Detailed information for compound 349751

Basic information

Technical information
  • TDR Targets ID: 349751
  • Name: 10-ethyl-8-pyridin-4-yl-[1,2]thiazolo[5,4-b]q uinolizine-3,4-dione
  • MW: 323.369 | Formula: C17H13N3O2S
  • H donors: 1 H acceptors: 3 LogP: 1.06 Rotable bonds: 2
    Rule of 5 violations (Lipinski): 1
  • SMILES: CCc1c2cc(ccn2c(=O)c2c1s[nH]c2=O)c1ccncc1
  • InChi: 1S/C17H13N3O2S/c1-2-12-13-9-11(10-3-6-18-7-4-10)5-8-20(13)17(22)14-15(12)23-19-16(14)21/h3-9H,2H2,1H3,(H,19,21)
  • InChiKey: KSKYADHIJGMLQL-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • 10-ethyl-8-(4-pyridyl)isothiazolo[5,4-b]quinolizine-3,4-dione
  • 10-ethyl-8-(4-pyridyl)isothiazolo[5,4-b]quinolizine-3,4-quinone

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Escherichia coli DNA gyrase (type II topoisomerase), subunit A Starlite/ChEMBL References
Staphylococcus aureus Topoisomerase IV subunit A Starlite/ChEMBL References
Escherichia coli DNA gyrase, subunit B References

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Mycobacterium leprae Probable DNA gyrase (subunit B) GyrB (DNA topoisomerase (ATP-hydrolysing)) (DNA topoisomerase II) (Type II DNA topoisomerase) Get druggable targets OG5_128755 All targets in OG5_128755
Trypanosoma cruzi mitochondrial DNA topoisomerase II, putative Get druggable targets OG5_128755 All targets in OG5_128755
Trypanosoma congolense DNA topoisomerase II, putative Get druggable targets OG5_128755 All targets in OG5_128755
Leishmania mexicana mitochondrial DNA topoisomerase II Get druggable targets OG5_128755 All targets in OG5_128755
Mycobacterium ulcerans DNA gyrase subunit A Get druggable targets OG5_129568 All targets in OG5_129568
Treponema pallidum DNA gyrase, subunit A (gyrA) Get druggable targets OG5_129568 All targets in OG5_129568
Wolbachia endosymbiont of Brugia malayi DNA gyrase subunit A Get druggable targets OG5_129568 All targets in OG5_129568
Mycobacterium leprae Probable DNA gyrase (subunit A) GyrA (DNA topoisomerase (ATP-hydrolysing)) (DNA topoisomerase II) (Type II DNA topoisomerase) Get druggable targets OG5_129568 All targets in OG5_129568
Neospora caninum DNA gyrase subunit A, putative Get druggable targets OG5_129568 All targets in OG5_129568
Plasmodium falciparum DNA gyrase subunit B Get druggable targets OG5_128755 All targets in OG5_128755
Leishmania donovani mitochondrial DNA topoisomerase II Get druggable targets OG5_128755 All targets in OG5_128755
Chlamydia trachomatis DNA gyrase subunit A Get druggable targets OG5_129568 All targets in OG5_129568
Plasmodium berghei DNA gyrase subunit B, putative Get druggable targets OG5_128755 All targets in OG5_128755
Babesia bovis DNA gyrase A subunit, putative Get druggable targets OG5_129568 All targets in OG5_129568
Leishmania major mitochondrial DNA topoisomerase II Get druggable targets OG5_128755 All targets in OG5_128755
Trypanosoma cruzi mitochondrial DNA topoisomerase II, putative Get druggable targets OG5_128755 All targets in OG5_128755
Chlamydia trachomatis DNA gyrase subunit B Get druggable targets OG5_128755 All targets in OG5_128755
Plasmodium knowlesi DNA gyrase subunit A, putative Get druggable targets OG5_129568 All targets in OG5_129568
Treponema pallidum DNA gyrase, subunit B (gyrB) Get druggable targets OG5_128755 All targets in OG5_128755
Plasmodium yoelii DNA gyrase subunit a-related Get druggable targets OG5_129568 All targets in OG5_129568
Babesia bovis DNA gyrase subunit B, putative Get druggable targets OG5_128755 All targets in OG5_128755
Toxoplasma gondii ATPase/histidine kinase/DNA gyrase B/HSP90 domain-containing protein Get druggable targets OG5_128755 All targets in OG5_128755
Leishmania infantum mitochondrial DNA topoisomerase II Get druggable targets OG5_128755 All targets in OG5_128755
Wolbachia endosymbiont of Brugia malayi DNA gyrase, topoisomerase II, B subunit, GyrB Get druggable targets OG5_128755 All targets in OG5_128755
Plasmodium knowlesi DNA gyrase subunit B, putative Get druggable targets OG5_128755 All targets in OG5_128755
Trypanosoma brucei gambiense DNA topoisomerase II, putative Get druggable targets OG5_128755 All targets in OG5_128755
Plasmodium falciparum DNA gyrase subunit A Get druggable targets OG5_129568 All targets in OG5_129568
Plasmodium yoelii DNA topoisomerase II, putative Get druggable targets OG5_128755 All targets in OG5_128755
Mycobacterium ulcerans DNA gyrase subunit B Get druggable targets OG5_128755 All targets in OG5_128755
Toxoplasma gondii DNA gyrase/topoisomerase IV, A subunit domain-containing protein Get druggable targets OG5_129568 All targets in OG5_129568
Leishmania braziliensis mitochondrial DNA topoisomerase II Get druggable targets OG5_128755 All targets in OG5_128755
Plasmodium berghei DNA gyrase subunit A, putative Get druggable targets OG5_129568 All targets in OG5_129568
Theileria parva DNA gyrase subunit A, putative Get druggable targets OG5_129568 All targets in OG5_129568
Plasmodium vivax DNA gyrase subunit A, putative Get druggable targets OG5_129568 All targets in OG5_129568
Mycobacterium tuberculosis DNA gyrase (subunit A) GyrA (DNA topoisomerase (ATP-hydrolysing)) (DNA topoisomerase II) (type II DNA topoisomerase) Get druggable targets OG5_129568 All targets in OG5_129568
Mycobacterium tuberculosis DNA gyrase (subunit B) GyrB (DNA topoisomerase (ATP-hydrolysing)) (DNA topoisomerase II) (type II DNA topoisomerase) Get druggable targets OG5_128755 All targets in OG5_128755
Plasmodium vivax DNA gyrase subunit B, putative Get druggable targets OG5_128755 All targets in OG5_128755
Theileria parva DNA gyrase subunit B, putative Get druggable targets OG5_128755 All targets in OG5_128755
Trypanosoma brucei DNA topoisomerase ii Get druggable targets OG5_128755 All targets in OG5_128755
Neospora caninum hypothetical protein Get druggable targets OG5_128755 All targets in OG5_128755
By sequence similarity to non orthologous known druggable targets
Species Potential target Known druggable target Length Alignment span Identity
Mycobacterium tuberculosis DNA gyrase (subunit A) GyrA (DNA topoisomerase (ATP-hydrolysing)) (DNA topoisomerase II) (type II DNA topoisomerase) Topoisomerase IV subunit A   800 aa 775 aa 37.3 %
Treponema pallidum DNA gyrase, subunit A (gyrA) Topoisomerase IV subunit A   800 aa 716 aa 40.6 %
Mycobacterium ulcerans DNA gyrase subunit A Topoisomerase IV subunit A   800 aa 775 aa 37.5 %
Chlamydia trachomatis DNA gyrase subunit A Topoisomerase IV subunit A   800 aa 723 aa 40.0 %
Wolbachia endosymbiont of Brugia malayi DNA gyrase subunit A Topoisomerase IV subunit A   800 aa 730 aa 36.8 %
Mycobacterium leprae Probable DNA gyrase (subunit A) GyrA (DNA topoisomerase (ATP-hydrolysing)) (DNA topoisomerase II) (Type II DNA topoisomerase) Topoisomerase IV subunit A   800 aa 676 aa 33.9 %
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Echinococcus granulosus endonuclease exonuclease phosphatase 0.0186 0.3344 1
Onchocerca volvulus 0.0159 0.2757 1
Leishmania major cathepsin L-like protease 0.0159 0.2757 1
Echinococcus granulosus polycomb protein SCMH1 0.0047 0.0259 0.0774
Brugia malayi Cathepsin L-like precursor 0.0107 0.1584 0.5664
Leishmania major cathepsin L-like protease 0.0159 0.2757 1
Trypanosoma cruzi cysteine peptidase, putative 0.0159 0.2757 1
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0159 0.2757 1
Trypanosoma cruzi cysteine proteinase, putative 0.0082 0.1037 0.2757
Loa Loa (eye worm) TOPoisomerase family member 0.0102 0.1477 0.5265
Schistosoma mansoni sex comb on midleg homolog 0.0047 0.0259 0.008
Entamoeba histolytica cysteine protease, putative 0.0159 0.2757 1
Leishmania major cathepsin L-like protease 0.0159 0.2757 1
Plasmodium falciparum DNA gyrase subunit B 0.0153 0.2617 0.1762
Plasmodium falciparum cysteine proteinase falcipain 2a 0.0159 0.2757 0.1919
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0159 0.2757 1
Brugia malayi cathepsin L-like precursor 0.0107 0.1584 0.5664
Schistosoma mansoni DNA topoisomerase II 0.0102 0.1477 0.2347
Brugia malayi Papain family cysteine protease containing protein 0.0082 0.1037 0.3641
Plasmodium vivax unspecified product 0.0082 0.1037 0.0681
Schistosoma mansoni cathepsin F (C01 family) 0.0159 0.2757 0.4731
Brugia malayi cathepsin L-like cysteine proteinase, identical 0.0053 0.0382 0.1221
Plasmodium falciparum cysteine proteinase falcipain 3 0.0159 0.2757 0.1919
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0159 0.2757 1
Schistosoma mansoni sex comb on midleg homolog 0.0047 0.0259 0.008
Loa Loa (eye worm) hypothetical protein 0.0053 0.0382 0.1216
Echinococcus granulosus cathepsin L 0.0082 0.1037 0.3101
Plasmodium vivax vivapain-2 0.0159 0.2757 0.2469
Echinococcus multilocularis cathepsin l cysteine peptidase 0.0159 0.2757 0.8244
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0045 0.0216 0.0645
Brugia malayi cathepsin F-like cysteine proteinase 0.0053 0.0382 0.1221
Trypanosoma cruzi cysteine peptidase (N-terminal), putative 0.0082 0.1037 0.2757
Loa Loa (eye worm) hypothetical protein 0.0066 0.0681 0.232
Onchocerca volvulus Cathepsin F homolog 0.0159 0.2757 1
Brugia malayi DNA gyrase/topoisomerase IV, A subunit family protein 0.0102 0.1477 0.5267
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0159 0.2757 1
Entamoeba histolytica cysteine proteinase, putative 0.0159 0.2757 1
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0159 0.2757 1
Echinococcus granulosus cathepsin l1 0.0159 0.2757 0.8244
Loa Loa (eye worm) Papain cysteine protease/cathepsin propeptide inhibitor-containing protein 0.0159 0.2757 1
Brugia malayi Cathepsin L-like precursor 0.0107 0.1584 0.5664
Schistosoma mansoni cathepsin F (C01 family) 0.0107 0.1584 0.2547
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0159 0.2757 1
Echinococcus multilocularis histone acetyltransferase MYST2 0.0054 0.0404 0.1208
Plasmodium vivax DNA gyrase subunit A, putative 0.0484 1 1
Loa Loa (eye worm) hypothetical protein 0.004 0.0106 0.0193
Echinococcus granulosus bromodomain adjacent to zinc finger domain 0.0059 0.0523 0.1563
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0107 0.1584 0.3182
Loa Loa (eye worm) hypothetical protein 0.0042 0.0148 0.0348
Trichomonas vaginalis DNA topoisomerase II, putative 0.0102 0.1477 0.2557
Echinococcus multilocularis SAM and MBT domain containing protein 0.0047 0.0259 0.0774
Trypanosoma brucei DNA topoisomerase II alpha, putative 0.0091 0.1233 0.1141
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0159 0.2757 1
Chlamydia trachomatis DNA gyrase subunit B 0.0153 0.2617 0.2077
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0159 0.2757 1
Onchocerca volvulus 0.0159 0.2757 1
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0159 0.2757 1
Loa Loa (eye worm) papain family cysteine protease containing protein 0.0159 0.2757 1
Echinococcus multilocularis endonuclease exonuclease phosphatase 0.0186 0.3344 1
Onchocerca volvulus Putative DNA topoisomerase 2, mitochondrial 0.0102 0.1477 0.4876
Schistosoma mansoni scm-relatedprotein containing 4 mbt domains (sfmbt) 0.0047 0.0259 0.008
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0159 0.2757 1
Leishmania major cathepsin L-like protease 0.0159 0.2757 1
Schistosoma mansoni SmCL2-like peptidase (C01 family) 0.0082 0.1037 0.1529
Onchocerca volvulus DNA topoisomerase 2 homolog 0.0102 0.1477 0.4876
Plasmodium vivax DNA topoisomerase II, putative 0.0102 0.1477 0.1138
Echinococcus granulosus cathepsin l cysteine peptidase 0.0159 0.2757 0.8244
Mycobacterium ulcerans DNA gyrase subunit A 0.0484 1 1
Loa Loa (eye worm) hypothetical protein 0.0107 0.1584 0.5662
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0045 0.0216 0.0605
Trypanosoma cruzi cysteine peptidase, putative 0.0159 0.2757 1
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0159 0.2757 1
Trypanosoma cruzi cysteine peptidase, clan CA, family C1, cathepsin L-like, putative 0.0107 0.1584 0.5061
Treponema pallidum DNA gyrase, subunit A (gyrA) 0.0484 1 1
Echinococcus granulosus histone acetyltransferase MYST2 0.0054 0.0404 0.1208
Echinococcus multilocularis DNA topoisomerase 2 alpha 0.0102 0.1477 0.4416
Loa Loa (eye worm) fibroinase 0.0159 0.2757 1
Giardia lamblia DNA topoisomerase II 0.0097 0.137 0.5
Echinococcus multilocularis cathepsin L cysteine protease 0.0159 0.2757 0.8244
Brugia malayi C2-HC type zinc finger protein C.e-MyT1 0.0054 0.0404 0.1301
Trypanosoma cruzi cruzipain precursor, putative 0.0159 0.2757 1
Trypanosoma cruzi cysteine proteinase, putative 0.0082 0.1037 0.2757
Brugia malayi Cathepsin L-like precursor 0.0159 0.2757 1
Brugia malayi mbt repeat family protein 0.0047 0.0259 0.0764
Trypanosoma cruzi mitochondrial DNA topoisomerase II, putative 0.0154 0.265 0.9548
Toxoplasma gondii DNA gyrase/topoisomerase IV, A subunit domain-containing protein 0.0484 1 1
Plasmodium falciparum cysteine proteinase falcipain 2b 0.0159 0.2757 0.1919
Trypanosoma cruzi DNA topoisomerase II, putative 0.0091 0.1233 0.3583
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0159 0.2757 1
Schistosoma mansoni myelin transcription factor 1 myt1 0.0054 0.0404 0.035
Echinococcus multilocularis cysteine protease 0.0159 0.2757 0.8244
Loa Loa (eye worm) papain family cysteine protease containing protein 0.0053 0.0382 0.1216
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0159 0.2757 1
Plasmodium vivax vivapain-3 0.0082 0.1037 0.0681
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0045 0.0216 0.06
Leishmania major mitochondrial DNA topoisomerase II 0.0154 0.265 0.9296
Loa Loa (eye worm) hypothetical protein 0.0159 0.2757 1
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0045 0.0216 0.0645
Echinococcus multilocularis cathepsin L cysteine protease 0.0159 0.2757 0.8244
Toxoplasma gondii cathepsin CPL 0.0159 0.2757 0.1789
Schistosoma mansoni SmCL2-like peptidase (C01 family) 0.0082 0.1037 0.1529
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0159 0.2757 1
Echinococcus multilocularis bromodomain adjacent to zinc finger domain 0.0059 0.0523 0.1563
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0045 0.0216 0.0645
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0159 0.2757 1
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0159 0.2757 1
Schistosoma mansoni SmCL2-like peptidase (C01 family) 0.0082 0.1037 0.1529
Leishmania major cathepsin L-like protease 0.0159 0.2757 1
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0045 0.0216 0.0645
Plasmodium vivax vivapain-2 0.0159 0.2757 0.2469
Loa Loa (eye worm) hypothetical protein 0.0047 0.0259 0.0759
Brugia malayi Papain family cysteine protease containing protein 0.0082 0.1037 0.3641
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0159 0.2757 1
Loa Loa (eye worm) hypothetical protein 0.007 0.0765 0.2632
Onchocerca volvulus 0.0159 0.2757 1
Brugia malayi DNA topoisomerase II, alpha isozyme 0.0102 0.1477 0.5267
Echinococcus granulosus cathepsin L cysteine proteinase 0.0159 0.2757 0.8244
Leishmania major cysteine peptidase A (CPA) 0.0159 0.2757 1
Echinococcus multilocularis cathepsin L 0.0082 0.1037 0.3101
Loa Loa (eye worm) hypothetical protein 0.0053 0.0382 0.1216
Onchocerca volvulus 0.0159 0.2757 1
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0159 0.2757 1
Entamoeba histolytica cysteine proteinase, putative 0.0107 0.1584 0.3182
Echinococcus multilocularis cathepsin l cysteine peptidase 0.0159 0.2757 0.8244
Echinococcus granulosus suppression of tumorigenicity 18 protein 0.0054 0.0404 0.1208
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0159 0.2757 1
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0159 0.2757 1
Echinococcus granulosus cysteine protease 0.0082 0.1037 0.3101
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0159 0.2757 1
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0159 0.2757 1
Mycobacterium tuberculosis DNA gyrase (subunit A) GyrA (DNA topoisomerase (ATP-hydrolysing)) (DNA topoisomerase II) (type II DNA topoisomerase) 0.0484 1 1
Echinococcus granulosus cathepsin L cysteine protease 0.0082 0.1037 0.3101
Loa Loa (eye worm) mbt repeat family protein 0.0047 0.0259 0.0759
Plasmodium vivax vivapain-1 0.0082 0.1037 0.0681
Schistosoma mansoni hypothetical protein 0.0286 0.5588 1
Schistosoma mansoni cathepsin s 0.0053 0.0382 0.031
Echinococcus granulosus SAM and MBT domain containing protein 0.0047 0.0259 0.0774
Loa Loa (eye worm) cysteine protease 0.0159 0.2757 1
Trypanosoma brucei DNA topoisomerase II beta, putative 0.0091 0.1233 0.1141
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0159 0.2757 1
Brugia malayi Cathepsin L-like cysteine proteinase 0.0107 0.1584 0.5664
Entamoeba histolytica DNA topoisomerase II, putative 0.0102 0.1477 0.2557
Echinococcus multilocularis polycomb protein SCMH1 0.0047 0.0259 0.0774
Loa Loa (eye worm) hypothetical protein 0.0053 0.0382 0.1216
Brugia malayi Cathepsin L-like precursor 0.0159 0.2757 1
Brugia malayi Cathepsin L-like precursor 0.0159 0.2757 1
Leishmania major cathepsin L-like protease 0.0159 0.2757 1
Brugia malayi Cathepsin L-like precursor 0.0159 0.2757 1
Echinococcus multilocularis suppression of tumorigenicity 18 protein 0.0054 0.0404 0.1208
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0159 0.2757 1
Brugia malayi Probable DNA topoisomerase II 0.0102 0.1477 0.5267
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0107 0.1584 0.3182
Entamoeba histolytica cysteine proteinase, putative 0.0159 0.2757 1
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0159 0.2757 1
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0159 0.2757 1
Leishmania major cathepsin L-like protease 0.0159 0.2757 1
Trypanosoma cruzi cysteine peptidase, putative 0.0082 0.1037 0.2757
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0159 0.2757 1
Brugia malayi Cathepsin L-like precursor 0.0159 0.2757 1
Trypanosoma brucei DNA topoisomerase ii 0.0154 0.265 0.9377
Echinococcus granulosus cathepsin l1 0.0107 0.1584 0.4737
Onchocerca volvulus 0.0159 0.2757 1
Trichomonas vaginalis Clan CA, family C1, cathepsin L or K-like cysteine peptidase 0.0159 0.2757 1
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0159 0.2757 1
Loa Loa (eye worm) hypothetical protein 0.0066 0.0681 0.232
Onchocerca volvulus 0.0107 0.1584 0.5306
Brugia malayi Cathepsin L-like precursor 0.0053 0.0382 0.1221
Brugia malayi Cathepsin L-like precursor 0.0159 0.2757 1
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0159 0.2757 1
Mycobacterium leprae Probable DNA gyrase (subunit A) GyrA (DNA topoisomerase (ATP-hydrolysing)) (DNA topoisomerase II) (Type II DNA topoisomerase) 0.0152 0.2586 1
Onchocerca volvulus 0.0159 0.2757 1
Toxoplasma gondii DNA topoisomerase 2, putative 0.0102 0.1477 0.0338
Plasmodium vivax DNA gyrase subunit B, putative 0.0153 0.2617 0.2323
Echinococcus granulosus DNA topoisomerase 2 alpha 0.0102 0.1477 0.4416
Onchocerca volvulus Cathepsin L homolog 0.0159 0.2757 1
Trypanosoma cruzi cysteine protease, putative 0.0082 0.1037 0.2757
Plasmodium falciparum DNA gyrase subunit A 0.0484 1 1
Chlamydia trachomatis DNA gyrase subunit B 0.01 0.1444 0.0819
Brugia malayi Papain family cysteine protease containing protein 0.0159 0.2757 1
Trypanosoma cruzi mitochondrial DNA topoisomerase II, putative 0.0154 0.265 0.9548
Leishmania major cathepsin L-like protease 0.0159 0.2757 1
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0159 0.2757 1
Schistosoma mansoni bromodomain containing protein 0.0062 0.0602 0.0718
Onchocerca volvulus Cathepsin L homolog 0.0159 0.2757 1
Loa Loa (eye worm) hypothetical protein 0.0107 0.1584 0.5662
Loa Loa (eye worm) ctsf protein 0.0159 0.2757 1
Trypanosoma cruzi cysteine peptidase, putative 0.0159 0.2757 1
Onchocerca volvulus DNA topoisomerase 2 homolog 0.0102 0.1477 0.4876
Wolbachia endosymbiont of Brugia malayi DNA gyrase subunit A 0.0484 1 1
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0159 0.2757 1
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0159 0.2757 1
Brugia malayi mbt repeat family protein 0.0047 0.0259 0.0764
Trypanosoma cruzi DNA topoisomerase II, putative 0.0091 0.1233 0.3583
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0159 0.2757 1
Brugia malayi Bromodomain containing protein 0.0074 0.0859 0.2984
Loa Loa (eye worm) hypothetical protein 0.0107 0.1584 0.5662
Schistosoma mansoni cathepsin F (C01 family) 0.0159 0.2757 0.4731
Trypanosoma cruzi cysteine peptidase, putative 0.0159 0.2757 1
Echinococcus multilocularis cysteine protease 0.0159 0.2757 0.8244
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0159 0.2757 1
Trichomonas vaginalis Clan CA, family C1, cathepsin L or K-like cysteine peptidase 0.0159 0.2757 1
Loa Loa (eye worm) hypothetical protein 0.0054 0.0404 0.1296
Onchocerca volvulus 0.0159 0.2757 1
Plasmodium falciparum DNA topoisomerase 2 0.0102 0.1477 0.0491
Loa Loa (eye worm) MBCTL1 0.0054 0.0404 0.1296

Activities

Activity type Activity value Assay description Source Reference
Activity (binding) Inhibition of DNA gyrase supercoiling in Staphylococcus aureus ATCC 29213 ChEMBL. 16392790
Activity (binding) Activity against human topoisomerase 2 ChEMBL. 16392790
Activity (binding) 0 Activity against human topoisomerase 2 ChEMBL. 16392790
Activity (binding) 0 Inhibition of DNA gyrase supercoiling in Staphylococcus aureus ATCC 29213 ChEMBL. 16392790
IC50 (binding) = 0.4 uM Inhibition of DNA gyrase supercoiling in Escherichia coli ATCC 25922 ChEMBL. 16392790
IC50 (binding) = 0.4 uM Inhibition of DNA gyrase supercoiling in Escherichia coli ATCC 25922 ChEMBL. 16392790
IC50 (binding) = 8.1 uM Inhibition of topoisomerase 4 decatenation in Staphylococcus aureus ATCC 29213 ChEMBL. 16392790
IC50 (binding) = 8.1 uM Inhibition of topoisomerase 4 decatenation in Staphylococcus aureus ATCC 29213 ChEMBL. 16392790
MIC (functional) = 0.125 ug ml-1 Antibacterial activity against Staphylococcus aureus ATCC 29213 ChEMBL. 16392790
MIC (functional) = 0.25 ug ml-1 Antibacterial activity against Escherichia coli ATCC 25922 ChEMBL. 16392790
MIC (functional) = 0.25 ug ml-1 Antibacterial activity against Escherichia coli ATCC 25922 ChEMBL. 16392790

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

1 literature reference was collected for this gene.

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