Page last updated: 2024-11-10

2-[[2-[2-(4-methoxyanilino)-2-oxoethyl]-1-oxo-5-isoquinolinyl]oxy]propanoic acid ethyl ester

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

Cross-References

ID SourceID
PubMed CID4131581
CHEMBL ID262079
CHEBI ID91559

Synonyms (18)

Synonym
isoquinolinone scaffold, 31
ethyl 2-[(2-{[(4-methoxyphenyl)carbamoyl]methyl}-1-oxo-1,2-dihydroisoquinolin-5-yl)oxy]propanoate
bdbm28647
SR-03000000023-1
ml017
CHEMBL262079 ,
smr001398718
MLS002474583
ethyl 2-[2-[2-(4-methoxyanilino)-2-oxoethyl]-1-oxoisoquinolin-5-yl]oxypropanoate
bdbm50341557
ethyl 2-(2-(2-(4-methoxyphenylamino)-2-oxoethyl)-1-oxo-1,2-dihydroisoquinolin-5-yloxy)propanoate
F1808-0154
868224-58-2
ethyl 2-((2-(2-((4-methoxyphenyl)amino)-2-oxoethyl)-1-oxo-1,2-dihydroisoquinolin-5-yl)oxy)propanoate
AKOS024610205
CHEBI:91559
2-[[2-[2-(4-methoxyanilino)-2-oxoethyl]-1-oxo-5-isoquinolinyl]oxy]propanoic acid ethyl ester
Q27163392
[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 (1)

Inhibition Measurements

ProteinTaxonomyMeasurementAverageMin (ref.)Avg (ref.)Max (ref.)Bioassay(s)
Steroidogenic factor 1Homo sapiens (human)IC50 (µMol)0.20000.03001.69807.3000AID329653; AID593523
[prepared from compound, protein, and bioassay information from National Library of Medicine (NLM), extracted Dec-2023]

Activation Measurements

ProteinTaxonomyMeasurementAverageMin (ref.)Avg (ref.)Max (ref.)Bioassay(s)
Steroidogenic factor 1Homo sapiens (human)EC50 (µMol)0.20000.20000.48000.7600AID1798910
[prepared from compound, protein, and bioassay information from National Library of Medicine (NLM), extracted Dec-2023]

Biological Processes (20)

Processvia Protein(s)Taxonomy
luteinizationSteroidogenic factor 1Homo sapiens (human)
sex determinationSteroidogenic factor 1Homo sapiens (human)
primary sex determinationSteroidogenic factor 1Homo sapiens (human)
male gonad developmentSteroidogenic factor 1Homo sapiens (human)
female gonad developmentSteroidogenic factor 1Homo sapiens (human)
positive regulation of gene expressionSteroidogenic factor 1Homo sapiens (human)
male sex determinationSteroidogenic factor 1Homo sapiens (human)
adrenal gland developmentSteroidogenic factor 1Homo sapiens (human)
intracellular receptor signaling pathwaySteroidogenic factor 1Homo sapiens (human)
Leydig cell differentiationSteroidogenic factor 1Homo sapiens (human)
hormone metabolic processSteroidogenic factor 1Homo sapiens (human)
positive regulation of transcription by RNA polymerase IISteroidogenic factor 1Homo sapiens (human)
regulation of steroid biosynthetic processSteroidogenic factor 1Homo sapiens (human)
maintenance of protein location in nucleusSteroidogenic factor 1Homo sapiens (human)
Sertoli cell differentiationSteroidogenic factor 1Homo sapiens (human)
positive regulation of male gonad developmentSteroidogenic factor 1Homo sapiens (human)
negative regulation of female gonad developmentSteroidogenic factor 1Homo sapiens (human)
regulation of transcription by RNA polymerase IISteroidogenic factor 1Homo sapiens (human)
tissue developmentSteroidogenic factor 1Homo sapiens (human)
hormone-mediated signaling pathwaySteroidogenic factor 1Homo sapiens (human)
[Information is prepared from geneontology information from the June-17-2024 release]

Molecular Functions (13)

Processvia Protein(s)Taxonomy
RNA polymerase II transcription regulatory region sequence-specific DNA bindingSteroidogenic factor 1Homo sapiens (human)
RNA polymerase II cis-regulatory region sequence-specific DNA bindingSteroidogenic factor 1Homo sapiens (human)
DNA-binding transcription factor activity, RNA polymerase II-specificSteroidogenic factor 1Homo sapiens (human)
transcription coregulator bindingSteroidogenic factor 1Homo sapiens (human)
DNA bindingSteroidogenic factor 1Homo sapiens (human)
chromatin bindingSteroidogenic factor 1Homo sapiens (human)
nuclear receptor activitySteroidogenic factor 1Homo sapiens (human)
protein bindingSteroidogenic factor 1Homo sapiens (human)
phospholipid bindingSteroidogenic factor 1Homo sapiens (human)
zinc ion bindingSteroidogenic factor 1Homo sapiens (human)
enzyme bindingSteroidogenic factor 1Homo sapiens (human)
sequence-specific DNA bindingSteroidogenic factor 1Homo sapiens (human)
sequence-specific double-stranded DNA bindingSteroidogenic factor 1Homo sapiens (human)
[Information is prepared from geneontology information from the June-17-2024 release]

Ceullar Components (5)

Processvia Protein(s)Taxonomy
nucleusSteroidogenic factor 1Homo sapiens (human)
nucleoplasmSteroidogenic factor 1Homo sapiens (human)
cytosolSteroidogenic factor 1Homo sapiens (human)
chromatinSteroidogenic factor 1Homo sapiens (human)
RNA polymerase II transcription regulator complexSteroidogenic factor 1Homo sapiens (human)
[Information is prepared from geneontology information from the June-17-2024 release]

Bioassays (18)

Assay IDTitleYearJournalArticle
AID593523Inverse agonist activity at SF-12011Journal of medicinal chemistry, Apr-14, Volume: 54, Issue:7
Small molecule agonists of the orphan nuclear receptors steroidogenic factor-1 (SF-1, NR5A1) and liver receptor homologue-1 (LRH-1, NR5A2).
AID593524Antiproliferative activity against SF-1 negative human SW13 cells2011Journal of medicinal chemistry, Apr-14, Volume: 54, Issue:7
Small molecule agonists of the orphan nuclear receptors steroidogenic factor-1 (SF-1, NR5A1) and liver receptor homologue-1 (LRH-1, NR5A2).
AID329653Inhibition of GAL4-tagged NR5A1 by luciferase assay2008Bioorganic & medicinal chemistry letters, Apr-15, Volume: 18, Issue:8
Synthesis of small molecule inhibitors of the orphan nuclear receptor steroidogenic factor-1 (NR5A1) based on isoquinolinone scaffolds.
AID329656Inhibition of GAL4-tagged RORalpha at 100 uM by luciferase assay2008Bioorganic & medicinal chemistry letters, Apr-15, Volume: 18, Issue:8
Synthesis of small molecule inhibitors of the orphan nuclear receptor steroidogenic factor-1 (NR5A1) based on isoquinolinone scaffolds.
AID593525Inhibition of doxycycline induced proliferation in human NCI-H295RR cells2011Journal of medicinal chemistry, Apr-14, Volume: 54, Issue:7
Small molecule agonists of the orphan nuclear receptors steroidogenic factor-1 (SF-1, NR5A1) and liver receptor homologue-1 (LRH-1, NR5A2).
AID329658Inhibition of HSV1 GAL4-tagged VP16 at 100 uM by luciferase assay2008Bioorganic & medicinal chemistry letters, Apr-15, Volume: 18, Issue:8
Synthesis of small molecule inhibitors of the orphan nuclear receptor steroidogenic factor-1 (NR5A1) based on isoquinolinone scaffolds.
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.
AID651635Viability Counterscreen for Primary qHTS for Inhibitors of ATXN expression
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.
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.
AID1798910Transactivation Cell-Based Assay from Article 10.1016/j.bmcl.2008.03.027: \\Synthesis of small molecule inhibitors of the orphan nuclear receptor steroidogenic factor-1 (NR5A1) based on isoquinolinone scaffolds.\\2008Bioorganic & medicinal chemistry letters, Apr-15, Volume: 18, Issue:8
Synthesis of small molecule inhibitors of the orphan nuclear receptor steroidogenic factor-1 (NR5A1) based on isoquinolinone scaffolds.
[information is prepared from bioassay data collected from National Library of Medicine (NLM), extracted Dec-2023]

Research

Studies (6)

TimeframeStudies, This Drug (%)All Drugs %
pre-19900 (0.00)18.7374
1990's0 (0.00)18.2507
2000's2 (33.33)29.6817
2010's3 (50.00)24.3611
2020's1 (16.67)2.80
[information is prepared from research data collected from National Library of Medicine (NLM), extracted Dec-2023]

Market Indicators

Research Demand Index: 12.35

According to the monthly volume, diversity, and competition of internet searches for this compound, as well the volume and growth of publications, there is estimated to be weak demand-to-supply ratio for research on this compound.

MetricThis Compound (vs All)
Research Demand Index12.35 (24.57)
Research Supply Index1.95 (2.92)
Research Growth Index4.30 (4.65)
Search Engine Demand Index0.00 (26.88)
Search Engine Supply Index0.00 (0.95)

This Compound (12.35)

All Compounds (24.57)

Study Types

Publication TypeThis drug (%)All Drugs (%)
Trials0 (0.00%)5.53%
Reviews0 (0.00%)6.00%
Case Studies0 (0.00%)4.05%
Observational0 (0.00%)0.25%
Other6 (100.00%)84.16%
[information is prepared from research data collected from National Library of Medicine (NLM), extracted Dec-2023]