEMBL ID3852274
SCHEMBL ID3134908
MeSH IDM0151970

Synonyms (58)

Synonym
CBMICRO_014897
1,3-dioxo-1h-benz(de)isoquinoline-2(3h)-butanoic acid
1h-benz(de)isoquinoline-2(3h)-butanoic acid, 1,3-dioxo-
isodibut
1,3-dioxo-1h-benz(de)isoquinoline-2(3h)-butyric acid
BRD-K60241851-001-02-8
4-(1,3-dioxo-1h,3h-benzo[de]isoquinolin-2-yl)-butyric acid
DIVK1C_007024
CBDIVE_003272
CBDIVE_001858
CBKINASE1_000229
CBKINASE1_012629
NCGC00178507-01
MLS001207259
smr000504925
BSPBIO_002720
virstatin
4-(n-(1,8-naphthalimide))-n-butyric acid
KBIO3_002220
KBIO1_001968
SPECTRUM2_000449
SPBIO_000498
SPECTRUM3_001240
SPECPLUS_000928
STK395003
4-(1,3-dioxo-1h-benzo[de]isoquinolin-2(3h)-yl)butanoic acid
CHEMBL403272
AKOS000114634
4-naphthalimidobutyric acid
CHEBI:189759
4-(1,3-dioxobenzo[de]isoquinolin-2-yl)butanoic acid
88909-96-0
1h,3h-benzo(de)isoquinoline-2-butyric acid-1,3-dione
unii-24sr2q1y6m
izodibut
24sr2q1y6m ,
4-{2,4-dioxo-3-azatricyclo[7.3.1.0,5,13]trideca-1(13),5,7,9,11-pentaen-3-yl}butanoic acid
EN300-00247
CCG-39963
F0303-0081
4-{2,4-dioxo-3-azatricyclo[7.3.1.0^{5,13}]trideca-1(13),5,7,9,11-pentaen-3-yl}butanoic acid
DG-0077
h-phg-nh2 hcl
AB00053241-05
SCHEMBL3852274
SCHEMBL3134908
4-{2,4-dioxo-3-azatricyclo[7.3.1.0 {5,13}]trideca- 1(13),5,7,9,11-pentaen-3-yl}butanoic acid
mfcd00181400
DTXSID10237406
Z56891243
1,3-dioxo-1h-benz[de]isoquinoline-2(3h)-butanoic acid
FT-0734904
4-(n-(1,8-naphthalimido))-n-butyric acid
alx-430-147
isodibut [who-dd]
4-(1,3-dioxo-1h,3h-benzo(de)isoquinolin-2-yl)-butyric acid
BRD-K60241851-001-06-9
CS-0092231
[information is derived through text-mining from research data collected from National Library of Medicine (NLM), extracted Dec-2023]

Drug Classes (1)

ClassDescription
isoquinolinesA class of organic heteropolycyclic compound consisting of isoquinoline and its substitution derivatives.
[compound class information is derived from Chemical Entities of Biological Interest (ChEBI), Hastings J, Owen G, Dekker A, Ennis M, Kale N, Muthukrishnan V, Turner S, Swainston N, Mendes P, Steinbeck C. (2016). ChEBI in 2016: Improved services and an expanding collection of metabolites. Nucleic Acids Res]

Protein Targets (6)

Potency Measurements

ProteinTaxonomyMeasurementAverage (µ)Min (ref.)Avg (ref.)Max (ref.)Bioassay(s)
thioredoxin reductaseRattus norvegicus (Norway rat)Potency25.11890.100020.879379.4328AID588456
ATAD5 protein, partialHomo sapiens (human)Potency2.05880.004110.890331.5287AID504467
IDH1Homo sapiens (human)Potency29.09290.005210.865235.4813AID686970
chromobox protein homolog 1Homo sapiens (human)Potency100.00000.006026.168889.1251AID540317
parathyroid hormone/parathyroid hormone-related peptide receptor precursorHomo sapiens (human)Potency7.07953.548119.542744.6684AID743266
muscleblind-like protein 1 isoform 1Homo sapiens (human)Potency7.94330.00419.962528.1838AID2675
[prepared from compound, protein, and bioassay information from National Library of Medicine (NLM), extracted Dec-2023]

Bioassays (32)

Assay IDTitleYearJournalArticle
AID1745845Primary qHTS for Inhibitors of ATXN expression
AID588501High-throughput multiplex microsphere screening for inhibitors of toxin protease, specifically Lethal Factor Protease, MLPCN compound set2010Current protocols in cytometry, Oct, Volume: Chapter 13Microsphere-based flow cytometry protease assays for use in protease activity detection and high-throughput screening.
AID588501High-throughput multiplex microsphere screening for inhibitors of toxin protease, specifically Lethal Factor Protease, MLPCN compound set2006Cytometry. Part A : the journal of the International Society for Analytical Cytology, May, Volume: 69, Issue:5
Microsphere-based protease assays and screening application for lethal factor and factor Xa.
AID588501High-throughput multiplex microsphere screening for inhibitors of toxin protease, specifically Lethal Factor Protease, MLPCN compound set2010Assay and drug development technologies, Feb, Volume: 8, Issue:1
High-throughput multiplex flow cytometry screening for botulinum neurotoxin type a light chain protease inhibitors.
AID588499High-throughput multiplex microsphere screening for inhibitors of toxin protease, specifically Botulinum neurotoxin light chain A protease, MLPCN compound set2010Current protocols in cytometry, Oct, Volume: Chapter 13Microsphere-based flow cytometry protease assays for use in protease activity detection and high-throughput screening.
AID588499High-throughput multiplex microsphere screening for inhibitors of toxin protease, specifically Botulinum neurotoxin light chain A protease, MLPCN compound set2006Cytometry. Part A : the journal of the International Society for Analytical Cytology, May, Volume: 69, Issue:5
Microsphere-based protease assays and screening application for lethal factor and factor Xa.
AID588499High-throughput multiplex microsphere screening for inhibitors of toxin protease, specifically Botulinum neurotoxin light chain A protease, MLPCN compound set2010Assay and drug development technologies, Feb, Volume: 8, Issue:1
High-throughput multiplex flow cytometry screening for botulinum neurotoxin type a light chain protease inhibitors.
AID651635Viability Counterscreen for Primary qHTS for Inhibitors of ATXN expression
AID504810Antagonists of the Thyroid Stimulating Hormone Receptor: HTS campaign2010Endocrinology, Jul, Volume: 151, Issue:7
A small molecule inverse agonist for the human thyroid-stimulating hormone receptor.
AID588497High-throughput multiplex microsphere screening for inhibitors of toxin protease, specifically Botulinum neurotoxin light chain F protease, MLPCN compound set2010Current protocols in cytometry, Oct, Volume: Chapter 13Microsphere-based flow cytometry protease assays for use in protease activity detection and high-throughput screening.
AID588497High-throughput multiplex microsphere screening for inhibitors of toxin protease, specifically Botulinum neurotoxin light chain F protease, MLPCN compound set2006Cytometry. Part A : the journal of the International Society for Analytical Cytology, May, Volume: 69, Issue:5
Microsphere-based protease assays and screening application for lethal factor and factor Xa.
AID588497High-throughput multiplex microsphere screening for inhibitors of toxin protease, specifically Botulinum neurotoxin light chain F protease, MLPCN compound set2010Assay and drug development technologies, Feb, Volume: 8, Issue:1
High-throughput multiplex flow cytometry screening for botulinum neurotoxin type a light chain protease inhibitors.
AID504812Inverse Agonists of the Thyroid Stimulating Hormone Receptor: HTS campaign2010Endocrinology, Jul, Volume: 151, Issue:7
A small molecule inverse agonist for the human thyroid-stimulating hormone receptor.
AID329131Inhibition of ToxT-mediated transcriptional activation of acfA promoter in Vibrio cholerae O395deltalacZ assessed as beta-galactosidase expression at 100 uM relative to control2007Proceedings of the National Academy of Sciences of the United States of America, Feb-13, Volume: 104, Issue:7
Virstatin inhibits dimerization of the transcriptional activator ToxT.
AID1785051Inhibition of ToxT in Vibrio cholerae at upto 5 uM measured after 3.5 hrs by beta-galactosidase assay relative to control2021ACS medicinal chemistry letters, Sep-09, Volume: 12, Issue:9
An Enantiodefined Conformationally Constrained Fatty Acid Mimetic and Potent Inhibitor of ToxT.
AID329122Inhibition of Vibrio cholerae wild type ToxT N-terminal domain dimerization expressed in Escherichia coli assessed as beta-galatosidase reporter gene expression at 35 uM by bacterial two-hybrid system2007Proceedings of the National Academy of Sciences of the United States of America, Feb-13, Volume: 104, Issue:7
Virstatin inhibits dimerization of the transcriptional activator ToxT.
AID329126Inhibition of ToxT-mediated transcriptional activation of tcpA promoter in Vibrio cholerae O395deltalacZ assessed as beta-galactosidase expression at 100 uM relative to control2007Proceedings of the National Academy of Sciences of the United States of America, Feb-13, Volume: 104, Issue:7
Virstatin inhibits dimerization of the transcriptional activator ToxT.
AID329128Inhibition of ToxT-mediated transcriptional activation of ctxAB promoter in Vibrio cholerae O395deltalacZ assessed as beta-galactosidase expression at 100 uM relative to control2007Proceedings of the National Academy of Sciences of the United States of America, Feb-13, Volume: 104, Issue:7
Virstatin inhibits dimerization of the transcriptional activator ToxT.
AID977602Inhibition of sodium fluorescein uptake in OATP1B3-transfected CHO cells at an equimolar substrate-inhibitor concentration of 10 uM2013Molecular pharmacology, Jun, Volume: 83, Issue:6
Structure-based identification of OATP1B1/3 inhibitors.
AID977599Inhibition of sodium fluorescein uptake in OATP1B1-transfected CHO cells at an equimolar substrate-inhibitor concentration of 10 uM2013Molecular pharmacology, Jun, Volume: 83, Issue:6
Structure-based identification of OATP1B1/3 inhibitors.
AID329129Inhibition of ToxT-mediated transcriptional activation of tagA promoter in Vibrio cholerae O395deltalacZ assessed as beta-galactosidase expression at 100 uM relative to control2007Proceedings of the National Academy of Sciences of the United States of America, Feb-13, Volume: 104, Issue:7
Virstatin inhibits dimerization of the transcriptional activator ToxT.
AID329133Inhibition of maltose binding protein-fused Vibrio cholerae ToxT monomer by gel filtration method2007Proceedings of the National Academy of Sciences of the United States of America, Feb-13, Volume: 104, Issue:7
Virstatin inhibits dimerization of the transcriptional activator ToxT.
AID329120Inhibition of Vibrio cholerae wild type ToxT N-terminal domain dimerization expressed in Escherichia coli assessed as beta-galatosidase reporter gene expression at 10 uM by bacterial two-hybrid system2007Proceedings of the National Academy of Sciences of the United States of America, Feb-13, Volume: 104, Issue:7
Virstatin inhibits dimerization of the transcriptional activator ToxT.
AID329127Inhibition of ToxT-mediated transcriptional activation of acfD promoter in Vibrio cholerae O395deltalacZ assessed as beta-galactosidase expression at 100 uM relative to control2007Proceedings of the National Academy of Sciences of the United States of America, Feb-13, Volume: 104, Issue:7
Virstatin inhibits dimerization of the transcriptional activator ToxT.
AID329134Inhibition of maltose binding protein-fused Vibrio cholerae ToxT L113P mutant monomer by gel filtration method2007Proceedings of the National Academy of Sciences of the United States of America, Feb-13, Volume: 104, Issue:7
Virstatin inhibits dimerization of the transcriptional activator ToxT.
AID329123Inhibition of Vibrio cholerae wild type ToxT N-terminal domain dimerization expressed in Escherichia coli assessed as beta-galatosidase reporter gene expression at 50 uM by bacterial two-hybrid system2007Proceedings of the National Academy of Sciences of the United States of America, Feb-13, Volume: 104, Issue:7
Virstatin inhibits dimerization of the transcriptional activator ToxT.
AID329132Inhibition of ToxT-mediated transcriptional activation of aldA promoter in Vibrio cholerae O395deltalacZ assessed as beta-galactosidase expression at 100 uM relative to control2007Proceedings of the National Academy of Sciences of the United States of America, Feb-13, Volume: 104, Issue:7
Virstatin inhibits dimerization of the transcriptional activator ToxT.
AID329124Inhibition of Vibrio cholerae ToxT L113P mutant N-terminal domain dimerization expressed in Escherichia coli assessed as beta-galatosidase reporter gene expression at 10 uM by bacterial two-hybrid system2007Proceedings of the National Academy of Sciences of the United States of America, Feb-13, Volume: 104, Issue:7
Virstatin inhibits dimerization of the transcriptional activator ToxT.
AID329125Inhibition of Vibrio cholerae wild type ToxT-mediated transcription of ctx promoter at 50 uM2007Proceedings of the National Academy of Sciences of the United States of America, Feb-13, Volume: 104, Issue:7
Virstatin inhibits dimerization of the transcriptional activator ToxT.
AID329130Inhibition of ToxT-mediated transcriptional activation of tcpI promoter in Vibrio cholerae O395deltalacZ assessed as beta-galactosidase expression at 100 uM relative to control2007Proceedings of the National Academy of Sciences of the United States of America, Feb-13, Volume: 104, Issue:7
Virstatin inhibits dimerization of the transcriptional activator ToxT.
AID329121Inhibition of Vibrio cholerae wild type ToxT N-terminal domain dimerization expressed in Escherichia coli assessed as beta-galatosidase reporter gene expression at 20 uM by bacterial two-hybrid system2007Proceedings of the National Academy of Sciences of the United States of America, Feb-13, Volume: 104, Issue:7
Virstatin inhibits dimerization of the transcriptional activator ToxT.
AID1159550Human Phosphogluconate dehydrogenase (6PGD) Inhibitor Screening2015Nature cell biology, Nov, Volume: 17, Issue:11
6-Phosphogluconate dehydrogenase links oxidative PPP, lipogenesis and tumour growth by inhibiting LKB1-AMPK signalling.
[information is prepared from bioassay data collected from National Library of Medicine (NLM), extracted Dec-2023]

Research

Studies (26)

TimeframeStudies, This Drug (%)All Drugs %
pre-19900 (0.00)18.7374
1990's3 (11.54)18.2507
2000's6 (23.08)29.6817
2010's14 (53.85)24.3611
2020's3 (11.54)2.80
[information is prepared from research data collected from National Library of Medicine (NLM), extracted Dec-2023]

Study Types

Publication TypeThis drug (%)All Drugs (%)
Trials1 (3.70%)5.53%
Reviews3 (11.11%)6.00%
Case Studies0 (0.00%)4.05%
Observational0 (0.00%)0.25%
Other23 (85.19%)84.16%
[information is prepared from research data collected from National Library of Medicine (NLM), extracted Dec-2023]