Detailed information for compound 226393

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 294.734 | Formula: C14H15ClN2O3
  • H donors: 1 H acceptors: 3 LogP: 2.61 Rotable bonds: 4
    Rule of 5 violations (Lipinski): 1
  • SMILES: COC(=O)[C@H]1[C@H](C)CC(=CC1=O)Nc1ccc(cn1)Cl
  • InChi: 1S/C14H15ClN2O3/c1-8-5-10(6-11(18)13(8)14(19)20-2)17-12-4-3-9(15)7-16-12/h3-4,6-8,13H,5H2,1-2H3,(H,16,17)/t8-,13+/m1/s1
  • InChiKey: BFAOEAQFZQPPRV-OQPBUACISA-N  


Substructure search Similarity search

Network

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Synonyms

No synonyms found for this compound

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
Mycobacterium tuberculosis Two component sensor kinase MprB 0.0088 0.0044 0.0044
Echinococcus granulosus intermediate filament protein 0.0029 0.0002 0.0027
Toxoplasma gondii ABC1 family protein 0.0039 0.0009 0.0053
Echinococcus multilocularis lamin 0.0029 0.0002 0.0027
Leishmania major heat shock protein 83-1 0.0114 0.0062 0.0533
Leishmania major heat shock protein 83-1 0.0114 0.0062 0.0533
Loa Loa (eye worm) hypothetical protein 0.0568 0.038 0.4323
Trichomonas vaginalis prokaryotic DNA topoisomerase, putative 0.0121 0.0067 0.0759
Trypanosoma brucei heat shock protein, putative 0.0114 0.0062 0.0457
Onchocerca volvulus 0.0121 0.0067 0.0996
Leishmania major heat shock protein 83-1 0.0114 0.0062 0.0533
Trypanosoma cruzi DNA topoisomerase III, putative 0.0121 0.0067 0.0572
Trypanosoma cruzi DNA topoisomerase IA, putative 0.0121 0.0067 0.0572
Loa Loa (eye worm) hypothetical protein 0.0568 0.038 0.4323
Plasmodium falciparum endoplasmin, putative 0.0102 0.0053 0.0095
Wolbachia endosymbiont of Brugia malayi topoisomerase IA, TopA 0.0121 0.0067 0.0648
Loa Loa (eye worm) pre-SET domain-containing protein family protein 0.0228 0.0141 0.1593
Trypanosoma cruzi DNA topoisomerase IA, putative 0.0121 0.0067 0.0572
Loa Loa (eye worm) DNA topoisomerase III 0.0121 0.0067 0.0738
Chlamydia trachomatis DNA gyrase subunit B 0.1081 0.0739 0.708
Loa Loa (eye worm) endoplasmin 0.0114 0.0062 0.0686
Trichomonas vaginalis penicillin-binding protein, putative 0.0039 0.0009 0.0106
Loa Loa (eye worm) DNA topoisomerase III beta-1 0.0121 0.0067 0.0738
Trypanosoma brucei DNA topoisomerase III, putative 0.0121 0.0067 0.0496
Loa Loa (eye worm) hypothetical protein 0.0726 0.049 0.5589
Brugia malayi DNA topoisomerase III beta-1 0.0121 0.0067 0.0734
Echinococcus multilocularis Pyruvate dehydrogenase (lipoamide) kinase 0.0088 0.0044 0.0499
Brugia malayi beta-lactamase family protein 0.0039 0.0009 0.0079
Schistosoma mansoni hypothetical protein 0.0184 0.0111 0.1244
Trypanosoma cruzi DNA topoisomerase III, putative 0.0121 0.0067 0.0572
Trypanosoma cruzi heat shock protein 85, putative 0.0114 0.0062 0.0533
Echinococcus multilocularis histone lysine methyltransferase setb histone lysine methyltransferase eggless 0.0033 0.0005 0.0053
Mycobacterium tuberculosis Possible two component sensor kinase 0.0088 0.0044 0.0044
Trichomonas vaginalis D-aminoacylase, putative 0.0039 0.0009 0.0106
Treponema pallidum DNA gyrase, subunit B (gyrB) 0.1491 0.1026 1
Trypanosoma cruzi cysteine peptidase, clan CA, family C1, cathepsin L-like, putative 0.0063 0.0026 0.0226
Entamoeba histolytica DNA topoisomerase II, putative 0.1276 0.0876 1
Echinococcus granulosus heat shock protein 0.0114 0.0062 0.0707
Giardia lamblia DNA topoisomerase III 0.0121 0.0067 0.0817
Echinococcus granulosus beta LACTamase domain containing family member 0.0039 0.0009 0.0106
Leishmania major DNA topoisomerase III, putative 0.0121 0.0067 0.0572
Trypanosoma brucei heat shock protein, putative 0.0114 0.0062 0.0457
Schistosoma mansoni glutaminase 0.0298 0.019 0.2151
Mycobacterium tuberculosis DNA gyrase (subunit A) GyrA (DNA topoisomerase (ATP-hydrolysing)) (DNA topoisomerase II) (type II DNA topoisomerase) 0.0628 0.0422 0.0422
Wolbachia endosymbiont of Brugia malayi signal transduction histidine kinase and receiver 0.0088 0.0044 0.0426
Brugia malayi Endoplasmin precursor 0.0114 0.0062 0.0682
Trichomonas vaginalis two component sensor and regulator histidine kinase bacteria, putative 0.0088 0.0044 0.0499
Echinococcus multilocularis DNA topoisomerase 2 alpha 0.1276 0.0876 1
Echinococcus granulosus geminin 0.0184 0.0111 0.1268
Mycobacterium leprae Probable integral membrane indolylacetylinositol arabinosyltransferase EmbB (arabinosylindolylacetylinositol synthase) 1.4301 1 1
Trypanosoma cruzi heat shock protein 90, putative 0.0114 0.0062 0.0533
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0069 0.003 0.0184
Wolbachia endosymbiont of Brugia malayi membrane associated signal transduction histidine kinase 0.0088 0.0044 0.0426
Echinococcus granulosus Pyruvate dehydrogenase lipoamide kinase 0.0088 0.0044 0.0499
Echinococcus granulosus 5'partial|histone lysine N methyltransferase SETDB2 0.0031 0.0004 0.0044
Loa Loa (eye worm) hypothetical protein 0.0139 0.0079 0.0881
Onchocerca volvulus 0.0039 0.0009 0.0107
Chlamydia trachomatis DNA gyrase subunit A 0.0628 0.0422 0.385
Mycobacterium tuberculosis Conserved protein 0.0039 0.0009 0.0009
Echinococcus multilocularis musashi 0.0029 0.0002 0.0027
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0033 0.0005 0.0026
Leishmania major hypothetical protein, conserved 0.0088 0.0044 0.0376
Mycobacterium ulcerans integral membrane indolylacetylinositol arabinosyltransferase EmbB 1.4301 1 1
Trypanosoma cruzi major cysteine proteinase, putative 0.0055 0.002 0.0172
Trypanosoma brucei DNA topoisomerase II beta, putative 0.1155 0.0791 0.6779
Trypanosoma brucei heat shock protein, putative 0.0114 0.0062 0.0457
Mycobacterium tuberculosis Integral membrane indolylacetylinositol arabinosyltransferase EmbC (arabinosylindolylacetylinositol synthase) 1.4301 1 1
Leishmania major heat shock protein 83-1 0.0114 0.0062 0.0533
Leishmania major heat shock protein 83-1 0.0114 0.0062 0.0533
Schistosoma mansoni heat shock protein 0.0114 0.0062 0.0682
Trypanosoma cruzi developmentally regulated phosphoprotein, putative 0.0088 0.0044 0.0376
Trypanosoma cruzi cysteine peptidase, putative 0.0069 0.003 0.0262
Leishmania major DNA topoisomerase 1A 0.0121 0.0067 0.0572
Loa Loa (eye worm) hypothetical protein 0.0039 0.0009 0.0083
Mycobacterium tuberculosis DNA gyrase (subunit B) GyrB (DNA topoisomerase (ATP-hydrolysing)) (DNA topoisomerase II) (type II DNA topoisomerase) 0.1491 0.1026 0.1026
Mycobacterium tuberculosis Integral membrane indolylacetylinositol arabinosyltransferase EmbB (arabinosylindolylacetylinositol synthase) 1.4301 1 1
Trichomonas vaginalis sensor histidine kinase, putative 0.0088 0.0044 0.0499
Brugia malayi heat shock protein 90 0.0114 0.0062 0.0682
Trichomonas vaginalis glutaminase, putative 0.0298 0.019 0.2173
Loa Loa (eye worm) TOPoisomerase family member 0.1276 0.0876 1
Plasmodium falciparum heat shock protein 90 0.0114 0.0062 0.0185
Plasmodium vivax endoplasmin, putative 0.0114 0.0062 0.0561
Mycobacterium tuberculosis Probable lipase LipE 0.0039 0.0009 0.0009
Echinococcus granulosus DNA topoisomerase 2 alpha 0.1276 0.0876 1
Trypanosoma brucei developmentally regulated phosphoprotein 0.0088 0.0044 0.0299
Trypanosoma brucei Heat shock protein 83, putative 0.0114 0.0062 0.0457
Trichomonas vaginalis D-aminoacylase, putative 0.0039 0.0009 0.0106
Leishmania major developmentally regulated phosphoprotein-like protein 0.0088 0.0044 0.0376
Trypanosoma cruzi heat shock protein 90, putative 0.0101 0.0053 0.0452
Mycobacterium leprae PUTATIVE TWO COMPONENT SENSOR HISTIDINE KINASE SENX3 0.0088 0.0044 0.0044
Leishmania major heat shock protein 83-1 0.0114 0.0062 0.0533
Toxoplasma gondii DNA topoisomerase family protein 0.0121 0.0067 0.071
Echinococcus multilocularis lamin dm0 0.0029 0.0002 0.0027
Mycobacterium ulcerans two component system response phosphate sensor kinase, PhoR 0.0088 0.0044 0.0044
Trypanosoma cruzi DNA topoisomerase II, putative 0.1155 0.0791 0.6804
Entamoeba histolytica DNA topoisomerase III, putative 0.0121 0.0067 0.0056
Onchocerca volvulus Putative DNA topoisomerase 2, mitochondrial 0.0949 0.0647 1
Loa Loa (eye worm) hypothetical protein 0.0088 0.0044 0.0478
Plasmodium falciparum DNA gyrase subunit B 0.1491 0.1026 1
Mycobacterium ulcerans putative regultory protein 0.0088 0.0044 0.0044
Mycobacterium ulcerans lipase LipD 0.0039 0.0009 0.0009
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0069 0.003 0.0184
Schistosoma mansoni hypothetical protein 0.0184 0.0111 0.1244
Loa Loa (eye worm) hypothetical protein 0.0139 0.0079 0.0881
Onchocerca volvulus 0.0039 0.0009 0.0107
Mycobacterium tuberculosis Probable esterase LipL 0.0039 0.0009 0.0009
Mycobacterium leprae Probable DNA gyrase (subunit A) GyrA (DNA topoisomerase (ATP-hydrolysing)) (DNA topoisomerase II) (Type II DNA topoisomerase) 0.0196 0.0119 0.0119
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0069 0.003 0.0184
Trypanosoma brucei heat shock protein 90, putative 0.0114 0.0062 0.0457
Trichomonas vaginalis set domain proteins, putative 0.0259 0.0163 0.1863
Onchocerca volvulus 0.0039 0.0009 0.0107
Mycobacterium ulcerans glutaminase 0.0298 0.019 0.019
Echinococcus granulosus histone lysine methyltransferase setb 0.0033 0.0005 0.0053
Mycobacterium leprae Probable lipase LipE 0.0039 0.0009 0.0009
Echinococcus multilocularis atpase aaa+ type core atpase aaa type core 0.0883 0.06 0.6853
Mycobacterium leprae conserved hypothetical protein 0.0039 0.0009 0.0009
Leishmania major DNA topoisomerase III, putative 0.0121 0.0067 0.0572
Trypanosoma brucei heat shock protein, putative 0.0114 0.0062 0.0457
Mycobacterium tuberculosis Two component sensor histidine kinase DosT 0.0088 0.0044 0.0044
Mycobacterium ulcerans two component sensor histidine kinase PrrB 0.0088 0.0044 0.0044
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0069 0.003 0.0184
Loa Loa (eye worm) hypothetical protein 0.0039 0.0009 0.0083
Wolbachia endosymbiont of Brugia malayi DNA gyrase subunit A 0.0628 0.0422 0.4112
Toxoplasma gondii DNA gyrase/topoisomerase IV, A subunit domain-containing protein 0.0628 0.0422 0.4789
Entamoeba histolytica DNA topoisomerase III, putative 0.0121 0.0067 0.0056
Trypanosoma cruzi Heat shock protein 83, putative 0.0114 0.0062 0.0533
Mycobacterium ulcerans two component regulator - sensor kinase 0.0088 0.0044 0.0044
Leishmania major heat shock protein 83-1 0.0114 0.0062 0.0533
Mycobacterium tuberculosis Two component sensor histidine kinase TrcS 0.0088 0.0044 0.0044
Trichomonas vaginalis heat shock protein, putative 0.0102 0.0053 0.0606
Echinococcus granulosus DNA topoisomerase 3 alpha 0.0121 0.0067 0.0759
Trichomonas vaginalis mismatch repair protein Mlh1C (mutL homolog) 0.0088 0.0044 0.0499
Trichomonas vaginalis sensory transduction histidine kinase bacterial, putative 0.0088 0.0044 0.0499
Loa Loa (eye worm) hypothetical protein 0.0139 0.0079 0.0881
Loa Loa (eye worm) hypothetical protein 0.0039 0.0009 0.0083
Trichomonas vaginalis penicillin-binding protein, putative 0.0039 0.0009 0.0106
Brugia malayi beta-lactamase 0.0039 0.0009 0.0079
Trypanosoma cruzi Histidine kinase-, DNA gyrase B-, and HSP90-like ATPase, putative 0.0088 0.0044 0.0376
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0039 0.0009 0.0079
Trichomonas vaginalis prokaryotic DNA topoisomerase, putative 0.0121 0.0067 0.0759
Trichomonas vaginalis D-aminoacylase, putative 0.0039 0.0009 0.0106
Loa Loa (eye worm) glutaminase 2 0.0298 0.019 0.2155
Mycobacterium tuberculosis Two component sensor histidine kinase PrrB 0.0088 0.0044 0.0044
Trypanosoma cruzi cruzipain precursor, putative 0.0069 0.003 0.0262
Loa Loa (eye worm) hypothetical protein 0.0029 0.0002 0.0004
Mycobacterium ulcerans beta-lactamase 0.0039 0.0009 0.0009
Plasmodium vivax DNA gyrase subunit A, putative 0.0628 0.0422 0.4085
Trypanosoma brucei DNA topoisomerase II alpha, putative 0.1155 0.0791 0.6779
Toxoplasma gondii ATPase/histidine kinase/DNA gyrase B/HSP90 domain-containing protein 0.0088 0.0044 0.0448
Chlamydia trachomatis DNA topoisomerase I 0.0121 0.0067 0.0232
Trichomonas vaginalis endoplasmin, putative 0.0102 0.0053 0.0606
Plasmodium vivax hypothetical protein, conserved 0.0088 0.0044 0.0382
Mycobacterium tuberculosis Probable hydrolase 0.0039 0.0009 0.0009
Trypanosoma brucei Histidine kinase-, DNA gyrase B-, and HSP90-like ATPase, putative 0.0088 0.0044 0.0299
Brugia malayi glutaminase DH11.1 0.0298 0.019 0.2151
Mycobacterium ulcerans two component sensor histidine kinase SenX3 0.0088 0.0044 0.0044
Trypanosoma brucei heat shock protein 90, putative 0.0114 0.0062 0.0457
Mycobacterium tuberculosis Two component sensor histidine kinase DevS 0.0088 0.0044 0.0044
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0039 0.0009 0.0079
Treponema pallidum DNA topoisomerase I (topA) 0.0121 0.0067 0.0648
Plasmodium vivax hypothetical protein, conserved 0.0039 0.0009 0.0045
Loa Loa (eye worm) hypothetical protein 0.0033 0.0005 0.0031
Schistosoma mansoni prokaryotic DNA topoisomerase 0.0121 0.0067 0.0734
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0069 0.003 0.0184
Trypanosoma cruzi hypothetical protein, conserved 0.0039 0.0009 0.008
Echinococcus granulosus heat shock protein 90 0.0114 0.0062 0.0707
Trichomonas vaginalis sensory transduction histidine kinase bacterial, putative 0.0088 0.0044 0.0499
Trypanosoma cruzi cysteine peptidase, putative 0.0069 0.003 0.0262
Leishmania major heat shock protein 83-1 0.0114 0.0062 0.0533
Trypanosoma brucei DNA topoisomerase IA, putative 0.0121 0.0067 0.0496
Plasmodium vivax DNA topoisomerase 3, putative 0.0121 0.0067 0.0605
Leishmania major heat shock protein 83-1 0.0114 0.0062 0.0533
Echinococcus multilocularis beta LACTamase domain containing family member 0.0039 0.0009 0.0106
Echinococcus granulosus lamin dm0 0.0029 0.0002 0.0027
Trypanosoma brucei DNA topoisomerase III, putative 0.0121 0.0067 0.0496
Mycobacterium leprae Probable DNA topoisomerase I TopA (omega-protein) (relaxing enzyme) (untwisting enzyme) (swivelase) (type I DNA topoisomerase) ( 0.0121 0.0067 0.0067
Schistosoma mansoni endoplasmin 0.0114 0.0062 0.0682
Chlamydia trachomatis DNA gyrase subunit A 0.026 0.0164 0.1223
Leishmania major heat shock protein 83-1 0.0114 0.0062 0.0533
Trypanosoma cruzi DNA topoisomerase III, putative 0.0121 0.0067 0.0572
Mycobacterium tuberculosis Probable esterase/lipase LipP 0.0039 0.0009 0.0009
Mycobacterium leprae Probable two component sensor kinase MprB 0.0088 0.0044 0.0044
Mycobacterium ulcerans DNA gyrase subunit A 0.0628 0.0422 0.0422
Mycobacterium tuberculosis Integral membrane indolylacetylinositol arabinosyltransferase EmbA (arabinosylindolylacetylinositol synthase) 1.4301 1 1
Mycobacterium tuberculosis Possible conserved lipoprotein LpqK 0.0039 0.0009 0.0009
Echinococcus multilocularis DNA topoisomerase 3 beta 1 0.0121 0.0067 0.0759
Leishmania major heat shock protein 83-1 0.0114 0.0062 0.0533
Schistosoma mansoni endoplasmin 0.0114 0.0062 0.0682
Trypanosoma cruzi mitochondrial DNA topoisomerase II, putative 0.1686 0.1163 1
Echinococcus granulosus DNA topoisomerase 3 beta 1 0.0121 0.0067 0.0759
Loa Loa (eye worm) hypothetical protein 0.0039 0.0009 0.0083
Leishmania major cathepsin L-like protease 0.0069 0.003 0.0262
Mycobacterium ulcerans two component sensor histidine kinase DevS 0.0088 0.0044 0.0044
Giardia lamblia DNA topoisomerase II 0.1188 0.0814 1
Toxoplasma gondii DNA topoisomerase domain-containing protein 0.0121 0.0067 0.071
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0069 0.003 0.0184
Mycobacterium ulcerans two component system membrane associated sensor kinase 0.0088 0.0044 0.0044
Leishmania major heat shock protein 83-1 0.0114 0.0062 0.0533
Onchocerca volvulus 0.0033 0.0005 0.0036
Brugia malayi GRF zinc finger family protein 0.0121 0.0067 0.0734
Trypanosoma cruzi DNA topoisomerase II, putative 0.1155 0.0791 0.6804
Mycobacterium tuberculosis Two component sensor kinase [second part] 0.0088 0.0044 0.0044
Schistosoma mansoni prokaryotic DNA topoisomerase 0.0121 0.0067 0.0734
Echinococcus multilocularis histone lysine N methyltransferase SETMAR 0.0033 0.0005 0.0053
Trypanosoma cruzi cysteine peptidase, putative 0.0069 0.003 0.0262
Brugia malayi Pre-SET motif family protein 0.0228 0.0141 0.1589
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0033 0.0005 0.0026
Echinococcus multilocularis heat shock protein 90 0.0114 0.0062 0.0707
Trichomonas vaginalis receptor histidine kinase, putative 0.0088 0.0044 0.0499
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0069 0.003 0.0184
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0033 0.0005 0.0026
Echinococcus multilocularis geminin 0.0184 0.0111 0.1268
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0069 0.003 0.0184
Mycobacterium leprae Probable DNA gyrase (subunit B) GyrB (DNA topoisomerase (ATP-hydrolysing)) (DNA topoisomerase II) (Type II DNA topoisomerase) 0.0548 0.0366 0.0366
Plasmodium falciparum DNA topoisomerase 3, putative 0.0121 0.0067 0.0232
Schistosoma mansoni heat shock protein 0.0114 0.0062 0.0682
Toxoplasma gondii heat shock protein 90, putative 0.0114 0.0062 0.0657
Mycobacterium tuberculosis Probable sensor protein KdpD 0.0088 0.0044 0.0044
Mycobacterium ulcerans two component sensory transduction histidine kinase MtrB 0.0088 0.0044 0.0044
Plasmodium falciparum DNA topoisomerase 2 0.1276 0.0876 0.8471
Mycobacterium tuberculosis Probable conserved lipoprotein 0.0039 0.0009 0.0009
Brugia malayi beta-lactamase family protein 0.0039 0.0009 0.0079
Plasmodium vivax DNA gyrase subunit B, putative 0.1491 0.1026 1
Loa Loa (eye worm) heat shock protein 90 0.0114 0.0062 0.0686
Trypanosoma brucei DNA topoisomerase ii 0.1686 0.1163 1
Mycobacterium ulcerans esterase/lipase LipP 0.0039 0.0009 0.0009
Schistosoma mansoni pyruvate dehydrogenase 0.0088 0.0044 0.0473
Leishmania major cathepsin L-like protease 0.0069 0.003 0.0262
Mycobacterium ulcerans two component sensor histidine kinase TrcS 0.0088 0.0044 0.0044
Mycobacterium leprae Probable integral membrane indolylacetylinositol arabinosyltransferase EmbC (arabinosylindolylacetylinositol synthase) 1.4301 1 1
Mycobacterium tuberculosis Conserved protein 0.0039 0.0009 0.0009
Toxoplasma gondii ATPase/histidine kinase/DNA gyrase B/HSP90 domain-containing protein 0.0088 0.0044 0.0448
Loa Loa (eye worm) intermediate filament tail domain-containing protein 0.0029 0.0002 0.0004
Trypanosoma cruzi heat shock protein 85, putative 0.0114 0.0062 0.0533
Giardia lamblia Pms1-like protein 0.0088 0.0044 0.0537
Trypanosoma cruzi hypothetical protein, conserved 0.0039 0.0009 0.008
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0069 0.003 0.0184
Loa Loa (eye worm) hypothetical protein 0.0726 0.049 0.5589
Trichomonas vaginalis receptor histidine kinase, putative 0.0088 0.0044 0.0499
Brugia malayi DNA topoisomerase II, alpha isozyme 0.1276 0.0876 1
Brugia malayi Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative 0.0039 0.0009 0.0079
Treponema pallidum DNA gyrase, subunit A (gyrA) 0.0628 0.0422 0.4112
Mycobacterium ulcerans integral membrane indolylacetylinositol arabinosyltransferase EmbA 1.4301 1 1
Mycobacterium tuberculosis Probable two component sensor kinase 0.0088 0.0044 0.0044
Trypanosoma brucei heat shock protein, putative 0.0114 0.0062 0.0457
Leishmania major cathepsin L-like protease 0.0069 0.003 0.0262
Echinococcus multilocularis rho GTPase activating protein 20 0.0121 0.0067 0.0759
Leishmania major DNA topoisomerase ii 0.1155 0.0791 0.6804
Plasmodium vivax DNA topoisomerase II, putative 0.1276 0.0876 0.853
Mycobacterium tuberculosis Two component sensory transduction histidine kinase MtrB 0.0088 0.0044 0.0044
Echinococcus granulosus lamin 0.0029 0.0002 0.0027
Mycobacterium tuberculosis Conserved protein 0.0039 0.0009 0.0009
Plasmodium falciparum DNA gyrase subunit A 0.0628 0.0422 0.385
Loa Loa (eye worm) glutaminase 0.0298 0.019 0.2155
Brugia malayi DNA topoisomerase III 0.0121 0.0067 0.0734
Mycobacterium tuberculosis Possible penicillin-binding protein 0.025 0.0157 0.0157
Trypanosoma brucei heat shock protein, putative 0.0114 0.0062 0.0457
Schistosoma mansoni histone-lysine n-methyltransferase suv9 0.0033 0.0005 0.0026
Toxoplasma gondii heat shock protein HSP90 0.0114 0.0062 0.0657
Leishmania major heat shock protein 83-1 0.0114 0.0062 0.0533
Mycobacterium leprae Probable two-component sensor kinase 0.0088 0.0044 0.0044
Mycobacterium tuberculosis Conserved protein 0.0088 0.0044 0.0044
Chlamydia trachomatis DNA gyrase subunit B 0.1491 0.1026 1
Loa Loa (eye worm) intermediate filament protein 0.0029 0.0002 0.0004
Mycobacterium ulcerans fusion of enoyl-CoA hydratase, EchA21 and lipase, LipE 0.0039 0.0009 0.0009
Mycobacterium leprae TWO COMPONENT SENSOR HISTIDINE KINASE PRRB 0.0088 0.0044 0.0044
Schistosoma mansoni DNA topoisomerase II 0.1276 0.0876 1
Mycobacterium ulcerans DNA topoisomerase I 0.0121 0.0067 0.0067
Loa Loa (eye worm) beta-LACTamase domain containing family member 0.0039 0.0009 0.0083
Giardia lamblia DNA topoisomerase III 0.0121 0.0067 0.0817
Mycobacterium ulcerans DNA gyrase subunit B 0.1491 0.1026 0.1026
Loa Loa (eye worm) hypothetical protein 0.0039 0.0009 0.0083
Brugia malayi Probable DNA topoisomerase II 0.1276 0.0876 1
Echinococcus multilocularis Pyruvate dehydrogenase (lipoamide) kinase 0.0088 0.0044 0.0499
Leishmania major hypothetical protein, conserved 0.0039 0.0009 0.008
Trypanosoma brucei heat shock protein, putative 0.0114 0.0062 0.0457
Mycobacterium ulcerans integral membrane indolylacetylinositol arabinosyltransferase EmbC 1.4301 1 1
Mycobacterium tuberculosis Probable lipase LipD 0.0039 0.0009 0.0009
Toxoplasma gondii DNA topoisomerase 2, putative 0.1276 0.0876 1
Trichomonas vaginalis DNA topoisomerase II, putative 0.1276 0.0876 1
Brugia malayi kinase, mitochondrial precursor 0.0088 0.0044 0.0473
Trichomonas vaginalis sensory transduction histidine kinase, putative 0.0088 0.0044 0.0499
Leishmania major heat shock protein 83-1 0.0114 0.0062 0.0533
Brugia malayi Pre-SET motif family protein 0.0033 0.0005 0.0026
Wolbachia endosymbiont of Brugia malayi DNA gyrase, topoisomerase II, B subunit, GyrB 0.1491 0.1026 1
Mycobacterium tuberculosis Possible two component system response sensor kinase membrane associated PhoR 0.0088 0.0044 0.0044
Leishmania major heat shock protein 83-1 0.0114 0.0062 0.0533
Onchocerca volvulus DNA topoisomerase 2 homolog 0.0949 0.0647 1
Onchocerca volvulus DNA topoisomerase 2 homolog 0.0949 0.0647 1
Plasmodium vivax heat shock protein 86, putative 0.0114 0.0062 0.0561
Trypanosoma cruzi heat shock protein 85, putative 0.0114 0.0062 0.0533
Trichomonas vaginalis esterase, putative 0.0039 0.0009 0.0106
Mycobacterium ulcerans two component sensor kinase MprB 0.0088 0.0044 0.0044
Toxoplasma gondii ATPase/histidine kinase/DNA gyrase B/HSP90 domain-containing protein 0.1099 0.0751 0.857
Mycobacterium tuberculosis Possible two component sensor kinase TcrY 0.0088 0.0044 0.0044
Loa Loa (eye worm) beta-lactamase 0.0039 0.0009 0.0083
Echinococcus multilocularis heat shock protein 0.0114 0.0062 0.0707
Onchocerca volvulus 0.0259 0.0163 0.2497
Loa Loa (eye worm) hypothetical protein 0.0039 0.0009 0.0083
Trichomonas vaginalis heat shock protein, putative 0.0114 0.0062 0.0707
Giardia lamblia Heat shock protein HSP 90-alpha 0.0114 0.0062 0.0761
Mycobacterium ulcerans hypothetical protein 0.0039 0.0009 0.0009
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0069 0.003 0.0184
Leishmania major heat shock protein 83-1 0.0114 0.0062 0.0533
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0069 0.003 0.0184
Brugia malayi DNA gyrase/topoisomerase IV, A subunit family protein 0.1276 0.0876 1
Treponema pallidum chemotaxis histidine kinase (cheA) 0.0088 0.0044 0.0426
Leishmania major heat shock protein 83-1 0.0114 0.0062 0.0533
Trypanosoma cruzi mitochondrial DNA topoisomerase II, putative 0.1686 0.1163 1
Leishmania major mitochondrial DNA topoisomerase II 0.1686 0.1163 1
Mycobacterium ulcerans sensor kinase from two component regulatory system 0.0088 0.0044 0.0044
Trypanosoma brucei heat shock protein, putative 0.0114 0.0062 0.0457

Activities

Activity type Activity value Assay description Source Reference
Anticonvulsant activity (functional) = 1 Anticonvulsant activity was determined in mice; 1 indicates 100 mg/kg or less ChEMBL. 7562939
Anticonvulsant activity (functional) = 1 Anticonvulsant activity was determined in mice; 1 indicates 100 mg/kg or less ChEMBL. 7562939
Anticonvulsant activity (functional) = 1 Anticonvulsant activity determined in rats at an oral dose of 50 mg/kg of phase VIA trials; active ChEMBL. 7562939

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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