Detailed information for compound 827900

Basic information

Technical information
  • TDR Targets ID: 827900
  • Name: 3-(4-chlorophenyl)sulfonyl-8-methoxychromen-2 -one
  • MW: 350.774 | Formula: C16H11ClO5S
  • H donors: 0 H acceptors: 3 LogP: 3.51 Rotable bonds: 3
    Rule of 5 violations (Lipinski): 1
  • SMILES: COc1cccc2c1oc(=O)c(c2)S(=O)(=O)c1ccc(cc1)Cl
  • InChi: 1S/C16H11ClO5S/c1-21-13-4-2-3-10-9-14(16(18)22-15(10)13)23(19,20)12-7-5-11(17)6-8-12/h2-9H,1H3
  • InChiKey: FREPZYUXWFCKLK-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • 3-(4-chlorophenyl)sulfonyl-8-methoxy-chromen-2-one
  • 3-(4-chlorophenyl)sulfonyl-8-methoxy-2-chromenone
  • 3-(4-chlorophenyl)sulfonyl-8-methoxy-coumarin
  • IDI1_027990
  • T5432546
  • ZINC02687244
  • ChemDiv3_010080

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
Brugia malayi Latrophilin receptor protein 2 0.0016 0.0202 0.0098
Echinococcus granulosus tar DNA binding protein 0.0066 0.3691 0.3691
Brugia malayi Intermediate filament tail domain containing protein 0.0028 0.1023 0.0928
Brugia malayi intermediate filament protein 0.0028 0.1023 0.0928
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.0066 0.3691 0.3691
Mycobacterium leprae PROBABLE ATP-DEPENDENT CLP PROTEASE PROTEOLYTIC SUBUNIT 2 CLPP2 (ENDOPEPTIDASE CLP 2) 0.0081 0.478 1
Echinococcus granulosus GPCR family 2 0.0016 0.0202 0.0202
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.0016 0.0202 0.0098
Echinococcus multilocularis lamin dm0 0.0028 0.1023 0.1023
Echinococcus multilocularis muscleblind protein 1 0.0155 1 1
Toxoplasma gondii ATP-dependent Clp endopeptidase, proteolytic subunit ClpP domain-containing protein 0.0081 0.478 1
Loa Loa (eye worm) hypothetical protein 0.0027 0.0987 0.0987
Loa Loa (eye worm) intermediate filament tail domain-containing protein 0.0028 0.1023 0.1023
Loa Loa (eye worm) transcription factor SMAD2 0.0124 0.78 0.78
Plasmodium falciparum ATP-dependent Clp protease proteolytic subunit 0.0081 0.478 1
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0047 0.24 0.24
Echinococcus granulosus intermediate filament protein 0.0028 0.1023 0.1023
Schistosoma mansoni intermediate filament proteins 0.0028 0.1023 0.1793
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0052 0.2701 0.2701
Toxoplasma gondii ATP-dependent Clp endopeptidase, proteolytic subunit ClpP domain-containing protein 0.0081 0.478 1
Schistosoma mansoni tar DNA-binding protein 0.0066 0.3691 0.762
Loa Loa (eye worm) TAR-binding protein 0.0066 0.3691 0.3691
Echinococcus granulosus lamin dm0 0.0028 0.1023 0.1023
Echinococcus multilocularis ATP dependent Clp protease proteolytic subunit 0.0081 0.478 0.478
Schistosoma mansoni lamin 0.0028 0.1023 0.1793
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0047 0.24 0.2319
Loa Loa (eye worm) hypothetical protein 0.0035 0.1545 0.1545
Schistosoma mansoni lamin 0.0028 0.1023 0.1793
Echinococcus granulosus ATP dependent Clp protease proteolytic subunit 0.0081 0.478 0.478
Mycobacterium ulcerans ATP-dependent Clp protease proteolytic subunit 0.0081 0.478 0.5
Loa Loa (eye worm) latrophilin receptor protein 2 0.0016 0.0202 0.0202
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0047 0.24 0.24
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0052 0.2701 0.2624
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0047 0.24 0.24
Loa Loa (eye worm) hypothetical protein 0.0028 0.1023 0.1023
Echinococcus multilocularis peptidase Clp (S14 family) 0.0053 0.2805 0.2805
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.0016 0.0202 0.0202
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0047 0.24 0.48
Loa Loa (eye worm) hypothetical protein 0.0155 1 1
Brugia malayi RNA recognition motif domain containing protein 0.0066 0.3691 0.3624
Echinococcus granulosus lamin 0.0028 0.1023 0.1023
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.0016 0.0202 0.0202
Schistosoma mansoni tar DNA-binding protein 0.0066 0.3691 0.762
Chlamydia trachomatis ATP-dependent Clp protease proteolytic subunit 0.0081 0.478 0.5
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0047 0.24 0.48
Schistosoma mansoni tar DNA-binding protein 0.0066 0.3691 0.762
Echinococcus multilocularis musashi 0.0028 0.1023 0.1023
Loa Loa (eye worm) hypothetical protein 0.0016 0.0202 0.0202
Echinococcus granulosus muscleblind protein 0.0155 1 1
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0047 0.24 0.48
Loa Loa (eye worm) MH2 domain-containing protein 0.0124 0.78 0.78
Echinococcus multilocularis muscleblind protein 0.0155 1 1
Brugia malayi latrophilin 2 splice variant baaae 0.0035 0.1545 0.1455
Mycobacterium leprae PROBABLE ATP-DEPENDENT CLP PROTEASE PROTEOLYTIC SUBUNIT 1 CLPP1 (ENDOPEPTIDASE CLP) 0.0053 0.2805 0.4744
Loa Loa (eye worm) hypothetical protein 0.0052 0.2701 0.2701
Schistosoma mansoni peptidase Clp (S14 family) 0.0081 0.478 1
Plasmodium vivax ATP-dependent Clp protease proteolytic subunit, putative 0.0081 0.478 1
Chlamydia trachomatis ATP-dependent Clp protease proteolytic subunit 0.0081 0.478 0.5
Echinococcus granulosus peptidase Clp S14 family 0.0053 0.2805 0.2805
Brugia malayi Calcitonin receptor-like protein seb-1 0.0052 0.2701 0.2624
Onchocerca volvulus 0.0028 0.1023 0.5
Loa Loa (eye worm) cytoplasmic intermediate filament protein 0.0015 0.0105 0.0105
Loa Loa (eye worm) hypothetical protein 0.0081 0.478 0.478
Mycobacterium tuberculosis Probable ATP-dependent CLP protease proteolytic subunit 2 ClpP2 (endopeptidase CLP 2) 0.0053 0.2805 0.5
Treponema pallidum ATP-dependent Clp protease proteolytic subunit 0.0081 0.478 1
Schistosoma mansoni tar DNA-binding protein 0.0066 0.3691 0.762
Brugia malayi TAR-binding protein 0.0066 0.3691 0.3624
Schistosoma mansoni tar DNA-binding protein 0.0066 0.3691 0.762
Schistosoma mansoni hypothetical protein 0.0035 0.1545 0.2932
Wolbachia endosymbiont of Brugia malayi ATP-dependent Clp protease proteolytic subunit 0.0081 0.478 0.5
Echinococcus multilocularis cadherin EGF LAG seven pass G type receptor 0.0016 0.0202 0.0202
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0047 0.24 0.24
Echinococcus granulosus cadherin EGF LAG seven pass G type receptor 0.0016 0.0202 0.0202
Echinococcus multilocularis tar DNA binding protein 0.0066 0.3691 0.3691
Brugia malayi Probable ClpP-like protease 0.0081 0.478 0.4725
Loa Loa (eye worm) intermediate filament protein 0.0028 0.1023 0.1023
Loa Loa (eye worm) RNA binding protein 0.0066 0.3691 0.3691
Onchocerca volvulus 0.0028 0.1023 0.5
Echinococcus multilocularis lamin 0.0028 0.1023 0.1023
Loa Loa (eye worm) hypothetical protein 0.0155 1 1
Brugia malayi RNA binding protein 0.0066 0.3691 0.3624
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0047 0.24 0.24
Mycobacterium ulcerans ATP-dependent Clp protease proteolytic subunit 0.0081 0.478 0.5
Brugia malayi MH2 domain containing protein 0.0124 0.78 0.7777
Mycobacterium tuberculosis Probable ATP-dependent CLP protease proteolytic subunit 1 ClpP1 (endopeptidase CLP) 0.0053 0.2805 0.5
Echinococcus multilocularis GPCR, family 2 0.0016 0.0202 0.0202

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.
 
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External resources for this compound

Bibliographic References

No literature references available for this target.

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