Detailed information for compound 1452870

Basic information

Technical information
  • TDR Targets ID: 1452870
  • Name: 1-(6-methoxynaphthalen-2-yl)sulfonyl-4-methyl imidazole
  • MW: 302.348 | Formula: C15H14N2O3S
  • H donors: 0 H acceptors: 3 LogP: 2.86 Rotable bonds: 3
    Rule of 5 violations (Lipinski): 1
  • SMILES: COc1ccc2c(c1)ccc(c2)S(=O)(=O)n1cnc(c1)C
  • InChi: 1S/C15H14N2O3S/c1-11-9-17(10-16-11)21(18,19)15-6-4-12-7-14(20-2)5-3-13(12)8-15/h3-10H,1-2H3
  • InChiKey: KNEZOBAWQIUJDD-UHFFFAOYSA-N  


Substructure search Similarity search

Network

Hover on a compound node to display the structore

Synonyms

  • 1-[(6-methoxy-2-naphthyl)sulfonyl]-4-methyl-imidazole
  • 1-[(6-methoxy-2-naphthyl)sulfonyl]-4-methylimidazole
  • 1-(6-methoxynaphthalen-2-yl)sulfonyl-4-methyl-imidazole
  • STOCK1S-93317
  • Oprea1_395002
  • 1-(6-Methoxy-naphthalene-2-sulfonyl)-4-methyl-1H-imidazole
  • BAS 01126494
  • MLS000715873
  • SMR000277390
  • Oprea1_078284

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 multilocularis musashi 0.0032 0.5124 0.5124
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0034 0.5643 0.5583
Echinococcus multilocularis FTZ F1 alpha 0.0034 0.5643 0.5643
Schistosoma mansoni retinoic acid receptor RXR 0.0034 0.5643 0.5583
Brugia malayi Steroid receptor seven-up type 2 0.0034 0.5643 0.5583
Loa Loa (eye worm) intermediate filament protein 0.0032 0.5124 0.5124
Echinococcus multilocularis Nuclear hormone receptor family member nhr 41 0.0034 0.5643 0.5643
Schistosoma mansoni retinoid-x-receptor (RXR) 0.0034 0.5643 0.5583
Schistosoma mansoni high voltage-activated calcium channel Cav2A 0.0048 1 1
Onchocerca volvulus 0.0034 0.5643 1
Loa Loa (eye worm) hypothetical protein 0.0048 1 1
Schistosoma mansoni FTZ-F1 nuclear receptor-like protein 0.0034 0.5643 0.5583
Loa Loa (eye worm) nuclear hormone receptor family member nhr-14 0.0034 0.5643 0.5643
Echinococcus granulosus voltage dependent calcium channel type d subunit|voltage dependent calcium channel|voltage dependent L type calcium channel subu 0.0048 1 1
Schistosoma mansoni thyroid hormone receptor 0.0034 0.5643 0.5583
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0034 0.5643 0.5643
Loa Loa (eye worm) nuclear receptor nhr-7B 0.0016 0.0137 0.0137
Brugia malayi hypothetical protein 0.0018 0.0726 0.0598
Loa Loa (eye worm) hypothetical protein 0.0016 0.0137 0.0137
Echinococcus granulosus Nuclear hormone receptor HR96 0.0016 0.0137 0.0137
Loa Loa (eye worm) hypothetical protein 0.0016 0.0137 0.0137
Echinococcus granulosus nuclear receptor nhr 48 0.0016 0.0137 0.0137
Echinococcus multilocularis lamin dm0 0.0032 0.5124 0.5124
Brugia malayi Nuclear hormone receptor family member nhr-40 0.0034 0.5643 0.5583
Brugia malayi hypothetical protein 0.0018 0.0726 0.0598
Loa Loa (eye worm) hypothetical protein 0.0032 0.4943 0.4943
Brugia malayi nuclear receptor NHR-88 0.0034 0.5643 0.5583
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0034 0.5643 0.5583
Echinococcus granulosus nuclear receptor subfamily 4 group A 0.0016 0.0137 0.0137
Loa Loa (eye worm) CYP4Cod1 0.0028 0.3794 0.3794
Loa Loa (eye worm) intermediate filament tail domain-containing protein 0.0032 0.5124 0.5124
Echinococcus granulosus Nuclear hormone receptor family member nhr 41 0.0034 0.5643 0.5643
Echinococcus multilocularis Nuclear hormone receptor HR96 0.0016 0.0137 0.0137
Brugia malayi Nuclear hormone receptor-like 1 0.0018 0.0726 0.0598
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0034 0.5643 0.5643
Schistosoma mansoni nuclear hormone receptor nor-1/nor-2 0.0034 0.5643 0.5583
Echinococcus granulosus FTZ F1 nuclear receptor protein 0.0034 0.5643 0.5643
Loa Loa (eye worm) nuclear hormone receptor family member nhr-40 0.0034 0.5643 0.5643
Loa Loa (eye worm) hypothetical protein 0.0016 0.0137 0.0137
Echinococcus granulosus COUP TF:Svp nuclear hormone receptor 0.0034 0.5643 0.5643
Echinococcus multilocularis lamin 0.0032 0.5124 0.5124
Loa Loa (eye worm) calcium channel 0.0048 1 1
Echinococcus multilocularis voltage dependent L type calcium channel subunit 0.0048 1 1
Loa Loa (eye worm) hypothetical protein 0.0034 0.5643 0.5643
Loa Loa (eye worm) hypothetical protein 0.0016 0.0137 0.0137
Loa Loa (eye worm) hypothetical protein 0.0034 0.5643 0.5643
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0034 0.5643 0.5583
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0016 0.0137 0.0137
Echinococcus multilocularis voltage dependent L type calcium channel subunit 0.0048 1 1
Onchocerca volvulus Bile acid receptor homolog 0.0034 0.5643 1
Echinococcus multilocularis voltage dependent calcium channel type d subunit 0.0048 1 1
Loa Loa (eye worm) hypothetical protein 0.0032 0.5124 0.5124
Loa Loa (eye worm) hypothetical protein 0.0016 0.0137 0.0137
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0034 0.5643 0.5583
Echinococcus granulosus Nuclear hormone receptor HR96 0.0016 0.0137 0.0137
Echinococcus multilocularis ecdysone induced protein 78C 0.0034 0.5643 0.5643
Echinococcus granulosus thyroid hormone receptor alpha 0.0016 0.0137 0.0137
Brugia malayi Nuclear hormone receptor family member nhr-3 0.0034 0.5643 0.5583
Brugia malayi photoreceptor-specific nuclear receptor 0.0034 0.5643 0.5583
Echinococcus multilocularis voltage dependent calcium channel 0.0048 1 1
Loa Loa (eye worm) hypothetical protein 0.0034 0.5643 0.5643
Loa Loa (eye worm) hypothetical protein 0.0034 0.5643 0.5643
Loa Loa (eye worm) hypothetical protein 0.0016 0.0137 0.0137
Loa Loa (eye worm) cytochrome P450 family protein 0.0028 0.3794 0.3794
Onchocerca volvulus Steroid hormone receptor family member cnr14 homolog 0.0034 0.5643 1
Loa Loa (eye worm) nuclear hormone receptor family member nhr-31 0.0034 0.5643 0.5643
Loa Loa (eye worm) hypothetical protein 0.0016 0.0137 0.0137
Brugia malayi cytoplasmic intermediate filament protein 0.0017 0.0526 0.0394
Echinococcus granulosus voltage dependent calcium channel type d subunit|voltage dependent calcium channel alpha 1 0.0048 1 1
Loa Loa (eye worm) hypothetical protein 0.0016 0.0137 0.0137
Schistosoma mansoni coup transcription factor 0.0034 0.5643 0.5583
Loa Loa (eye worm) hypothetical protein 0.0018 0.0726 0.0726
Loa Loa (eye worm) hypothetical protein 0.0042 0.8217 0.8217
Schistosoma mansoni lamin 0.0032 0.5124 0.5057
Echinococcus granulosus voltage dependent calcium channel 0.0048 1 1
Brugia malayi Nuclear hormone receptor-like 1 0.0034 0.5643 0.5583
Brugia malayi Nuclear hormone receptor family member nhr-49 0.0034 0.5643 0.5583
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0034 0.5643 0.5643
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0034 0.5643 0.5583
Onchocerca volvulus 0.0032 0.5124 0.9058
Loa Loa (eye worm) hypothetical protein 0.0034 0.5643 0.5643
Schistosoma mansoni Tr4/Tr2 (homologue) 0.0034 0.5643 0.5583
Brugia malayi Nuclear hormone receptor family member nhr-1 0.0034 0.5643 0.5583
Echinococcus granulosus retinoic acid receptor rxr beta a 0.0034 0.5643 0.5643
Mycobacterium ulcerans cytochrome P450 185A4 Cyp185A4 0.0028 0.3794 0.5
Loa Loa (eye worm) hypothetical protein 0.0016 0.0137 0.0137
Loa Loa (eye worm) cytochrome P450 family protein 0.0028 0.3794 0.3794
Brugia malayi Intermediate filament tail domain containing protein 0.0032 0.5124 0.5057
Brugia malayi Nuclear hormone receptor family member nhr-31 0.0034 0.5643 0.5583
Schistosoma mansoni nuclear hormone receptor 0.0034 0.5643 0.5583
Schistosoma mansoni RAR-like nuclear receptor 0.0034 0.5643 0.5583
Echinococcus granulosus nuclear receptor subfamily 1 group D 0.0018 0.0726 0.0726
Loa Loa (eye worm) cytoplasmic intermediate filament protein 0.0017 0.0526 0.0526
Loa Loa (eye worm) nuclear hormone receptor-like 1 0.0018 0.0726 0.0726
Trypanosoma cruzi Voltage-dependent calcium channel subunit, putative 0.0048 1 1
Echinococcus granulosus lamin dm0 0.0032 0.5124 0.5124
Loa Loa (eye worm) hypothetical protein 0.002 0.1327 0.1327
Echinococcus multilocularis FTZ F1 nuclear receptor protein 0.0034 0.5643 0.5643
Loa Loa (eye worm) nuclear Hormone Receptor family member 0.0034 0.5643 0.5643
Loa Loa (eye worm) DR-78 0.0016 0.0137 0.0137
Brugia malayi Nuclear hormone receptor-like 1 0.0018 0.0726 0.0598
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0016 0.0137 0.0137
Leishmania major cytochrome p450-like protein 0.0028 0.3794 0.5
Echinococcus multilocularis hepatocyte nuclear factor 4 alpha 0.0034 0.5643 0.5643
Brugia malayi intermediate filament protein 0.0032 0.5124 0.5057
Brugia malayi Cytochrome P450 family protein 0.0028 0.3794 0.3708
Loa Loa (eye worm) hypothetical protein 0.0018 0.0726 0.0726
Toxoplasma gondii transporter, cation channel family protein 0.0048 1 1
Loa Loa (eye worm) steroid hormone receptor 0.0034 0.5643 0.5643
Echinococcus multilocularis nuclear receptor subfamily 1 group D 0.0018 0.0726 0.0726
Brugia malayi Cytochrome P450 family protein 0.0028 0.3794 0.3708
Trypanosoma brucei Voltage-dependent calcium channel subunit, putative 0.0048 1 1
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0034 0.5643 0.5583
Echinococcus multilocularis nuclear receptor nhr 48 0.0016 0.0137 0.0137
Schistosoma mansoni intermediate filament proteins 0.0032 0.5124 0.5057
Loa Loa (eye worm) hypothetical protein 0.0048 1 1
Loa Loa (eye worm) nuclear hormone receptor family member nhr-41 0.0034 0.5643 0.5643
Loa Loa (eye worm) hypothetical protein 0.0016 0.0137 0.0137
Loa Loa (eye worm) hypothetical protein 0.0042 0.8217 0.8217
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0034 0.5643 0.5643
Loa Loa (eye worm) hypothetical protein 0.0016 0.0137 0.0137
Schistosoma mansoni high voltage-activated calcium channel Cav1 0.0048 1 1
Brugia malayi steroid hormone receptor 0.0034 0.5643 0.5583
Brugia malayi Nuclear hormone receptor family member nhr-41 0.0034 0.5643 0.5583
Loa Loa (eye worm) nuclear hormone receptor family member nhr-1 0.0034 0.5643 0.5643
Loa Loa (eye worm) nuclear hormone receptor family member nhr-49 0.0034 0.5643 0.5643
Echinococcus multilocularis voltage dependent calcium channel type d subunit 0.0048 1 1
Loa Loa (eye worm) nuclear hormone receptor 0.0016 0.0137 0.0137
Echinococcus granulosus hepatocyte nuclear factor 4 alpha 0.0034 0.5643 0.5643
Echinococcus granulosus lamin 0.0032 0.5124 0.5124
Onchocerca volvulus 0.0032 0.5124 0.9058
Echinococcus granulosus FTZ F1 alpha 0.0034 0.5643 0.5643
Loa Loa (eye worm) hypothetical protein 0.0016 0.0137 0.0137
Loa Loa (eye worm) nuclear receptor NHR-67 0.0016 0.0137 0.0137
Schistosoma mansoni thyroid hormone receptor 0.0034 0.5643 0.5583
Echinococcus granulosus ecdysone induced protein 78C 0.0034 0.5643 0.5643
Echinococcus multilocularis COUP TF:Svp nuclear hormone receptor 0.0034 0.5643 0.5643
Echinococcus multilocularis nuclear receptor subfamily 4 group A 0.0016 0.0137 0.0137
Brugia malayi nuclear receptor RXR 0.0018 0.0726 0.0598
Loa Loa (eye worm) voltage-dependent calcium channel 0.0048 1 1
Loa Loa (eye worm) hypothetical protein 0.0034 0.5643 0.5643
Schistosoma mansoni voltage-gated cation channel 0.0048 1 1
Echinococcus granulosus voltage dependent calcium channel 0.0048 1 1
Echinococcus granulosus intermediate filament protein 0.0032 0.5124 0.5124
Loa Loa (eye worm) hypothetical protein 0.0034 0.5643 0.5643
Schistosoma mansoni ecdysone-induced protein 78c (dr-78) 0.0018 0.0726 0.0598
Loa Loa (eye worm) hypothetical protein 0.0018 0.0726 0.0726
Echinococcus multilocularis retinoic acid receptor rxr beta a retinoic acid receptor rxr alpha a retinoic acid receptor rxr alpha 0.0016 0.0137 0.0137
Schistosoma mansoni retinoid-x-receptor (RXR) 0.0018 0.0726 0.0598
Onchocerca volvulus Protein ultraspiracle homolog 0.0034 0.5643 1
Loa Loa (eye worm) hypothetical protein 0.0018 0.0726 0.0726
Schistosoma mansoni nuclear receptor 2DBD-gamma 0.0034 0.5643 0.5583
Brugia malayi nuclear hormone receptor 0.0034 0.5643 0.5583
Brugia malayi ecdysteroid receptor 0.0034 0.5643 0.5583
Echinococcus multilocularis Nuclear hormone receptor HR96 0.0016 0.0137 0.0137
Echinococcus granulosus voltage dependent L type calcium channel subunit|voltage dependent calcium channel 0.0048 1 1
Echinococcus multilocularis thyroid hormone receptor alpha 0.0034 0.5643 0.5643
Brugia malayi Nuclear hormone receptor family member nhr-14 0.0034 0.5643 0.5583
Loa Loa (eye worm) hypothetical protein 0.0016 0.0137 0.0137
Loa Loa (eye worm) hypothetical protein 0.0018 0.0726 0.0726
Echinococcus multilocularis voltage dependent calcium channel 0.0048 1 1
Schistosoma mansoni steroid hormone receptor ad4bp 0.0034 0.5643 0.5583
Loa Loa (eye worm) hypothetical protein 0.0034 0.5643 0.5643
Schistosoma mansoni photoreceptor-specific nuclear receptor related 0.0034 0.5643 0.5583
Schistosoma mansoni lamin 0.0032 0.5124 0.5057

Activities

Activity type Activity value Assay description Source Reference
Potency (functional) 14.7157 uM PUBCHEM_BIOASSAY: Primary qHTS for delayed death inhibitors of the malarial parasite plastid, 96 hour incubation. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488745, AID488752, AID488774, AID504848, AID504850] ChEMBL. No reference
Potency (functional) 21.3313 uM PUBCHEM_BIOASSAY: qHTS profiling assay for firefly luciferase inhibitor/activator using purified enzyme and Km concentrations of substrates (counterscreen for miR-21 project). (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID2288, AID2289, AID2598, AID411] ChEMBL. No reference
Potency (functional) = 35.4813 um PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Human Jumonji Domain Containing 2E (JMJD2E). (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 89.1251 uM PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of BAZ2B. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID504391] ChEMBL. No reference
Potency (functional) 89.1251 uM PUBCHEM_BIOASSAY: qHTS for Inhibitors of Polymerase Iota. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID588623] ChEMBL. No reference

Phenotypes

Whole-cell/tissue/organism interactions

Species name Source Reference Is orphan
Plasmodium falciparum ChEMBL23

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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