Detailed information for compound 809736

Basic information

Technical information
  • TDR Targets ID: 809736
  • Name: 6-bromo-2-furan-2-yl-3,1-benzoxazin-4-one
  • MW: 292.085 | Formula: C12H6BrNO3
  • H donors: 0 H acceptors: 1 LogP: 3.02 Rotable bonds: 1
    Rule of 5 violations (Lipinski): 1
  • SMILES: Brc1ccc2c(c1)c(=O)oc(n2)c1ccco1
  • InChi: 1S/C12H6BrNO3/c13-7-3-4-9-8(6-7)12(15)17-11(14-9)10-2-1-5-16-10/h1-6H
  • InChiKey: OITCTVDJVATGCK-UHFFFAOYSA-N  


Substructure search Similarity search

Network

Hover on a compound node to display the structore

Synonyms

  • 6-bromo-2-(2-furyl)-3,1-benzoxazin-4-one
  • Oprea1_843042
  • STK156348
  • CBMicro_008704
  • EU-0072010
  • BIM-0008917.P001
  • ZINC00184775
  • Oprea1_789709

Targets

Known targets for this compound

No curated genes were found associated with this compound

Predicted pathogen targets for this compound

By orthology
No druggable targets predicted by orthology data
By sequence similarity to non orthologous known druggable targets
No druggable targets predicted by sequence similarity
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Schistosoma mansoni glutaminase 0.0267 0.3004 0.4941
Loa Loa (eye worm) hypothetical protein 0.0025 0.011 0.0367
Loa Loa (eye worm) Sodium:neurotransmitter symporter family protein 0.0161 0.1731 0.5761
Schistosoma mansoni hypothetical protein 0.0524 0.6081 1
Echinococcus granulosus lamin dm0 0.0058 0.0501 0.0824
Trypanosoma cruzi mitochondrial DNA polymerase beta-PAK, putative 0.0045 0.0349 0.0955
Toxoplasma gondii aldehyde dehydrogenase 0.0064 0.0571 0.2782
Loa Loa (eye worm) intermediate filament protein 0.0058 0.0501 0.1667
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD7 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0018 0.0021 0.0104
Loa Loa (eye worm) hypothetical protein 0.0161 0.1731 0.5761
Leishmania major aldehyde dehydrogenase, mitochondrial precursor 0.0064 0.0571 0.156
Trypanosoma brucei DNA polymerase beta thumb, putative 0.0045 0.0349 0.0955
Echinococcus multilocularis sodium and chloride dependent glycine 0.0161 0.1731 0.1731
Schistosoma mansoni hypothetical protein 0.0069 0.0637 0.1048
Schistosoma mansoni sodium-dependent neurotransmitter transporter 0.0031 0.0182 0.0299
Plasmodium vivax amine transporter, putative 0.0031 0.0182 0.0887
Schistosoma mansoni sodium-dependent neurotransmitter transporter 0.0031 0.0182 0.0299
Loa Loa (eye worm) hypothetical protein 0.0057 0.0488 0.1625
Trypanosoma brucei mitochondrial DNA polymerase beta 0.0322 0.366 1
Echinococcus multilocularis GPCR, family 2 0.0032 0.0192 0.0192
Onchocerca volvulus 0.0031 0.0182 0.1838
Onchocerca volvulus 0.0031 0.0182 0.1838
Plasmodium vivax enoyl-acyl carrier protein reductase 0.0188 0.2052 1
Leishmania major 4-coumarate:coa ligase-like protein 0.0025 0.011 0.0301
Trypanosoma cruzi mitochondrial DNA polymerase beta-PAK, putative 0.0152 0.1631 0.4456
Brugia malayi hypothetical protein 0.0031 0.0182 0.0605
Trypanosoma cruzi serine/threonine protein phosphatase, putative 0.0042 0.0314 0.0859
Loa Loa (eye worm) hypothetical protein 0.0101 0.1021 0.34
Echinococcus multilocularis lamin 0.0058 0.0501 0.0501
Loa Loa (eye worm) hypothetical protein 0.0031 0.0182 0.0605
Echinococcus granulosus uncharacterized sodium dependent transporter 0.0031 0.0182 0.0299
Echinococcus granulosus serine:threonine protein phosphatase 2B 0.0042 0.0314 0.0517
Brugia malayi AMP-binding enzyme family protein 0.0025 0.011 0.0367
Toxoplasma gondii protein phosphatase 2B catalytic subunit, calcineurin family phosphatse superfamily protein 0.0042 0.0314 0.1533
Toxoplasma gondii hypothetical protein 0.0031 0.0182 0.0887
Onchocerca volvulus 0.0031 0.0182 0.1838
Loa Loa (eye worm) intermediate filament tail domain-containing protein 0.0058 0.0501 0.1667
Brugia malayi Serine/threonine protein phosphatase 2B catalytic subunit 2 0.0042 0.0314 0.1047
Loa Loa (eye worm) hypothetical protein 0.0019 0.0034 0.0112
Brugia malayi cytoplasmic intermediate filament protein 0.0031 0.0179 0.0596
Echinococcus multilocularis lamin dm0 0.0058 0.0501 0.0501
Plasmodium vivax serine/threonine protein phosphatase 2B catalytic subunit A, putative 0.0042 0.0314 0.1533
Mycobacterium tuberculosis Probable chain -fatty-acid-CoA ligase FadD13 (fatty-acyl-CoA synthetase) 0.0025 0.011 0.0537
Schistosoma mansoni biogenic amine (5HT) receptor 0.0127 0.1329 0.2185
Loa Loa (eye worm) MH2 domain-containing protein 0.0116 0.1195 0.3978
Schistosoma mansoni norepinephrine/norepinephrine transporter 0.0031 0.0182 0.0299
Schistosoma mansoni sodium/chloride dependent transporter 0.0161 0.1731 0.2846
Plasmodium vivax hypothetical protein, conserved 0.0031 0.0182 0.0887
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.0032 0.0192 0.0192
Echinococcus granulosus intermediate filament protein 0.0058 0.0501 0.0824
Toxoplasma gondii hypothetical protein 0.0052 0.0429 0.2091
Wolbachia endosymbiont of Brugia malayi enoyl-ACP reductase 0.0188 0.2052 0.5
Mycobacterium tuberculosis Fatty-acid-AMP ligase FadD30 (fatty-acid-AMP synthetase) (fatty-acid-AMP synthase) 0.0019 0.0034 0.0164
Loa Loa (eye worm) transcription factor SMAD2 0.0116 0.1195 0.3978
Loa Loa (eye worm) hypothetical protein 0.0019 0.0034 0.0112
Schistosoma mansoni hypothetical protein 0.0524 0.6081 1
Mycobacterium ulcerans acyl-CoA synthetase 0.0025 0.011 0.0257
Mycobacterium ulcerans long-chain fatty-acid CoA ligase 0.0025 0.011 0.0257
Leishmania major mitochondrial DNA polymerase beta-PAK, putative 0.0152 0.1631 0.4456
Schistosoma mansoni lamin 0.0058 0.0501 0.0824
Schistosoma mansoni norepinephrine/norepinephrine transporter 0.0031 0.0182 0.0299
Brugia malayi Sodium:neurotransmitter symporter family protein 0.0031 0.0182 0.0605
Echinococcus multilocularis serotonin receptor 0.0127 0.1329 0.1329
Schistosoma mansoni tar DNA-binding protein 0.026 0.2915 0.4794
Leishmania major mitochondrial DNA polymerase beta 0.0322 0.366 1
Schistosoma mansoni tar DNA-binding protein 0.026 0.2915 0.4794
Schistosoma mansoni sodium/chloride dependent neurotransmitter transporter 0.0031 0.0182 0.0299
Mycobacterium ulcerans acyl-CoA synthetase 0.0025 0.011 0.0257
Brugia malayi intermediate filament protein 0.0058 0.0501 0.1667
Onchocerca volvulus 0.0058 0.0501 1
Schistosoma mansoni sodium/chloride dependent transporter 0.0161 0.1731 0.2846
Loa Loa (eye worm) hypothetical protein 0.0069 0.0637 0.2121
Schistosoma mansoni sodium/chloride dependent neurotransmitter transporter 0.0031 0.0182 0.0299
Schistosoma mansoni norepinephrine/norepinephrine transporter 0.0031 0.0182 0.0299
Toxoplasma gondii Sodium:neurotransmitter symporter family protein 0.0031 0.0182 0.0887
Leishmania major 4-coumarate:coa ligase-like protein 0.0025 0.011 0.0301
Trypanosoma cruzi DNA polymerase beta thumb, putative 0.0045 0.0349 0.0955
Loa Loa (eye worm) hypothetical protein 0.0031 0.0182 0.0605
Schistosoma mansoni tar DNA-binding protein 0.026 0.2915 0.4794
Echinococcus granulosus GPCR family 2 0.0032 0.0192 0.0315
Plasmodium falciparum amino acid transporter, putative 0.0031 0.0182 0.0887
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD3 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0018 0.0021 0.0104
Plasmodium vivax acyl-CoA synthetase, putative 0.0019 0.0034 0.0164
Loa Loa (eye worm) hypothetical protein 0.0127 0.1329 0.4423
Mycobacterium ulcerans long-chain-fatty-acid-CoA ligase 0.0025 0.011 0.0257
Echinococcus multilocularis serine:threonine protein phosphatase 2B 0.0042 0.0314 0.0314
Echinococcus multilocularis sodium and chloride dependent glycine 0.0161 0.1731 0.1731
Mycobacterium ulcerans fatty-acid-CoA ligase 0.0025 0.011 0.0257
Loa Loa (eye worm) serotonin transporter b 0.0031 0.0182 0.0605
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.026 0.2915 0.9703
Echinococcus multilocularis tar DNA binding protein 0.026 0.2915 0.2915
Brugia malayi Sodium:neurotransmitter symporter family protein 0.0161 0.1731 0.5761
Brugia malayi Calcitonin receptor-like protein seb-1 0.0101 0.1021 0.34
Schistosoma mansoni aldehyde dehydrogenase 0.0064 0.0571 0.0939
Mycobacterium ulcerans hypothetical protein 0.0025 0.011 0.0257
Echinococcus granulosus uncharacterized sodium dependent transporter 0.0031 0.0182 0.0299
Mycobacterium ulcerans aldehyde dehydrogenase 0.0064 0.0571 0.1808
Mycobacterium ulcerans glutaminase 0.0267 0.3004 1
Loa Loa (eye worm) TAR-binding protein 0.026 0.2915 0.9703
Schistosoma mansoni intermediate filament proteins 0.0058 0.0501 0.0824
Schistosoma mansoni protein phosphatase-2b 0.0042 0.0314 0.0517
Entamoeba histolytica Ser/Thr protein phosphatase, putative 0.0042 0.0314 1
Loa Loa (eye worm) glutaminase 0.0267 0.3004 1
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD2 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0025 0.011 0.0537
Schistosoma mansoni hypothetical protein 0.0032 0.0192 0.0315
Plasmodium falciparum transporter, putative 0.0031 0.0182 0.0887
Schistosoma mansoni protein phosphatase-2b 0.0042 0.0314 0.0517
Chlamydia trachomatis enoyl-acyl-carrier protein reductase 0.0188 0.2052 1
Echinococcus granulosus sodium dependent neurotransmitter transporter 0.0031 0.0182 0.0299
Loa Loa (eye worm) hypothetical protein 0.0019 0.0034 0.0112
Mycobacterium ulcerans aldehyde dehydrogenase 0.0064 0.0571 0.1808
Loa Loa (eye worm) hypothetical protein 0.0058 0.0501 0.1667
Entamoeba histolytica calcineurin catalytic subunit A, putative 0.0042 0.0314 1
Loa Loa (eye worm) Sodium:neurotransmitter symporter family protein 0.0031 0.0182 0.0605
Schistosoma mansoni sodium-dependent amino acid transporter 0.0031 0.0182 0.0299
Echinococcus granulosus tar DNA binding protein 0.026 0.2915 0.4794
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.0032 0.0192 0.0315
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.0032 0.0192 0.0638
Schistosoma mansoni hypothetical protein 0.0032 0.0192 0.0315
Loa Loa (eye worm) hypothetical protein 0.0025 0.011 0.0367
Brugia malayi latrophilin 2 splice variant baaae 0.0069 0.0637 0.2121
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0101 0.1021 0.34
Schistosoma mansoni aldehyde dehydrogenase 0.0064 0.0571 0.0939
Plasmodium falciparum serine/threonine protein phosphatase 2B catalytic subunit A 0.0042 0.0314 0.1533
Loa Loa (eye worm) hypothetical protein 0.0027 0.0129 0.0431
Trypanosoma cruzi serine/threonine protein phosphatase, putative 0.0042 0.0314 0.0859
Loa Loa (eye worm) norepinephrine transporter 0.0031 0.0182 0.0605
Loa Loa (eye worm) solute carrier family 6 member 4 0.0031 0.0182 0.0605
Brugia malayi AMP-binding enzyme family protein 0.0025 0.011 0.0367
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD35 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0018 0.0021 0.0104
Leishmania major serine/threonine protein phosphatase 2B catalytic subunit A2, putative 0.0042 0.0314 0.0859
Entamoeba histolytica calcineurin catalytic subunit A, putative 0.0042 0.0314 1
Onchocerca volvulus 0.0031 0.0182 0.1838
Mycobacterium ulcerans enoyl-(acyl carrier protein) reductase 0.0188 0.2052 0.6794
Schistosoma mansoni hypothetical protein 0.0032 0.0192 0.0315
Echinococcus granulosus sodium and chloride dependent glycine 0.0161 0.1731 0.2846
Loa Loa (eye worm) cytoplasmic intermediate filament protein 0.0031 0.0179 0.0596
Brugia malayi RNA recognition motif domain containing protein 0.026 0.2915 0.9703
Loa Loa (eye worm) hypothetical protein 0.0028 0.0142 0.0473
Trypanosoma cruzi serine/threonine protein phosphatase 2B catalytic subunit A2, putative 0.0042 0.0314 0.0859
Loa Loa (eye worm) hypothetical protein 0.0042 0.0307 0.1023
Brugia malayi AMP-binding enzyme family protein 0.0025 0.011 0.0367
Echinococcus multilocularis geminin 0.0524 0.6081 0.6081
Schistosoma mansoni tar DNA-binding protein 0.026 0.2915 0.4794
Mycobacterium ulcerans hypothetical protein 0.017 0.1837 0.6071
Entamoeba histolytica Ser/Thr protein phosphatase, putative 0.0042 0.0314 1
Trypanosoma brucei mitochondrial DNA polymerase beta-PAK 0.0152 0.1631 0.4456
Loa Loa (eye worm) hypothetical protein 0.0031 0.0182 0.0605
Schistosoma mansoni hypothetical protein 0.0032 0.0192 0.0315
Loa Loa (eye worm) hypothetical protein 0.0042 0.0314 0.1047
Toxoplasma gondii Sodium:neurotransmitter symporter family protein 0.0031 0.0182 0.0887
Leishmania major serine/threonine protein phosphatase, putative 0.0042 0.0314 0.0859
Trichomonas vaginalis glutaminase, putative 0.0267 0.3004 1
Brugia malayi Sodium:neurotransmitter symporter family protein 0.0031 0.0182 0.0605
Echinococcus granulosus sodium:chloride dependent neurotransmitter 0.0031 0.0182 0.0299
Loa Loa (eye worm) hypothetical protein 0.0019 0.0034 0.0112
Echinococcus granulosus lamin 0.0058 0.0501 0.0824
Mycobacterium ulcerans aldehyde dehydrogenase 0.0064 0.0571 0.1808
Trypanosoma cruzi mitochondrial DNA polymerase beta, putative 0.0322 0.366 1
Toxoplasma gondii hypothetical protein 0.0031 0.0182 0.0887
Echinococcus granulosus cytoplasmic intermediate filament protein 0.0028 0.0142 0.0234
Loa Loa (eye worm) hypothetical protein 0.0127 0.1329 0.4423
Loa Loa (eye worm) hypothetical protein 0.0025 0.011 0.0367
Leishmania major 4-coumarate:coa ligase-like protein 0.0025 0.011 0.0301
Echinococcus granulosus biogenic amine 5HT receptor 0.0127 0.1329 0.2185
Brugia malayi Sodium:neurotransmitter symporter family protein 1, putative 0.0031 0.0182 0.0605
Schistosoma mansoni tar DNA-binding protein 0.026 0.2915 0.4794
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD5 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0018 0.0021 0.0104
Loa Loa (eye worm) RNA binding protein 0.026 0.2915 0.9703
Loa Loa (eye worm) hypothetical protein 0.0027 0.0129 0.0431
Echinococcus granulosus serine:threonine protein phosphatase 2B 0.0042 0.0314 0.0517
Echinococcus multilocularis uncharacterized sodium dependent transporter 0.0031 0.0182 0.0182
Echinococcus multilocularis cytoplasmic intermediate filament protein 0.0028 0.0142 0.0142
Echinococcus granulosus aldehyde dehydrogenase mitochondrial 0.0064 0.0571 0.0939
Mycobacterium leprae NADH-DEPENDENT ENOYL-[ACYL-CARRIER-PROTEIN] REDUCTASE INHA (NADH-DEPENDENT ENOYL-ACP REDUCTASE) 0.0188 0.2052 1
Loa Loa (eye worm) glutaminase 2 0.0267 0.3004 1
Toxoplasma gondii Sodium:neurotransmitter symporter family protein 0.0031 0.0182 0.0887
Echinococcus multilocularis serotonin transporter 0.0031 0.0182 0.0182
Loa Loa (eye worm) hypothetical protein 0.0031 0.0182 0.0605
Chlamydia trachomatis Ssodium-dependent amino acid transporter 0.0031 0.0182 0.0735
Mycobacterium tuberculosis NADH-dependent enoyl-[acyl-carrier-protein] reductase InhA (NADH-dependent enoyl-ACP reductase) 0.0188 0.2052 1
Trypanosoma cruzi DNA polymerase beta thumb, putative 0.0045 0.0349 0.0955
Entamoeba histolytica calcineurin catalytic subunit A, putative 0.0042 0.0314 1
Onchocerca volvulus 0.0058 0.0501 1
Schistosoma mansoni sodium/chloride dependent neurotransmitter transporter 0.0031 0.0182 0.0299
Brugia malayi MH2 domain containing protein 0.0116 0.1195 0.3978
Loa Loa (eye worm) hypothetical protein 0.0032 0.0192 0.0638
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0101 0.1021 0.34
Brugia malayi Intermediate filament tail domain containing protein 0.0058 0.0501 0.1667
Echinococcus multilocularis musashi 0.0058 0.0501 0.0501
Toxoplasma gondii enoyl-acyl carrier reductase ENR 0.0188 0.2052 1
Echinococcus granulosus cadherin EGF LAG seven pass G type receptor 0.0032 0.0192 0.0315
Loa Loa (eye worm) latrophilin receptor protein 2 0.0032 0.0192 0.0638
Trypanosoma brucei protein phosphatase 2B, putative 0.0042 0.0314 0.0859
Schistosoma mansoni sodium/chloride dependent transporter 0.0031 0.0182 0.0299
Trypanosoma cruzi mitochondrial DNA polymerase beta, putative 0.0322 0.366 1
Brugia malayi RNA binding protein 0.026 0.2915 0.9703
Mycobacterium tuberculosis Conserved hypothetical protein 0.017 0.1837 0.8953
Brugia malayi glutaminase DH11.1 0.0267 0.3004 1
Loa Loa (eye worm) hypothetical protein 0.0161 0.1731 0.5761
Echinococcus multilocularis sodium dependent neurotransmitter transporter 0.0031 0.0182 0.0182
Mycobacterium ulcerans acyl-CoA synthetase 0.0025 0.011 0.0257
Plasmodium falciparum enoyl-acyl carrier reductase 0.0188 0.2052 1
Echinococcus multilocularis cadherin EGF LAG seven pass G type receptor 0.0032 0.0192 0.0192
Entamoeba histolytica calcineurin catalytic subunit A, putative 0.0042 0.0314 1
Plasmodium falciparum acyl-CoA synthetase 0.0019 0.0034 0.0164
Mycobacterium ulcerans long-chain-fatty-acid--CoA ligase 0.0025 0.011 0.0257
Schistosoma mansoni lamin 0.0058 0.0501 0.0824
Loa Loa (eye worm) hypothetical protein 0.0019 0.0034 0.0112
Echinococcus multilocularis serine:threonine protein phosphatase 2B 0.0042 0.0314 0.0314
Trypanosoma cruzi mitochondrial DNA polymerase beta-PAK, putative 0.0055 0.0468 0.1278
Echinococcus multilocularis serotonin receptor 0.0127 0.1329 0.1329
Loa Loa (eye worm) hypothetical protein 0.0031 0.0182 0.0605
Mycobacterium tuberculosis Probable aldehyde dehydrogenase 0.0064 0.0571 0.2782
Echinococcus multilocularis sodium:chloride dependent neurotransmitter 0.0031 0.0182 0.0182
Loa Loa (eye worm) hypothetical protein 0.0031 0.0182 0.0605
Echinococcus multilocularis aldehyde dehydrogenase, mitochondrial 0.0064 0.0571 0.0571
Echinococcus granulosus geminin 0.0524 0.6081 1
Schistosoma mansoni sodium-dependent neurotransmitter transporter 0.0031 0.0182 0.0299
Brugia malayi Latrophilin receptor protein 2 0.0032 0.0192 0.0638
Treponema pallidum sodium- and chloride- dependent transporter 0.0031 0.0182 0.5
Echinococcus granulosus sodium and chloride dependent glycine 0.0161 0.1731 0.2846
Brugia malayi Sodium:neurotransmitter symporter family protein 0.0031 0.0182 0.0605
Loa Loa (eye worm) hypothetical protein 0.0031 0.0182 0.0605
Brugia malayi TAR-binding protein 0.026 0.2915 0.9703
Loa Loa (eye worm) hypothetical protein 0.0031 0.0182 0.0605
Echinococcus granulosus serotonin transporter 0.0031 0.0182 0.0299

Activities

No activities found for this compound.

Phenotypes

Whole-cell/tissue/organism interactions

We have no records of whole-cell/tissue assays done with this compound What does this mean?

Many chemical entities in TDR Targets come from high-throughput screenings with whole cells or tissue samples, and not all assayed compounds have been tested against a single a single target protein, probably because they get ruled out during screening process. Even if these compounds may have not been of interest in the original screening, they may come as interesting leads for other screening assays. Furthermore, we may be able to propose drug-target associations using chemical similarities and network patterns.

Annotated phenotypes:

We have no manually annotated phenotypes for this drug. What does this mean? / Care to help?
In TDR Targets, information about phenotypes that are caused by drugs, or by genetic manipulation of cells (e.g. gene knockouts or knockdowns) is manually curated from the literature. These descriptions help to describe the potential of the target for drug development. If no information is available for this gene or if the information is incomplete, this may mean that i) the papers containing this information either appeared after the curation effort for this organism was carried out or they were inadvertently missed by curators; or that ii) the curation effort for this organism has not yet started.
 
In any case, if you have information about papers containing relevant validation data for this target, please log in using your TDR Targets username and password and send them to us using the corresponding form in this page (only visible to registered users) or contact us.

External resources for this compound

Bibliographic References

No literature references available for this target.

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