Detailed information for compound 843142

Basic information

Technical information
  • TDR Targets ID: 843142
  • Name: N-(4-chlorophenyl)-2-[(3-methyl-4-oxo-[1]benz oxolo[3,2-d]pyrimidin-2-yl)sulfanyl]acetamide
  • MW: 399.851 | Formula: C19H14ClN3O3S
  • H donors: 1 H acceptors: 2 LogP: 4.09 Rotable bonds: 5
    Rule of 5 violations (Lipinski): 1
  • SMILES: O=C(Nc1ccc(cc1)Cl)CSc1nc2c3ccccc3oc2c(=O)n1C
  • InChi: 1S/C19H14ClN3O3S/c1-23-18(25)17-16(13-4-2-3-5-14(13)26-17)22-19(23)27-10-15(24)21-12-8-6-11(20)7-9-12/h2-9H,10H2,1H3,(H,21,24)
  • InChiKey: ZNLSWNMDAXXDQB-UHFFFAOYSA-N  


Substructure search Similarity search

Network

Hover on a compound node to display the structore

Synonyms

  • N-(4-chlorophenyl)-2-(3-methyl-4-oxo-benzofurano[3,2-d]pyrimidin-2-yl)sulfanyl-acetamide
  • N-(4-chlorophenyl)-2-[(3-methyl-4-oxo-2-benzofurano[3,2-d]pyrimidinyl)thio]acetamide
  • N-(4-chlorophenyl)-2-[(4-keto-3-methyl-benzofurano[3,2-d]pyrimidin-2-yl)thio]acetamide
  • N-(4-chlorophenyl)-2-[(3-methyl-4-oxo-[1]benzoxolo[3,2-d]pyrimidin-2-yl)sulfanyl]ethanamide

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
Echinococcus granulosus muscleblind protein 0.0275 0.8156 0.8156
Echinococcus granulosus GPCR family 2 0.0031 0.0434 0.0434
Mycobacterium ulcerans aldehyde dehydrogenase 0.0057 0.1239 1
Echinococcus multilocularis endonuclease exonuclease phosphatase 0.0205 0.5938 0.5938
Loa Loa (eye worm) intermediate filament tail domain-containing protein 0.0025 0.023 0.0258
Schistosoma mansoni tar DNA-binding protein 0.0123 0.334 0.334
Echinococcus multilocularis cadherin EGF LAG seven pass G type receptor 0.0031 0.0434 0.0434
Plasmodium falciparum ataxin-2 like protein, putative 0.005 0.1027 1
Mycobacterium tuberculosis Probable aldehyde dehydrogenase 0.0057 0.1239 1
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0042 0.0778 0.0778
Schistosoma mansoni sex comb on midleg homolog 0.0051 0.1064 0.1064
Wolbachia endosymbiont of Brugia malayi exonuclease III 0.0018 0 0.5
Echinococcus granulosus aldehyde dehydrogenase mitochondrial 0.0057 0.1239 0.1239
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0099 0.2574 0.2882
Brugia malayi latrophilin 2 splice variant baaae 0.0068 0.1584 0.1773
Echinococcus multilocularis lamin dm0 0.0025 0.023 0.023
Brugia malayi Latrophilin receptor protein 2 0.0031 0.0434 0.0486
Onchocerca volvulus 0.0044 0.085 0.0713
Schistosoma mansoni tar DNA-binding protein 0.0123 0.334 0.334
Echinococcus multilocularis aldehyde dehydrogenase, mitochondrial 0.0057 0.1239 0.1239
Loa Loa (eye worm) hypothetical protein 0.03 0.8931 1
Schistosoma mansoni hypothetical protein 0.0315 0.9401 0.9401
Loa Loa (eye worm) hypothetical protein 0.0113 0.3016 0.3377
Echinococcus granulosus tar DNA binding protein 0.0123 0.334 0.334
Brugia malayi mbt repeat family protein 0.0051 0.1064 0.1191
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0042 0.0778 0.0778
Loa Loa (eye worm) MBCTL1 0.0058 0.1288 0.1442
Echinococcus multilocularis survival motor neuron protein 1 0.0218 0.6339 0.6339
Brugia malayi Calcitonin receptor-like protein seb-1 0.0099 0.2574 0.2882
Loa Loa (eye worm) hypothetical protein 0.005 0.1027 0.1149
Schistosoma mansoni sex comb on midleg homolog 0.0051 0.1064 0.1064
Echinococcus multilocularis histone acetyltransferase MYST2 0.0058 0.1288 0.1288
Echinococcus granulosus Ataxin 2 N terminaldomain containing protein 0.0022 0.0154 0.0154
Brugia malayi N-terminal motif family protein 0.0164 0.4637 0.5192
Onchocerca volvulus Huntingtin homolog 0.0113 0.3016 0.3202
Brugia malayi hypothetical protein 0.03 0.8931 1
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0042 0.0778 0.0778
Brugia malayi C2-HC type zinc finger protein C.e-MyT1 0.0058 0.1288 0.1442
Echinococcus multilocularis geminin 0.0334 1 1
Echinococcus granulosus lamin 0.0025 0.023 0.023
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.0123 0.334 0.3739
Echinococcus granulosus histone acetyltransferase MYST2 0.0058 0.1288 0.1288
Toxoplasma gondii aldehyde dehydrogenase 0.0057 0.1239 1
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0042 0.0778 0.0778
Trichomonas vaginalis ap endonuclease, putative 0.0018 0 0.5
Echinococcus granulosus cadherin EGF LAG seven pass G type receptor 0.0031 0.0434 0.0434
Brugia malayi Muscleblind-like protein 0.0275 0.8156 0.9133
Schistosoma mansoni lamin 0.0025 0.023 0.023
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.0031 0.0434 0.0486
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0042 0.0778 0.0778
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0099 0.2574 0.2882
Brugia malayi Iron-sulfur cluster assembly accessory protein 0.0044 0.085 0.0952
Loa Loa (eye worm) hypothetical protein 0.0058 0.1288 0.1442
Brugia malayi hypothetical protein 0.0218 0.6339 0.7097
Loa Loa (eye worm) hypothetical protein 0.0068 0.1584 0.1773
Brugia malayi intermediate filament protein 0.0025 0.023 0.0258
Loa Loa (eye worm) hypothetical protein 0.0025 0.023 0.0258
Leishmania major aldehyde dehydrogenase, mitochondrial precursor 0.0057 0.1239 1
Echinococcus multilocularis suppression of tumorigenicity 18 protein 0.0058 0.1288 0.1288
Schistosoma mansoni intermediate filament proteins 0.0025 0.023 0.023
Echinococcus granulosus endonuclease exonuclease phosphatase 0.0205 0.5938 0.5938
Echinococcus multilocularis muscleblind protein 1 0.0275 0.8156 0.8156
Schistosoma mansoni tar DNA-binding protein 0.0123 0.334 0.334
Brugia malayi TAR-binding protein 0.0123 0.334 0.3739
Schistosoma mansoni hypothetical protein 0.0334 1 1
Echinococcus granulosus survival motor neuron protein 1 0.0218 0.6339 0.6339
Echinococcus granulosus SAM and MBT domain containing protein 0.0051 0.1064 0.1064
Loa Loa (eye worm) hypothetical protein 0.0051 0.1064 0.1191
Echinococcus multilocularis muscleblind protein 0.0275 0.8156 0.8156
Brugia malayi hypothetical protein 0.005 0.1027 0.1149
Onchocerca volvulus 0.0051 0.1064 0.0958
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.0031 0.0434 0.0434
Onchocerca volvulus Rap guanine nucleotide exchange factor 1 homolog 0.0164 0.4637 0.5064
Trypanosoma cruzi PAB1-binding protein , putative 0.005 0.1027 1
Echinococcus multilocularis Ataxin 2, N terminal,domain containing protein 0.0022 0.0154 0.0154
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0042 0.0778 0.0871
Treponema pallidum exodeoxyribonuclease (exoA) 0.0018 0 0.5
Loa Loa (eye worm) RNA binding protein 0.0123 0.334 0.3739
Schistosoma mansoni lamin 0.0025 0.023 0.023
Brugia malayi RNA binding protein 0.0123 0.334 0.3739
Plasmodium falciparum ataxin-2 like protein, putative 0.005 0.1027 1
Entamoeba histolytica exodeoxyribonuclease III, putative 0.0018 0 0.5
Toxoplasma gondii LsmAD domain-containing protein 0.005 0.1027 0.8286
Onchocerca volvulus 0.03 0.8931 1
Echinococcus multilocularis tar DNA binding protein 0.0123 0.334 0.334
Schistosoma mansoni hypothetical protein 0.0044 0.085 0.085
Brugia malayi mbt repeat family protein 0.0051 0.1064 0.1191
Loa Loa (eye worm) TAR-binding protein 0.0123 0.334 0.3739
Trichomonas vaginalis ap endonuclease, putative 0.0018 0 0.5
Echinococcus multilocularis GPCR, family 2 0.0031 0.0434 0.0434
Trypanosoma brucei PAB1-binding protein , putative 0.005 0.1027 1
Echinococcus multilocularis musashi 0.0025 0.023 0.023
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0042 0.0778 0.0778
Schistosoma mansoni hypothetical protein 0.0031 0.0434 0.0434
Trypanosoma cruzi PAB1-binding protein , putative 0.005 0.1027 1
Brugia malayi hypothetical protein 0.0113 0.3016 0.3377
Schistosoma mansoni hypothetical protein 0.0334 1 1
Loa Loa (eye worm) hypothetical protein 0.0275 0.8156 0.9133
Schistosoma mansoni tar DNA-binding protein 0.0123 0.334 0.334
Echinococcus multilocularis polycomb protein SCMH1 0.0051 0.1064 0.1064
Loa Loa (eye worm) hypothetical protein 0.0031 0.0434 0.0486
Schistosoma mansoni hypothetical protein 0.0031 0.0434 0.0434
Echinococcus granulosus suppression of tumorigenicity 18 protein 0.0058 0.1288 0.1288
Echinococcus granulosus intermediate filament protein 0.0025 0.023 0.023
Mycobacterium ulcerans aldehyde dehydrogenase 0.0057 0.1239 1
Schistosoma mansoni hypothetical protein 0.0031 0.0434 0.0434
Brugia malayi hypothetical protein 0.0032 0.0466 0.0521
Onchocerca volvulus Polycomb protein Sfmbt homolog 0.0051 0.1064 0.0958
Loa Loa (eye worm) hypothetical protein 0.0218 0.6339 0.7097
Loa Loa (eye worm) mbt repeat family protein 0.0051 0.1064 0.1191
Plasmodium vivax ataxin-2 like protein, putative 0.005 0.1027 1
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0042 0.0778 0.0778
Leishmania major hypothetical protein, conserved 0.005 0.1027 0.8286
Echinococcus granulosus polycomb protein SCMH1 0.0051 0.1064 0.1064
Schistosoma mansoni myelin transcription factor 1 myt1 0.0058 0.1288 0.1288
Echinococcus multilocularis lamin 0.0025 0.023 0.023
Mycobacterium ulcerans aldehyde dehydrogenase 0.0057 0.1239 1
Loa Loa (eye worm) hypothetical protein 0.0024 0.0216 0.0242
Onchocerca volvulus Huntingtin homolog 0.0113 0.3016 0.3202
Loa Loa (eye worm) latrophilin receptor protein 2 0.0031 0.0434 0.0486
Loa Loa (eye worm) intermediate filament protein 0.0025 0.023 0.0258
Schistosoma mansoni hypothetical protein 0.0022 0.0154 0.0154
Loa Loa (eye worm) hypothetical protein 0.0099 0.2574 0.2882
Schistosoma mansoni scm-relatedprotein containing 4 mbt domains (sfmbt) 0.0051 0.1064 0.1064
Schistosoma mansoni tar DNA-binding protein 0.0123 0.334 0.334
Echinococcus granulosus lamin dm0 0.0025 0.023 0.023
Echinococcus multilocularis SAM and MBT domain containing protein 0.0051 0.1064 0.1064
Schistosoma mansoni hypothetical protein 0.0068 0.1584 0.1584
Loa Loa (eye worm) hypothetical protein 0.0275 0.8156 0.9133
Schistosoma mansoni aldehyde dehydrogenase 0.0057 0.1239 0.1239
Brugia malayi Intermediate filament tail domain containing protein 0.0025 0.023 0.0258
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0042 0.0778 0.0871
Schistosoma mansoni survival motor neuron protein 0.0044 0.085 0.085
Loa Loa (eye worm) hypothetical protein 0.0113 0.3016 0.3377
Brugia malayi RNA recognition motif domain containing protein 0.0123 0.334 0.3739
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.0031 0.0434 0.0434
Loa Loa (eye worm) hypothetical protein 0.0164 0.4637 0.5192
Schistosoma mansoni hypothetical protein 0.0031 0.0434 0.0434
Giardia lamblia Endonuclease/Exonuclease/phosphatase 0.0018 0 0.5
Schistosoma mansoni aldehyde dehydrogenase 0.0057 0.1239 0.1239

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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