Detailed information for compound 619793

Basic information

Technical information
  • TDR Targets ID: 619793
  • Name: 2-(3,4-dimethoxyphenyl)-N-(6-sulfamoyl-1,3-be nzothiazol-2-yl)acetamide
  • MW: 407.464 | Formula: C17H17N3O5S2
  • H donors: 2 H acceptors: 4 LogP: 1.99 Rotable bonds: 7
    Rule of 5 violations (Lipinski): 1
  • SMILES: COc1cc(ccc1OC)CC(=O)Nc1nc2c(s1)cc(cc2)S(=O)(=O)N
  • InChi: 1S/C17H17N3O5S2/c1-24-13-6-3-10(7-14(13)25-2)8-16(21)20-17-19-12-5-4-11(27(18,22)23)9-15(12)26-17/h3-7,9H,8H2,1-2H3,(H2,18,22,23)(H,19,20,21)
  • InChiKey: JPLIBWWIHZPMCF-UHFFFAOYSA-N  


Substructure search Similarity search

Network

Hover on a compound node to display the structore

Synonyms

  • 2-(3,4-dimethoxyphenyl)-N-(6-sulfamoyl-1,3-benzothiazol-2-yl)ethanamide
  • ZINC02694799

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
Trypanosoma cruzi hypothetical protein, conserved 0.0037 0.1011 0.3678
Loa Loa (eye worm) beta-LACTamase domain containing family member 0.0037 0.1011 0.1029
Brugia malayi Melibiase family protein 0.0067 0.237 0.2413
Loa Loa (eye worm) hypothetical protein 0.0037 0.1011 0.1029
Mycobacterium leprae Probable lipase LipE 0.0037 0.1011 0.5
Schistosoma mansoni alpha-galactosidase/alpha-n-acetylgalactosaminidase 0.0101 0.3882 0.6104
Trypanosoma cruzi hypothetical protein, conserved 0.0039 0.1107 0.4028
Brugia malayi Iron-sulfur cluster assembly accessory protein 0.0047 0.148 0.1507
Echinococcus multilocularis gcn5proteinral control of amino acid synthesis 0.0151 0.6136 0.6141
Mycobacterium tuberculosis Probable hydrolase 0.0037 0.1011 0.0761
Treponema pallidum exodeoxyribonuclease (exoA) 0.0021 0.027 0.5
Trypanosoma brucei apurinic/apyrimidinic endonuclease, putative 0.0021 0.027 0.0983
Schistosoma mansoni alpha-galactosidase/alpha-n-acetylgalactosaminidase 0.0101 0.3882 0.6104
Trichomonas vaginalis bromodomain-containing protein, putative 0.0044 0.1341 0.5657
Echinococcus granulosus Ataxin 2 N terminaldomain containing protein 0.0034 0.087 0.0628
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0048 0.1487 0.2056
Leishmania major apurinic/apyrimidinic endonuclease-redox protein 0.0021 0.027 0.0983
Loa Loa (eye worm) hypothetical protein 0.0029 0.0633 0.0645
Loa Loa (eye worm) hypothetical protein 0.0067 0.237 0.2413
Toxoplasma gondii ABC1 family protein 0.0037 0.1011 0.2051
Schistosoma mansoni lamin 0.0029 0.0657 0.0654
Schistosoma mansoni alpha-galactosidase/alpha-n-acetylgalactosaminidase 0.0101 0.3882 0.6104
Trypanosoma cruzi PAB1-binding protein , putative 0.0076 0.2749 1
Toxoplasma gondii histone lysine acetyltransferase GCN5-A 0.0044 0.1341 0.2964
Plasmodium vivax hypothetical protein, conserved 0.0037 0.1011 0.2989
Brugia malayi hypothetical protein 0.0076 0.2749 0.2799
Trichomonas vaginalis maltase-glucoamylase, putative 0.0039 0.1107 0.4672
Brugia malayi hypothetical protein 0.0049 0.1542 0.157
Trichomonas vaginalis ap endonuclease, putative 0.0021 0.027 0.114
Loa Loa (eye worm) beta-lactamase 0.0037 0.1011 0.1029
Trichomonas vaginalis D-aminoacylase, putative 0.0037 0.1011 0.4266
Mycobacterium ulcerans lipase LipD 0.0037 0.1011 0.3896
Loa Loa (eye worm) hypothetical protein 0.0037 0.1011 0.1029
Trichomonas vaginalis sucrase-isomaltase, putative 0.0039 0.1107 0.4672
Brugia malayi beta-lactamase family protein 0.0037 0.1011 0.1029
Trichomonas vaginalis alpha-glucosidase, putative 0.0039 0.1107 0.4672
Echinococcus granulosus 3 hydroxyacyl coenzyme A dehydrogenase type 2 0.0063 0.2172 0.1991
Brugia malayi 3-hydroxyacyl-CoA dehydrogenase type II 0.0063 0.2172 0.2211
Trichomonas vaginalis cat eye syndrome critical region protein 2, cscr2, putative 0.0044 0.1341 0.5657
Plasmodium vivax ataxin-2 like protein, putative 0.0076 0.2749 1
Mycobacterium tuberculosis Conserved protein 0.0037 0.1011 0.0761
Mycobacterium tuberculosis Probable esterase/lipase LipP 0.0037 0.1011 0.0761
Mycobacterium ulcerans short-chain type dehydrogenase/reductase 0.0063 0.2172 1
Trypanosoma brucei hypothetical protein, conserved 0.0037 0.1011 0.3678
Echinococcus multilocularis beta LACTamase domain containing family member 0.0037 0.1011 0.0776
Loa Loa (eye worm) exodeoxyribonuclease III family protein 0.0021 0.027 0.0275
Brugia malayi MH2 domain containing protein 0.0119 0.4717 0.4802
Brugia malayi Glycosyl hydrolases family 31 protein 0.0039 0.1107 0.1127
Toxoplasma gondii glycosyl hydrolase, family 31 protein 0.0039 0.1107 0.2317
Echinococcus multilocularis Alpha N acetylgalactosaminidase 0.0101 0.3882 0.3781
Echinococcus multilocularis survival motor neuron protein 1 0.0233 0.9822 1
Loa Loa (eye worm) hypothetical protein 0.0037 0.1011 0.1029
Trypanosoma brucei glucosidase, putative 0.0039 0.1107 0.4028
Schistosoma mansoni alpha-galactosidase/alpha-n-acetylgalactosaminidase 0.0067 0.237 0.3548
Loa Loa (eye worm) hypothetical protein 0.0029 0.0657 0.0669
Trichomonas vaginalis alpha-glucosidase, putative 0.0039 0.1107 0.4672
Giardia lamblia Histone acetyltransferase GCN5 0.0041 0.1174 1
Mycobacterium tuberculosis Conserved protein 0.0037 0.1011 0.0761
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0048 0.1487 0.2056
Brugia malayi Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative 0.0037 0.1011 0.1029
Loa Loa (eye worm) hypothetical protein 0.0037 0.1011 0.1029
Schistosoma mansoni gcn5proteinral control of amino-acid synthesis 5-like 2 gcnl2 0.0151 0.6136 0.9915
Trypanosoma cruzi hypothetical protein, conserved 0.0037 0.1011 0.3678
Loa Loa (eye worm) hypothetical protein 0.0076 0.2749 0.2799
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0048 0.1487 0.2056
Mycobacterium ulcerans esterase/lipase LipP 0.0037 0.1011 0.3896
Brugia malayi cytoplasmic intermediate filament protein 0.0016 0.0047 0.0048
Trichomonas vaginalis D-aminoacylase, putative 0.0037 0.1011 0.4266
Onchocerca volvulus 0.0029 0.0657 0.1668
Loa Loa (eye worm) cytoplasmic intermediate filament protein 0.0016 0.0047 0.0048
Loa Loa (eye worm) glycosyl hydrolase family 31 protein 0.0039 0.1107 0.1127
Echinococcus granulosus intermediate filament protein 0.0029 0.0657 0.0405
Echinococcus multilocularis lysosomal alpha glucosidase 0.0176 0.7294 0.7353
Schistosoma mansoni intermediate filament proteins 0.0029 0.0657 0.0654
Trichomonas vaginalis alpha-glucosidase, putative 0.0039 0.1107 0.4672
Entamoeba histolytica glycosyl hydrolase, family 31 protein 0.0039 0.1107 0.943
Echinococcus multilocularis lamin dm0 0.0029 0.0657 0.0405
Loa Loa (eye worm) acetyltransferase 0.0151 0.6136 0.6247
Echinococcus granulosus Alpha N acetylgalactosaminidase 0.0101 0.3882 0.3781
Trichomonas vaginalis penicillin-binding protein, putative 0.0037 0.1011 0.4266
Trichomonas vaginalis penicillin-binding protein, putative 0.0037 0.1011 0.4266
Loa Loa (eye worm) intermediate filament protein 0.0029 0.0657 0.0669
Echinococcus multilocularis musashi 0.0029 0.0657 0.0405
Brugia malayi Glycosyl hydrolases family 31 protein 0.0176 0.7294 0.7426
Trichomonas vaginalis D-aminoacylase, putative 0.0037 0.1011 0.4266
Schistosoma mansoni alpha-galactosidase/alpha-n-acetylgalactosaminidase 0.0067 0.237 0.3548
Schistosoma mansoni alpha-glucosidase 0.0152 0.6187 1
Loa Loa (eye worm) intermediate filament tail domain-containing protein 0.0029 0.0657 0.0669
Echinococcus granulosus lamin 0.0029 0.0657 0.0405
Mycobacterium tuberculosis Probable esterase LipL 0.0037 0.1011 0.0761
Plasmodium vivax histone acetyltransferase GCN5, putative 0.0044 0.1341 0.4319
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0048 0.1487 0.1274
Echinococcus granulosus beta LACTamase domain containing family member 0.0037 0.1011 0.0776
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0037 0.1011 0.1252
Mycobacterium tuberculosis Probable conserved lipoprotein 0.0037 0.1011 0.0761
Mycobacterium tuberculosis Conserved protein 0.0037 0.1011 0.0761
Schistosoma mansoni alpha glucosidase 0.0039 0.1107 0.1415
Trichomonas vaginalis neutral alpha-glucosidase ab precursor, putative 0.0039 0.1107 0.4672
Onchocerca volvulus 0.0037 0.1011 0.2565
Trichomonas vaginalis alpha-glucosidase, putative 0.0039 0.1107 0.4672
Brugia malayi beta-lactamase family protein 0.0037 0.1011 0.1029
Brugia malayi hypothetical protein 0.0233 0.9822 1
Onchocerca volvulus 0.0029 0.0657 0.1668
Loa Loa (eye worm) transcription factor SMAD2 0.0119 0.4717 0.4802
Mycobacterium ulcerans beta-lactamase 0.0037 0.1011 0.3896
Entamoeba histolytica glycosyl hydrolase, family 31 protein 0.0039 0.1107 0.943
Mycobacterium ulcerans hypothetical protein 0.0037 0.1011 0.3896
Brugia malayi intermediate filament protein 0.0029 0.0657 0.0669
Plasmodium falciparum ataxin-2 like protein, putative 0.0076 0.2749 1
Mycobacterium ulcerans fusion of enoyl-CoA hydratase, EchA21 and lipase, LipE 0.0037 0.1011 0.3896
Loa Loa (eye worm) glycosyl hydrolase family 31 protein 0.0176 0.7294 0.7426
Schistosoma mansoni 3-hydroxyacyl-CoA dehydrogenase 0.0063 0.2172 0.3214
Trypanosoma cruzi apurinic/apyrimidinic endonuclease, putative 0.0021 0.027 0.0983
Loa Loa (eye worm) hypothetical protein 0.0037 0.1011 0.1029
Trichomonas vaginalis esterase, putative 0.0037 0.1011 0.4266
Trichomonas vaginalis alpha-glucosidase, putative 0.0039 0.1107 0.4672
Brugia malayi beta-lactamase 0.0037 0.1011 0.1029
Onchocerca volvulus 0.0102 0.3941 1
Trypanosoma cruzi PAB1-binding protein , putative 0.0076 0.2749 1
Mycobacterium ulcerans short-chain type dehydrogenase/reductase 0.0063 0.2172 1
Plasmodium falciparum ataxin-2 like protein, putative 0.0076 0.2749 1
Echinococcus granulosus lamin dm0 0.0029 0.0657 0.0405
Toxoplasma gondii histone lysine acetyltransferase GCN5-B 0.0044 0.1341 0.2964
Toxoplasma gondii melibiase subfamily protein 0.0101 0.3882 1
Leishmania major alpha glucosidase II subunit, putative 0.0039 0.1107 0.4028
Trypanosoma cruzi hypothetical protein, conserved 0.0039 0.1107 0.4028
Brugia malayi acetyltransferase, GNAT family protein 0.0151 0.6136 0.6247
Echinococcus multilocularis lamin 0.0029 0.0657 0.0405
Entamoeba histolytica acetyltransferase, GNAT family 0.0041 0.1174 1
Leishmania major hypothetical protein, conserved 0.0037 0.1011 0.3678
Schistosoma mansoni hypothetical protein 0.0034 0.087 0.1014
Entamoeba histolytica exodeoxyribonuclease III, putative 0.0021 0.027 0.2302
Trypanosoma brucei PAB1-binding protein , putative 0.0076 0.2749 1
Echinococcus multilocularis Ataxin 2, N terminal,domain containing protein 0.0034 0.087 0.0628
Loa Loa (eye worm) hypothetical protein 0.0037 0.1011 0.1029
Trichomonas vaginalis neutral alpha-glucosidase ab precursor, putative 0.0039 0.1107 0.4672
Schistosoma mansoni survival motor neuron protein 0.0047 0.148 0.2045
Brugia malayi Intermediate filament tail domain containing protein 0.0029 0.0657 0.0669
Echinococcus multilocularis lysosomal alpha glucosidase 0.0176 0.7294 0.7353
Loa Loa (eye worm) MH2 domain-containing protein 0.0119 0.4717 0.4802
Schistosoma mansoni hypothetical protein 0.0047 0.148 0.2045
Mycobacterium tuberculosis Probable lipase LipE 0.0037 0.1011 0.0761
Mycobacterium leprae conserved hypothetical protein 0.0037 0.1011 0.5
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0048 0.1487 0.1514
Echinococcus granulosus survival motor neuron protein 1 0.0233 0.9822 1
Echinococcus granulosus lysosomal alpha glucosidase 0.0176 0.7294 0.7353
Mycobacterium tuberculosis Probable short-chain type dehydrogenase/reductase 0.0063 0.2172 0.1954
Schistosoma mansoni alpha-glucosidase 0.0152 0.6187 1
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0048 0.1487 0.1274
Wolbachia endosymbiont of Brugia malayi exonuclease III 0.0021 0.027 0.5
Loa Loa (eye worm) 3-hydroxyacyl-CoA dehydrogenase type II 0.0059 0.1981 0.2017
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0048 0.1487 0.1274
Echinococcus granulosus neutral alpha glucosidase AB 0.0039 0.1107 0.0876
Trichomonas vaginalis ap endonuclease, putative 0.0021 0.027 0.114
Trichomonas vaginalis alpha-galactosidase/alpha-N-acetylgalactosaminidase, putative 0.0067 0.237 1
Brugia malayi exodeoxyribonuclease III family protein 0.0021 0.027 0.0275
Trypanosoma cruzi apurinic/apyrimidinic endonuclease 0.0021 0.027 0.0983
Echinococcus multilocularis neutral alpha glucosidase AB 0.0039 0.1107 0.0876
Leishmania major hypothetical protein, conserved 0.0076 0.2749 1
Echinococcus multilocularis Glycoside hydrolase, family 27 0.0101 0.3882 0.3781
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0048 0.1487 0.1274
Onchocerca volvulus 0.0037 0.1011 0.2565
Mycobacterium tuberculosis Possible conserved lipoprotein LpqK 0.0037 0.1011 0.0761
Schistosoma mansoni lamin 0.0029 0.0657 0.0654
Leishmania major 3-oxoacyl-(acyl-carrier protein) reductase, putative 0.0063 0.2172 0.7901
Plasmodium falciparum histone acetyltransferase GCN5 0.0041 0.1174 0.3647
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0048 0.1487 0.1514
Echinococcus granulosus histone acetyltransferase KAT2B 0.0044 0.1341 0.1121
Loa Loa (eye worm) hypothetical protein 0.0233 0.9822 1
Echinococcus granulosus histone acetyltransferase KAT2B 0.0147 0.5946 0.5942
Mycobacterium tuberculosis Probable lipase LipD 0.0037 0.1011 0.0761
Toxoplasma gondii LsmAD domain-containing protein 0.0076 0.2749 0.6862
Onchocerca volvulus 0.0047 0.148 0.3756
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0037 0.1011 0.1252
Schistosoma mansoni alpha-galactosidase/alpha-n-acetylgalactosaminidase 0.0101 0.3882 0.6104
Echinococcus multilocularis 3 hydroxyacyl coenzyme A dehydrogenase type 2 0.0063 0.2172 0.1991
Onchocerca volvulus 0.0037 0.1011 0.2565

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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