Detailed information for compound 1326351

Basic information

Technical information
  • TDR Targets ID: 1326351
  • Name: 2-(2,1,3-benzothiadiazol-7-ylsulfonyl)-1-[4-( 3-chlorophenyl)piperazin-1-yl]ethanone
  • MW: 436.936 | Formula: C18H17ClN4O3S2
  • H donors: 0 H acceptors: 5 LogP: 2.78 Rotable bonds: 5
    Rule of 5 violations (Lipinski): 1
  • SMILES: Clc1cccc(c1)N1CCN(CC1)C(=O)CS(=O)(=O)c1cccc2c1nsn2
  • InChi: 1S/C18H17ClN4O3S2/c19-13-3-1-4-14(11-13)22-7-9-23(10-8-22)17(24)12-28(25,26)16-6-2-5-15-18(16)21-27-20-15/h1-6,11H,7-10,12H2
  • InChiKey: XNMAOFPGTIIXFH-UHFFFAOYSA-N  


Substructure search Similarity search

Network

Hover on a compound node to display the structore

Synonyms

  • 2-(2,1,3-benzothiadiazol-7-ylsulfonyl)-1-[4-(3-chlorophenyl)-1-piperazinyl]ethanone
  • 1-[4-(3-chlorophenyl)piperazin-1-yl]-2-piazthiol-4-ylsulfonyl-ethanone
  • G845-0049
  • NCGC00135046-01

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens lamin A/C Starlite/ChEMBL No references
Equus caballus Ferritin light chain Starlite/ChEMBL No references

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_128723 All targets in OG5_128723
Brugia malayi Intermediate filament tail domain containing protein Get druggable targets OG5_128723 All targets in OG5_128723
Echinococcus multilocularis lamin Get druggable targets OG5_128723 All targets in OG5_128723
Echinococcus granulosus lamin dm0 Get druggable targets OG5_128723 All targets in OG5_128723
Echinococcus granulosus cytoplasmic intermediate filament protein Get druggable targets OG5_128723 All targets in OG5_128723
Echinococcus granulosus lamin Get druggable targets OG5_128723 All targets in OG5_128723
Onchocerca volvulus Get druggable targets OG5_128723 All targets in OG5_128723
Schistosoma japonicum expressed protein Get druggable targets OG5_128723 All targets in OG5_128723
Loa Loa (eye worm) intermediate filament tail domain-containing protein Get druggable targets OG5_128723 All targets in OG5_128723
Schistosoma mansoni lamin Get druggable targets OG5_128723 All targets in OG5_128723
Schistosoma mansoni intermediate filament proteins Get druggable targets OG5_128723 All targets in OG5_128723
Schistosoma japonicum Lamin-C, putative Get druggable targets OG5_128723 All targets in OG5_128723
Echinococcus multilocularis musashi Get druggable targets OG5_128723 All targets in OG5_128723
Schistosoma japonicum expressed protein Get druggable targets OG5_128723 All targets in OG5_128723
Schistosoma mansoni lamin Get druggable targets OG5_128723 All targets in OG5_128723
Schistosoma japonicum ko:K07611 lamin, putative Get druggable targets OG5_128723 All targets in OG5_128723
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_128723 All targets in OG5_128723
Brugia malayi intermediate filament protein Get druggable targets OG5_128723 All targets in OG5_128723
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_128723 All targets in OG5_128723
Onchocerca volvulus Get druggable targets OG5_128723 All targets in OG5_128723
Echinococcus granulosus intermediate filament protein Get druggable targets OG5_128723 All targets in OG5_128723
Echinococcus multilocularis lamin dm0 Get druggable targets OG5_128723 All targets in OG5_128723
Schistosoma japonicum Intermediate filament protein ifa-1, putative Get druggable targets OG5_128723 All targets in OG5_128723
Echinococcus multilocularis cytoplasmic intermediate filament protein Get druggable targets OG5_128723 All targets in OG5_128723
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_128723 All targets in OG5_128723
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_128723 All targets in OG5_128723
Loa Loa (eye worm) intermediate filament protein Get druggable targets OG5_128723 All targets in OG5_128723
By sequence similarity to non orthologous known druggable targets
Species Potential target Known druggable target Length Alignment span Identity
Schistosoma mansoni apoferritin-2 Ferritin light chain   175 aa 142 aa 29.6 %
Schistosoma mansoni ferritin Ferritin light chain   175 aa 171 aa 43.9 %
Schistosoma mansoni ferritin Ferritin light chain   175 aa 171 aa 44.4 %
Echinococcus multilocularis expressed protein Ferritin light chain   175 aa 146 aa 30.1 %
Schistosoma mansoni apoferritin-2 Ferritin light chain   175 aa 146 aa 28.8 %
Schistosoma japonicum Ferritin, putative Ferritin light chain   175 aa 144 aa 24.3 %
Echinococcus granulosus expressed protein Ferritin light chain   175 aa 146 aa 28.8 %
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Onchocerca volvulus 0.0119 0.2746 1
Mycobacterium leprae PROBABLE SHORT CHAIN ALCOHOL DEHYDROGENASE/REDUCTASE 0.0119 0.2746 0.5
Echinococcus multilocularis prostaglandin H2 D isomerase 0.0343 0.8845 1
Echinococcus granulosus WW domain containing oxidoreductase 0.0119 0.2746 0.3098
Schistosoma mansoni steroid dehydrogenase 0.0119 0.2746 0.3098
Onchocerca volvulus Sepiapterin reductase homolog 0.0119 0.2746 1
Brugia malayi oxidoreductase, short chain dehydrogenase/reductase family protein 0.0119 0.2746 1
Echinococcus granulosus oxidoreductase 0.0119 0.2746 0.3098
Onchocerca volvulus 0.0119 0.2746 1
Schistosoma mansoni steroid dehydrogenase 0.0119 0.2746 0.3098
Trypanosoma cruzi 3-ketoacyl-CoA reductase, putative 0.0119 0.2746 1
Toxoplasma gondii oxidoreductase, short chain dehydrogenase/reductase family protein 0.0119 0.2746 1
Leishmania major hypothetical protein, conserved 0.0119 0.2746 1
Brugia malayi oxidoreductase, short chain dehydrogenase/reductase family protein 0.0119 0.2746 1
Toxoplasma gondii 2,4-dienoyl CoA reductase 2, peroxisomal family protein 0.0119 0.2746 1
Brugia malayi glutathione transferase 0.0078 0.1637 0.596
Loa Loa (eye worm) hypothetical protein 0.0033 0.0411 0.1495
Wolbachia endosymbiont of Brugia malayi Short-chain alcohol dehydrogenase family enzyme 0.0119 0.2746 0.5
Brugia malayi oxidoreductase, short chain dehydrogenase/reductase family protein 0.0119 0.2746 1
Trichomonas vaginalis short-chain dehydrogenase, putative 0.0119 0.2746 1
Schistosoma mansoni carbonyl reductase 0.0119 0.2746 0.3098
Echinococcus multilocularis carbonyl reductase 1 0.0119 0.2746 0.3098
Trypanosoma cruzi hypothetical protein, conserved 0.0119 0.2746 1
Echinococcus granulosus retinol dehydrogenase 11 0.0119 0.2746 0.3098
Toxoplasma gondii carbonyl reductase 1, putative 0.0119 0.2746 1
Loa Loa (eye worm) oxidoreductase 0.0119 0.2746 1
Trichomonas vaginalis short-chain dehydrogenase, putative 0.0119 0.2746 1
Loa Loa (eye worm) oxidoreductase 0.0119 0.2746 1
Schistosoma mansoni short chain dehydrogenase 0.0119 0.2746 0.3098
Entamoeba histolytica short chain dehydrogenase family protein 0.0119 0.2746 0.5
Brugia malayi Intermediate filament tail domain containing protein 0.0033 0.0411 0.1495
Echinococcus multilocularis lamin 0.0033 0.0411 0.0454
Brugia malayi Dehydrogenases, short chain protein 2 0.0119 0.2746 1
Brugia malayi oxidoreductase, short chain dehydrogenase/reductase family protein 0.0119 0.2746 1
Echinococcus multilocularis oxidoreductase 0.0119 0.2746 0.3098
Loa Loa (eye worm) oxidoreductase 0.0119 0.2746 1
Echinococcus multilocularis carbonyl reductase 1 0.0119 0.2746 0.3098
Plasmodium vivax steroid dehydrogenase, putative 0.0119 0.2746 0.3098
Schistosoma mansoni steroid dehydrogenase 0.0119 0.2746 0.3098
Loa Loa (eye worm) hypothetical protein 0.0032 0.0394 0.1436
Leishmania major 3-oxoacyl-(acyl-carrier protein) reductase, putative 0.0119 0.2746 1
Leishmania major quinonoid dihydropteridine reductase 0.0119 0.2746 1
Leishmania major dehydrogenase-like protein 0.0119 0.2746 1
Toxoplasma gondii oxidoreductase, short chain dehydrogenase/reductase family protein 0.0119 0.2746 1
Entamoeba histolytica hypothetical protein, conserved 0.0119 0.2746 0.5
Onchocerca volvulus 0.0119 0.2746 1
Brugia malayi oxidoreductase, short chain dehydrogenase/reductase family protein 0.0119 0.2746 1
Trypanosoma cruzi NAD(P)-dependent oxidoreductase, putative 0.0119 0.2746 1
Echinococcus multilocularis musashi 0.0033 0.0411 0.0454
Onchocerca volvulus 0.0119 0.2746 1
Loa Loa (eye worm) oxidoreductase 0.0119 0.2746 1
Echinococcus multilocularis glutathione S transferase 0.0078 0.1637 0.1842
Trypanosoma cruzi oxidoreductase-like protein, putative 0.0119 0.2746 1
Schistosoma mansoni short chain dehydrogenase 0.0119 0.2746 0.3098
Loa Loa (eye worm) oxidoreductase 0.0119 0.2746 1
Loa Loa (eye worm) oxidoreductase 0.0119 0.2746 1
Loa Loa (eye worm) hypothetical protein 0.0119 0.2746 1
Toxoplasma gondii oxidoreductase, putative 0.0119 0.2746 1
Echinococcus granulosus carbonyl reductase 1 0.0119 0.2746 0.3098
Trypanosoma brucei beta-D-hydroxybutyrate dehydrogenase 0.0119 0.2746 1
Echinococcus granulosus 3 hydroxyacyl coenzyme A dehydrogenase type 2 0.0119 0.2746 0.3098
Loa Loa (eye worm) oxidoreductase 0.0119 0.2746 1
Echinococcus multilocularis conserved hypothetical protein 0.0119 0.2746 0.3098
Echinococcus multilocularis glutathione S transferase 0.0078 0.1637 0.1842
Onchocerca volvulus 0.0119 0.2746 1
Echinococcus granulosus carbonyl reductase 1 0.0119 0.2746 0.3098
Schistosoma mansoni 3-hydroxyacyl-CoA dehydrogenase 0.0119 0.2746 0.3098
Brugia malayi oxidoreductase, short chain dehydrogenase/reductase family protein 0.0119 0.2746 1
Loa Loa (eye worm) dehydrogenase 0.0119 0.2746 1
Brugia malayi D-beta-hydroxybutyrate dehydrogenase, mitochondrial precursor 0.0119 0.2746 1
Trichomonas vaginalis short-chain dehydrogenase, putative 0.0119 0.2746 1
Brugia malayi oxidoreductase, short chain dehydrogenase/reductase family protein 0.0119 0.2746 1
Giardia lamblia Hypothetical protein 0.0119 0.2746 0.5
Leishmania major short chain dehydrogenase-like protein 0.0119 0.2746 1
Leishmania major hypothetical protein, conserved 0.0119 0.2746 1
Trypanosoma brucei beta-ketoacyl-ACP reductase 3, putative 0.0119 0.2746 1
Echinococcus multilocularis glutathione S transferase 0.006 0.1154 0.1295
Echinococcus granulosus glutathione S transferase 0.006 0.1154 0.1295
Schistosoma mansoni glutathione-S-transferase 0.0078 0.1637 0.1842
Schistosoma mansoni short chain dehydrogenase 0.0119 0.2746 0.3098
Trypanosoma cruzi 3-ketoacyl-CoA reductase, putative 0.0119 0.2746 1
Loa Loa (eye worm) hypothetical protein 0.006 0.1154 0.42
Echinococcus granulosus Dehydrogenase:reductase SDR family 0.0119 0.2746 0.3098
Schistosoma mansoni steroid dehydrogenase 0.0119 0.2746 0.3098
Schistosoma mansoni short chain dehydrogenase 0.0119 0.2746 0.3098
Entamoeba histolytica short chain dehydrogenase family protein 0.0119 0.2746 0.5
Trypanosoma cruzi NAD(P)-dependent oxidoreductase, putative 0.0119 0.2746 1
Schistosoma mansoni steroid dehydrogenase 0.0119 0.2746 0.3098
Entamoeba histolytica estradiol 17-beta-dehydrogenase, putative 0.0119 0.2746 0.5
Schistosoma mansoni Glutathione S-transferase 28 kDa (GST 28) (GST class-mu) 0.0343 0.8845 1
Mycobacterium leprae Possible short-chain dehydrogenase EphD 0.0119 0.2746 0.5
Brugia malayi dehydrogenases, short chain protein 9 0.0119 0.2746 1
Trypanosoma cruzi hypothetical protein, conserved 0.0119 0.2746 1
Echinococcus multilocularis epidermal retinal dehydrogenase 2 0.0119 0.2746 0.3098
Echinococcus granulosus retinol dehydrogenase 11 0.0119 0.2746 0.3098
Loa Loa (eye worm) short chain dehydrogenase/reductase family oxidoreductase 0.0119 0.2746 1
Brugia malayi intermediate filament protein 0.0033 0.0411 0.1495
Trypanosoma brucei oxidoreductase-like protein 0.0119 0.2746 1
Schistosoma mansoni intermediate filament proteins 0.0033 0.0411 0.0454
Echinococcus granulosus 3 ketodihydrosphingosine reductase 0.0119 0.2746 0.3098
Schistosoma mansoni oxidoreductase short chain dehydrogenase/reductase family 0.0119 0.2746 0.3098
Brugia malayi Retinol dehydrogenase 12 0.0119 0.2746 1
Loa Loa (eye worm) hypothetical protein 0.0119 0.2746 1
Onchocerca volvulus Dehydrogenase\/reductase SDR family member 1 homolog 0.0119 0.2746 1
Echinococcus multilocularis carbonyl reductase 1 0.0119 0.2746 0.3098
Mycobacterium leprae Probable oxidoreductase 0.0119 0.2746 0.5
Schistosoma mansoni short chain dehydrogenase 0.0119 0.2746 0.3098
Brugia malayi 3-hydroxyacyl-CoA dehydrogenase type II 0.0119 0.2746 1
Trypanosoma cruzi hypothetical protein, conserved 0.0119 0.2746 1
Trypanosoma cruzi quinonoid dihydropteridine reductase, putative 0.0119 0.2746 1
Leishmania major pteridine reductase 1 0.0119 0.2746 1
Brugia malayi oxidoreductase, short chain dehydrogenase/reductase family protein 0.0119 0.2746 1
Echinococcus multilocularis retinol dehydrogenase 13 0.0119 0.2746 0.3098
Brugia malayi oxidoreductase, short chain dehydrogenase/reductase family protein 0.0119 0.2746 1
Echinococcus granulosus intermediate filament protein 0.0033 0.0411 0.0454
Toxoplasma gondii oxidoreductase, short chain dehydrogenase/reductase family protein 0.0119 0.2746 1
Leishmania major short chain dehydrogenase/reductase, putative 0.0119 0.2746 1
Schistosoma mansoni short chain dehydrogenase 0.0119 0.2746 0.3098
Trypanosoma cruzi oxidoreductase-like protein, putative 0.0119 0.2746 1
Brugia malayi Hypothetical oxidoreductase F56D1.5 0.0119 0.2746 1
Schistosoma mansoni short chain dehydrogenase 0.0119 0.2746 0.3098
Loa Loa (eye worm) oxidoreductase 0.0119 0.2746 1
Loa Loa (eye worm) hypothetical protein 0.0119 0.2746 1
Brugia malayi oxidoreductase, short chain dehydrogenase/reductase family protein 0.0119 0.2746 1
Schistosoma mansoni short-chain dehydrogenase/reductase 0.0119 0.2746 0.3098
Loa Loa (eye worm) dehydrogenase 0.0119 0.2746 1
Brugia malayi oxidoreductase, short chain dehydrogenase/reductase family protein 0.0119 0.2746 1
Schistosoma mansoni steroid dehydrogenase 0.0119 0.2746 0.3098
Leishmania major short chain dehydrogenase/reductase, putative 0.0119 0.2746 1
Mycobacterium leprae Probable short-chain type dehydrogenase/reductase 0.0119 0.2746 0.5
Echinococcus granulosus glutathione S transferase 0.0265 0.6734 0.7611
Trichomonas vaginalis hydroxyacyl dehydrogenase, putative 0.0119 0.2746 1
Echinococcus granulosus lamin 0.0033 0.0411 0.0454
Echinococcus granulosus carbonyl reductase 1 0.0119 0.2746 0.3098
Loa Loa (eye worm) intermediate filament protein 0.0033 0.0411 0.1495
Onchocerca volvulus 0.0119 0.2746 1
Trypanosoma brucei 3-keto-dihydrosphingosine reductase 0.0119 0.2746 1
Mycobacterium leprae ROBABLE SHORT-CHAIN TYPE DEHYDROGENASE/REDUCTASE 0.0119 0.2746 0.5
Echinococcus granulosus carbonyl reductase 1 0.0119 0.2746 0.3098
Leishmania major quinonoid dihydropteridine reductase 0.0119 0.2746 1
Loa Loa (eye worm) hypothetical protein 0.0119 0.2746 1
Trypanosoma cruzi short-chain dehydrogenase, putative 0.0119 0.2746 1
Trypanosoma cruzi hypothetical protein, conserved 0.0119 0.2746 1
Brugia malayi hypothetical protein 0.0119 0.2746 1
Loa Loa (eye worm) hypothetical protein 0.0119 0.2746 1
Schistosoma mansoni steroid dehydrogenase 0.0119 0.2746 0.3098
Echinococcus granulosus glutathione s transferase mu 0.0078 0.1637 0.1842
Mycobacterium leprae Probable short-chain type dehydrogenase/reductase 0.0119 0.2746 0.5
Echinococcus granulosus epidermal retinal dehydrogenase 2 0.0119 0.2746 0.3098
Schistosoma mansoni retinal dehydrogenase 0.0119 0.2746 0.3098
Trichomonas vaginalis short-chain dehydrogenase, putative 0.0119 0.2746 1
Echinococcus granulosus lamin dm0 0.0033 0.0411 0.0454
Trypanosoma brucei short-chain dehydrogenase, putative 0.0119 0.2746 1
Leishmania major hypothetical protein, conserved 0.0119 0.2746 1
Entamoeba histolytica estradiol 17-beta-dehydrogenase, putative 0.0119 0.2746 0.5
Echinococcus multilocularis retinol dehydrogenase 11 0.0119 0.2746 0.3098
Schistosoma mansoni steroid dehydrogenase 0.0119 0.2746 0.3098
Brugia malayi Dehydrogenases, short chain protein 30 0.0119 0.2746 1
Trypanosoma cruzi beta-ketoacyl-ACP reductase 2, putative 0.0119 0.2746 1
Onchocerca volvulus 0.0119 0.2746 1
Brugia malayi hypothetical protein 0.0119 0.2746 1
Plasmodium vivax glutathione S-transferase, putative 0.0343 0.8845 1
Schistosoma mansoni short chain dehydrogenase 0.0119 0.2746 0.3098
Onchocerca volvulus 0.0119 0.2746 1
Brugia malayi oxidoreductase, short chain dehydrogenase/reductase family protein 0.0119 0.2746 1
Echinococcus multilocularis glutathione S transferase 0.006 0.1154 0.1295
Echinococcus multilocularis steroid dehydrogenase 0.0119 0.2746 0.3098
Schistosoma mansoni steroid dehydrogenase 0.0119 0.2746 0.3098
Schistosoma mansoni carbonyl reductase 0.0119 0.2746 0.3098
Onchocerca volvulus 0.0119 0.2746 1
Echinococcus multilocularis glutathione S-transferase 0.0078 0.1637 0.1842
Schistosoma mansoni GST class-mu 0.0078 0.1637 0.1842
Schistosoma mansoni short chain dehydrogenase 0.0119 0.2746 0.3098
Giardia lamblia Oxidoreductase, short chain dehydrogenase/reductase family 0.0119 0.2746 0.5
Loa Loa (eye worm) hypothetical protein 0.0119 0.2746 1
Schistosoma mansoni short chain dehydrogenase 0.0119 0.2746 0.3098
Trypanosoma brucei short-chain dehydrogenase, putative 0.0119 0.2746 1
Leishmania major hypothetical protein, conserved 0.0119 0.2746 1
Schistosoma mansoni lamin 0.0033 0.0411 0.0454
Loa Loa (eye worm) hypothetical protein 0.0078 0.1637 0.596
Leishmania major oxidoreductase-like protein 0.0119 0.2746 1
Echinococcus multilocularis carbonyl reductase 1 0.0119 0.2746 0.3098
Trypanosoma brucei 3-ketoacyl-CoA reductase, putative 0.0119 0.2746 1
Echinococcus granulosus glutathione S transferase 0.0078 0.1637 0.1842
Toxoplasma gondii 3-ketoacyl-CoA reductase, putative 0.0119 0.2746 1
Brugia malayi oxidoreductase, short chain dehydrogenase/reductase family protein 0.0119 0.2746 1
Loa Loa (eye worm) oxidoreductase 0.0119 0.2746 1
Onchocerca volvulus 0.0119 0.2746 1
Onchocerca volvulus 0.0119 0.2746 1
Schistosoma mansoni short chain dehydrogenase 0.0119 0.2746 0.3098
Echinococcus granulosus hypothetical protein 0.0119 0.2746 0.3098
Trypanosoma cruzi beta-ketoacyl-ACP reductase 2, putative 0.0119 0.2746 1
Schistosoma mansoni 3-keto-dihydrosphingosine reductase 0.0119 0.2746 0.3098
Echinococcus granulosus glutathione S transferase Mu 1 0.0078 0.1637 0.1842
Leishmania major quinonoid dihydropteridine reductase 0.0119 0.2746 1
Trypanosoma cruzi hypothetical protein, conserved 0.0119 0.2746 1
Echinococcus multilocularis steroid dehydrogenase 0.0119 0.2746 0.3098
Echinococcus multilocularis glutathione S transferase 0.0265 0.6734 0.7611
Schistosoma mansoni short chain dehydrogenase 0.0119 0.2746 0.3098
Toxoplasma gondii sterol carrier protein-2 HAD-2SCP-2 0.0119 0.2746 1
Schistosoma mansoni short chain dehydrogenase 0.0119 0.2746 0.3098
Echinococcus granulosus hypothetical protein 0.0119 0.2746 0.3098
Leishmania major quinonoid dihydropteridine reductase 0.0119 0.2746 1
Leishmania major 3-keto-dihydrosphingosine reductase 0.0119 0.2746 1
Echinococcus multilocularis 3 ketodihydrosphingosine reductase 0.0119 0.2746 0.3098
Trypanosoma cruzi short chain dehydrogenase/reductase, putative 0.0119 0.2746 1
Entamoeba histolytica hypothetical protein, conserved 0.0119 0.2746 0.5
Toxoplasma gondii oxidoreductase, short chain dehydrogenase/reductase family protein 0.0119 0.2746 1
Trypanosoma cruzi 3-keto-dihydrosphingosine reductase 0.0119 0.2746 1
Trichomonas vaginalis steroid dehydrogenase, putative 0.0119 0.2746 1
Plasmodium vivax hypothetical protein, conserved 0.0119 0.2746 0.3098
Onchocerca volvulus 0.006 0.1154 0.3181
Trypanosoma cruzi 3-keto-dihydrosphingosine reductase 0.0119 0.2746 1
Brugia malayi oxidoreductase, short chain dehydrogenase/reductase family protein 0.0119 0.2746 1
Loa Loa (eye worm) hypothetical protein 0.0119 0.2746 1
Onchocerca volvulus Dehydrogenase\/reductase SDR family member 13 homolog 0.0119 0.2746 1
Echinococcus multilocularis retinol dehydrogenase 11 0.0119 0.2746 0.3098
Giardia lamblia Short-chain dehydrogenase, putative 0.0119 0.2746 0.5
Loa Loa (eye worm) hypothetical protein 0.0119 0.2746 1
Brugia malayi oxidoreductase 0.0119 0.2746 1
Trichomonas vaginalis short-chain dehydrogenase, putative 0.0119 0.2746 1
Loa Loa (eye worm) intermediate filament tail domain-containing protein 0.0033 0.0411 0.1495
Onchocerca volvulus 0.0119 0.2746 1
Schistosoma mansoni steroid dehydrogenase 0.0119 0.2746 0.3098
Onchocerca volvulus Dehydrogenase\/reductase SDR family member 13 homolog 0.0119 0.2746 1
Schistosoma mansoni lamin 0.0033 0.0411 0.0454
Echinococcus multilocularis 3 hydroxyacyl coenzyme A dehydrogenase type 2 0.0119 0.2746 0.3098
Echinococcus multilocularis lamin dm0 0.0033 0.0411 0.0454
Loa Loa (eye worm) hypothetical protein 0.0119 0.2746 1
Entamoeba histolytica estradiol 17-beta-dehydrogenase, putative 0.0119 0.2746 0.5
Echinococcus granulosus steroid dehydrogenase 0.0119 0.2746 0.3098
Brugia malayi dehydrogenases, short chain protein 2 0.0119 0.2746 1
Trichomonas vaginalis estradiol 17 beta-dehydrogenase, putative 0.0119 0.2746 1
Schistosoma mansoni carbonyl reductase 0.0119 0.2746 0.3098
Trypanosoma brucei short-chain dehydrogenase, putative 0.0119 0.2746 1
Echinococcus multilocularis transient receptor potential cation channel 0.0119 0.2746 0.3098
Plasmodium falciparum oxidoreductase, short-chain dehydrogenase family, putative 0.0119 0.2746 1
Echinococcus granulosus prostaglandin H2 D isomerase 0.0343 0.8845 1
Trypanosoma brucei short-chain dehydrogenase, putative 0.0119 0.2746 1
Trypanosoma cruzi short chain dehydrogenase, putative 0.0119 0.2746 1
Onchocerca volvulus 0.0119 0.2746 1
Plasmodium falciparum conserved Plasmodium protein, unknown function 0.0119 0.2746 1
Leishmania major quinonoid dihydropteridine reductase 0.0119 0.2746 1
Plasmodium falciparum steroid dehydrogenase, putative 0.0119 0.2746 1
Leishmania major short chain dehydrogenase, putative 0.0119 0.2746 1
Trypanosoma brucei beta-ketoacyl-ACP reductase 2 0.0119 0.2746 1
Entamoeba histolytica oxidoreductase, short chain dehydrogenase/reductase family 0.0119 0.2746 0.5
Echinococcus multilocularis Dehydrogenase:reductase SDR family 0.0119 0.2746 0.3098
Leishmania major hypothetical protein, conserved 0.0119 0.2746 1
Trichomonas vaginalis short-chain dehydrogenase, putative 0.0119 0.2746 1
Leishmania major quinonoid dihydropteridine reductase 0.0119 0.2746 1
Echinococcus multilocularis glutathione S transferase 0.0078 0.1637 0.1842
Brugia malayi Glutathione S-transferase 4 0.006 0.1154 0.42
Schistosoma mansoni short chain dehydrogenase 0.0119 0.2746 0.3098
Schistosoma mansoni short chain dehydrogenase 0.0119 0.2746 0.3098
Echinococcus multilocularis estradiol 17 beta dehydrogenase 12 0.0119 0.2746 0.3098
Trypanosoma cruzi short chain dehydrogenase, putative 0.0119 0.2746 1
Trypanosoma brucei short-chain dehydrogenase, putative 0.0119 0.2746 1
Trichomonas vaginalis short-chain dehydrogenase, putative 0.0119 0.2746 1
Plasmodium falciparum glutathione S-transferase 0.0078 0.1637 0.5946
Toxoplasma gondii oxidoreductase, short chain dehydrogenase/reductase family protein 0.0119 0.2746 1
Brugia malayi oxidoreductase, short chain dehydrogenase/reductase family protein 0.0119 0.2746 1
Leishmania major short chain dehydrogenase, putative 0.0119 0.2746 1
Entamoeba histolytica hypothetical protein 0.0119 0.2746 0.5
Trichomonas vaginalis short-chain dehydrogenase, putative 0.0119 0.2746 1
Loa Loa (eye worm) hypothetical protein 0.0119 0.2746 1
Trypanosoma cruzi short chain dehydrogenase/reductase, putative 0.0119 0.2746 1
Giardia lamblia Reductase, putative 0.0119 0.2746 0.5
Entamoeba histolytica 3-ketodihydrosphingosine reductase protein, putative 0.0119 0.2746 0.5
Brugia malayi oxidoreductase, short chain dehydrogenase/reductase family protein 0.0119 0.2746 1
Mycobacterium ulcerans short chain dehydrogenase 0.0386 1 1
Loa Loa (eye worm) hypothetical protein 0.0119 0.2746 1
Toxoplasma gondii oxidoreductase, putative 0.0119 0.2746 1
Echinococcus multilocularis glutathione s transferase mu 0.0078 0.1637 0.1842
Brugia malayi oxidoreductase, short chain dehydrogenase/reductase family protein 0.0119 0.2746 1
Trypanosoma cruzi short-chain dehydrogenase, putative 0.0119 0.2746 1
Brugia malayi oxidoreductase, short chain dehydrogenase/reductase family protein 0.0119 0.2746 1
Leishmania major quinonoid dihydropteridine reductase 0.0119 0.2746 1
Trichomonas vaginalis short-chain dehydrogenases/reductase, putative 0.0119 0.2746 1
Trypanosoma cruzi hypothetical protein, conserved 0.0119 0.2746 1

Activities

Activity type Activity value Assay description Source Reference
Potency (functional) = 0.3162 um PUBCHEM_BIOASSAY: qHTS Assay for Modulators of Lamin A Splicing. (Class of assay: confirmatory) ChEMBL. No reference
Potency (binding) = 14.1254 um PUBCHEM_BIOASSAY: qHTS Assay for Identification of Novel General Anesthetics. In this assay, a GABAergic mimetic model system, apoferritin and a profluorescent 1-aminoanthracene ligand (1-AMA), was used to construct a competitive binding assay for identification of novel general anesthetics (Class of assay: confirmatory) [Related pubchem assays: 2385 (Probe Development Summary for Identification of Novel General Anesthetics), 2323 (Validation apoferritin assay run on SigmaAldrich LOPAC1280 collection)] ChEMBL. No reference
Potency (binding) = 31.6228 um PUBCHEM_BIOASSAY: qHTS for Inhibitors of Tau Fibril Formation, Thioflavin T Binding. (Class of assay: confirmatory) [Related pubchem assays: 596 ] ChEMBL. No reference
Potency (functional) 35.4813 uM PubChem BioAssay. qHTS of TDP-43 Inhibitors. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 79.4328 uM PubChem BioAssay. qHTS of PTHR Inhibitors: Primary Screen. (Class of assay: confirmatory) ChEMBL. No reference

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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