Detailed information for compound 1318561

Basic information

Technical information
  • TDR Targets ID: 1318561
  • Name: 2-bromo-N-hexylbenzenesulfonamide
  • MW: 320.246 | Formula: C12H18BrNO2S
  • H donors: 1 H acceptors: 2 LogP: 3.91 Rotable bonds: 7
    Rule of 5 violations (Lipinski): 1
  • SMILES: CCCCCCNS(=O)(=O)c1ccccc1Br
  • InChi: 1S/C12H18BrNO2S/c1-2-3-4-7-10-14-17(15,16)12-9-6-5-8-11(12)13/h5-6,8-9,14H,2-4,7,10H2,1H3
  • InChiKey: MSEDPVQAXSZIKM-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • 2-bromo-N-hexyl-benzenesulfonamide
  • SMR000465129
  • KUC100926N
  • MLS000879288

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens snurportin 1 No references
Homo sapiens euchromatic histone-lysine N-methyltransferase 2 Starlite/ChEMBL No references
Homo sapiens karyopherin (importin) beta 1 No references
Equus caballus Ferritin light chain Starlite/ChEMBL No references
Homo sapiens ubiquitin specific peptidase 1 Starlite/ChEMBL No references
Homo sapiens RAN, member RAS oncogene family No references
Mus musculus RAR-related orphan receptor gamma Starlite/ChEMBL No references
Homo sapiens SMAD family member 2 Starlite/ChEMBL No references
Influenza A virus Nonstructural protein 1 Starlite/ChEMBL No references
Homo sapiens RecQ helicase-like Starlite/ChEMBL No references

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Schistosoma mansoni blooms syndrome DNA helicase Get druggable targets OG5_126644 All targets in OG5_126644
Leishmania major ATP-dependent DEAD/H DNA helicase recQ, putative Get druggable targets OG5_126644 All targets in OG5_126644
Loa Loa (eye worm) MH2 domain-containing protein Get druggable targets OG5_131716 All targets in OG5_131716
Schistosoma mansoni hypothetical protein Get druggable targets OG5_131808 All targets in OG5_131808
Cryptosporidium parvum GTP-binding nuclear protein ran/tc4 Get druggable targets OG5_127514 All targets in OG5_127514
Plasmodium yoelii GTP-binding nuclear protein ran/tc4 Get druggable targets OG5_127514 All targets in OG5_127514
Loa Loa (eye worm) RecQ helicase Get druggable targets OG5_126644 All targets in OG5_126644
Plasmodium falciparum importin beta, putative Get druggable targets OG5_127843 All targets in OG5_127843
Schistosoma mansoni ran Get druggable targets OG5_127514 All targets in OG5_127514
Trypanosoma brucei ATP-dependent DEAD/H DNA helicase recQ, putative Get druggable targets OG5_126644 All targets in OG5_126644
Echinococcus granulosus bloom syndrome protein Get druggable targets OG5_126644 All targets in OG5_126644
Giardia lamblia GTP-binding nuclear protein RAN/TC4 Get druggable targets OG5_127514 All targets in OG5_127514
Plasmodium knowlesi GTP-binding nuclear protein RAN/TC4, putative Get druggable targets OG5_127514 All targets in OG5_127514
Leishmania donovani GTP-binding protein, putative Get druggable targets OG5_127514 All targets in OG5_127514
Trichomonas vaginalis DNA helicase recq, putative Get druggable targets OG5_126644 All targets in OG5_126644
Trypanosoma cruzi ATP-dependent DEAD/H DNA helicase recQ, putative Get druggable targets OG5_126644 All targets in OG5_126644
Candida albicans Ran, Ras family GTP-binding protein Get druggable targets OG5_127514 All targets in OG5_127514
Leishmania infantum GTP-binding protein, putative Get druggable targets OG5_127514 All targets in OG5_127514
Toxoplasma gondii ATP-dependent DNA helicase, RecQ family protein Get druggable targets OG5_126644 All targets in OG5_126644
Echinococcus multilocularis ATP dependent DNA helicase Q1 Get druggable targets OG5_126644 All targets in OG5_126644
Onchocerca volvulus Get druggable targets OG5_131470 All targets in OG5_131470
Trypanosoma brucei GTP-binding nuclear protein rtb2, putative Get druggable targets OG5_127514 All targets in OG5_127514
Cryptosporidium parvum RecQ bloom helicase (RNA helicase+hrdc) Get druggable targets OG5_126644 All targets in OG5_126644
Entamoeba histolytica Ran family GTPase Get druggable targets OG5_127514 All targets in OG5_127514
Neospora caninum GTP-binding nuclear protein Ran, related Get druggable targets OG5_127514 All targets in OG5_127514
Brugia malayi ATP-dependent DNA helicase, RecQ family protein Get druggable targets OG5_126644 All targets in OG5_126644
Babesia bovis importin beta subunit, putative Get druggable targets OG5_127843 All targets in OG5_127843
Plasmodium berghei importin beta, putative Get druggable targets OG5_127843 All targets in OG5_127843
Plasmodium berghei ATP-dependent DNA helicase Q1, putative Get druggable targets OG5_126644 All targets in OG5_126644
Loa Loa (eye worm) transcription factor SMAD2 Get druggable targets OG5_131716 All targets in OG5_131716
Leishmania braziliensis importin beta-1 subunit, putative Get druggable targets OG5_127843 All targets in OG5_127843
Leishmania infantum importin beta-1 subunit, putative Get druggable targets OG5_127843 All targets in OG5_127843
Leishmania mexicana GTP-binding protein, putative Get druggable targets OG5_127514 All targets in OG5_127514
Loa Loa (eye worm) GTP-binding nuclear protein RAN/TC4 Get druggable targets OG5_127514 All targets in OG5_127514
Trypanosoma congolense GTP-binding nuclear protein rtb2, putative Get druggable targets OG5_127514 All targets in OG5_127514
Schistosoma mansoni DNA helicase recq1 Get druggable targets OG5_126644 All targets in OG5_126644
Brugia malayi Importin beta-1 subunit Get druggable targets OG5_127843 All targets in OG5_127843
Echinococcus multilocularis bloom syndrome protein Get druggable targets OG5_126644 All targets in OG5_126644
Candida albicans DNA helicase Get druggable targets OG5_126644 All targets in OG5_126644
Trichomonas vaginalis importin beta-1, putative Get druggable targets OG5_127843 All targets in OG5_127843
Echinococcus multilocularis importin subunit beta 1 Get druggable targets OG5_127843 All targets in OG5_127843
Plasmodium knowlesi ATP-dependent DNA helicase Q1, putative Get druggable targets OG5_126644 All targets in OG5_126644
Trypanosoma cruzi ATP-dependent DEAD/H DNA helicase recQ, putative Get druggable targets OG5_126644 All targets in OG5_126644
Plasmodium falciparum ATP-dependent DNA helicase Q1 Get druggable targets OG5_126644 All targets in OG5_126644
Leishmania major GTP-binding protein, putative Get druggable targets OG5_127514 All targets in OG5_127514
Cryptosporidium hominis importin-beta2 Get druggable targets OG5_127843 All targets in OG5_127843
Schistosoma mansoni DNA helicase recq5 Get druggable targets OG5_126644 All targets in OG5_126644
Schistosoma mansoni ran Get druggable targets OG5_127514 All targets in OG5_127514
Loa Loa (eye worm) ATP-dependent DNA helicase Get druggable targets OG5_126644 All targets in OG5_126644
Echinococcus granulosus ATP dependent DNA helicase Q5 Get druggable targets OG5_126644 All targets in OG5_126644
Trypanosoma brucei gambiense GTP-binding nuclear protein rtb2, putative Get druggable targets OG5_127514 All targets in OG5_127514
Brugia malayi Pre-SET motif family protein Get druggable targets OG5_131470 All targets in OG5_131470
Plasmodium yoelii importin beta-1 subunit Get druggable targets OG5_127843 All targets in OG5_127843
Entamoeba histolytica hypothetical protein Get druggable targets OG5_127843 All targets in OG5_127843
Leishmania infantum ATP-dependent DEAD/H DNA helicase recQ, putative Get druggable targets OG5_126644 All targets in OG5_126644
Echinococcus granulosus snurportin 1 Get druggable targets OG5_131808 All targets in OG5_131808
Echinococcus granulosus GTP binding nuclear protein Ran Get druggable targets OG5_127514 All targets in OG5_127514
Neospora caninum hypothetical protein Get druggable targets OG5_126644 All targets in OG5_126644
Trichomonas vaginalis Importin beta-1 subunit, putative Get druggable targets OG5_127843 All targets in OG5_127843
Plasmodium vivax GTP-binding nuclear protein RAN/TC4, putative Get druggable targets OG5_127514 All targets in OG5_127514
Brugia malayi RNA, U transporter 1 Get druggable targets OG5_131808 All targets in OG5_131808
Schistosoma japonicum Importin subunit beta, putative Get druggable targets OG5_127843 All targets in OG5_127843
Leishmania braziliensis ATP-dependent DEAD/H DNA helicase recQ, putative Get druggable targets OG5_126644 All targets in OG5_126644
Trichomonas vaginalis set domain proteins, putative Get druggable targets OG5_131470 All targets in OG5_131470
Entamoeba histolytica recQ family DNA helicase Get druggable targets OG5_126644 All targets in OG5_126644
Trypanosoma congolense importin beta-1 subunit, putative Get druggable targets OG5_127843 All targets in OG5_127843
Toxoplasma gondii HEAT repeat-containing protein Get druggable targets OG5_127843 All targets in OG5_127843
Plasmodium yoelii ATP-dependent DNA helicase recQ-related Get druggable targets OG5_126644 All targets in OG5_126644
Leishmania braziliensis GTP-binding protein, putative Get druggable targets OG5_127514 All targets in OG5_127514
Toxoplasma gondii GTP-binding nuclear protein ran/tc4 Get druggable targets OG5_127514 All targets in OG5_127514
Trichomonas vaginalis DNA helicase recq1, putative Get druggable targets OG5_126644 All targets in OG5_126644
Leishmania donovani importin beta-1 subunit, putative Get druggable targets OG5_127843 All targets in OG5_127843
Trichomonas vaginalis ran, putative Get druggable targets OG5_127514 All targets in OG5_127514
Plasmodium knowlesi ADP-dependent DNA helicase RecQ, putative Get druggable targets OG5_126644 All targets in OG5_126644
Leishmania major importin beta-1 subunit, putative Get druggable targets OG5_127843 All targets in OG5_127843
Candida albicans karyopherin-beta Get druggable targets OG5_127843 All targets in OG5_127843
Toxoplasma gondii ATP-dependent DNA helicase, RecQ family protein Get druggable targets OG5_126644 All targets in OG5_126644
Brugia malayi ATP-dependent DNA helicase, RecQ family protein Get druggable targets OG5_126644 All targets in OG5_126644
Echinococcus multilocularis GTP binding nuclear protein Ran Get druggable targets OG5_127514 All targets in OG5_127514
Schistosoma japonicum Snurportin-1, putative Get druggable targets OG5_131808 All targets in OG5_131808
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_127843 All targets in OG5_127843
Echinococcus multilocularis ATP dependent DNA helicase Q5 Get druggable targets OG5_126644 All targets in OG5_126644
Plasmodium falciparum ADP-dependent DNA helicase RecQ Get druggable targets OG5_126644 All targets in OG5_126644
Trypanosoma cruzi importin beta-1 subunit, putative Get druggable targets OG5_127843 All targets in OG5_127843
Plasmodium falciparum GTP-binding nuclear protein RAN/TC4 Get druggable targets OG5_127514 All targets in OG5_127514
Treponema pallidum ATP-dependent DNA helicase Get druggable targets OG5_126644 All targets in OG5_126644
Plasmodium berghei GTP-binding nuclear protein RAN/TC4, putative Get druggable targets OG5_127514 All targets in OG5_127514
Theileria parva importin beta, putative Get druggable targets OG5_127843 All targets in OG5_127843
Candida albicans DNA helicase Get druggable targets OG5_126644 All targets in OG5_126644
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_126644 All targets in OG5_126644
Plasmodium berghei ADP-dependent DNA helicase RecQ, putative Get druggable targets OG5_126644 All targets in OG5_126644
Trypanosoma cruzi GTP-binding nuclear protein rtb2, putative Get druggable targets OG5_127514 All targets in OG5_127514
Neospora caninum hypothetical protein Get druggable targets OG5_127843 All targets in OG5_127843
Candida albicans Ran, Ras family GTP-binding protein Get druggable targets OG5_127514 All targets in OG5_127514
Brugia malayi Bloom's syndrome protein homolog Get druggable targets OG5_126644 All targets in OG5_126644
Leishmania donovani ATP-dependent DEAD/H DNA helicase recQ, putative Get druggable targets OG5_126644 All targets in OG5_126644
Loa Loa (eye worm) pre-SET domain-containing protein family protein Get druggable targets OG5_131470 All targets in OG5_131470
Trypanosoma brucei importin beta-1 subunit, putative Get druggable targets OG5_127843 All targets in OG5_127843
Echinococcus multilocularis snurportin 1 Get druggable targets OG5_131808 All targets in OG5_131808
Neospora caninum hypothetical protein Get druggable targets OG5_126644 All targets in OG5_126644
Toxoplasma gondii ATP-dependent DNA helicase, RecQ family protein Get druggable targets OG5_126644 All targets in OG5_126644
Schistosoma japonicum ko:K07936 GTP-binding nuclear protein Ran, putative Get druggable targets OG5_127514 All targets in OG5_127514
Echinococcus granulosus importin subunit beta 1 Get druggable targets OG5_127843 All targets in OG5_127843
Echinococcus granulosus ATP dependent DNA helicase Q1 Get druggable targets OG5_126644 All targets in OG5_126644
Brugia malayi GTP-binding nuclear protein RAN/TC4 Get druggable targets OG5_127514 All targets in OG5_127514
Theileria parva GTP-binding nuclear protein ran, putative Get druggable targets OG5_127514 All targets in OG5_127514
Giardia lamblia Sgs1 DNA helicase, putative Get druggable targets OG5_126644 All targets in OG5_126644
Leishmania mexicana importin beta-1 subunit, putative Get druggable targets OG5_127843 All targets in OG5_127843
Schistosoma japonicum ko:K03654 ATP-dependent DNA helicase RecQ, putative Get druggable targets OG5_126644 All targets in OG5_126644
Schistosoma mansoni importin beta-1 Get druggable targets OG5_127843 All targets in OG5_127843
Cryptosporidium hominis GTP-binding nuclear protein ran/tc4 Get druggable targets OG5_127514 All targets in OG5_127514
Trypanosoma cruzi ATP-dependent DEAD/H DNA helicase recQ, putative Get druggable targets OG5_126644 All targets in OG5_126644
Cryptosporidium parvum importin/karyopherin Get druggable targets OG5_127843 All targets in OG5_127843
Plasmodium knowlesi importin beta, putative Get druggable targets OG5_127843 All targets in OG5_127843
Plasmodium yoelii ATP-dependent DNA helicase-related Get druggable targets OG5_126644 All targets in OG5_126644
Theileria parva hypothetical protein Get druggable targets OG5_126644 All targets in OG5_126644
Babesia bovis GTP-binding nuclear protein Ran Get druggable targets OG5_127514 All targets in OG5_127514
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_126644 All targets in OG5_126644
Schistosoma japonicum Bloom syndrome protein homolog, putative Get druggable targets OG5_126644 All targets in OG5_126644
Leishmania mexicana ATP-dependent DEAD/H DNA helicase recQ, putative Get druggable targets OG5_126644 All targets in OG5_126644
Babesia bovis ATP-dependent DNA helicase, RecQ family protein Get druggable targets OG5_126644 All targets in OG5_126644
Trichomonas vaginalis Importin beta-1 subunit, putative Get druggable targets OG5_127843 All targets in OG5_127843
Trypanosoma cruzi GTP-binding nuclear protein rtb2, putative Get druggable targets OG5_127514 All targets in OG5_127514
Trypanosoma brucei importin beta-1 subunit, putative Get druggable targets OG5_127843 All targets in OG5_127843
Babesia bovis ATP-dependent DNA helicase, RecQ family protein Get druggable targets OG5_126644 All targets in OG5_126644
Trichomonas vaginalis DNA helicase recq, putative Get druggable targets OG5_126644 All targets in OG5_126644
Schistosoma japonicum Importin subunit beta-1, putative Get druggable targets OG5_127843 All targets in OG5_127843
Cryptosporidium hominis DEAD/DEAH box helicase Get druggable targets OG5_126644 All targets in OG5_126644
Theileria parva DNA helicase, putative Get druggable targets OG5_126644 All targets in OG5_126644
Loa Loa (eye worm) nucleolar RNA-associated protein alpha Get druggable targets OG5_131808 All targets in OG5_131808
Trypanosoma brucei gambiense ATP-dependent DEAD/H DNA helicase recQ, putative Get druggable targets OG5_126644 All targets in OG5_126644
Plasmodium vivax importin-beta 2, putative Get druggable targets OG5_127843 All targets in OG5_127843
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_126644 All targets in OG5_126644
Trypanosoma brucei gambiense importin beta-1 subunit, putative Get druggable targets OG5_127843 All targets in OG5_127843
Brugia malayi MH2 domain containing protein Get druggable targets OG5_131716 All targets in OG5_131716
Candida albicans karyopherin-beta Get druggable targets OG5_127843 All targets in OG5_127843
Plasmodium vivax ADP-dependent DNA helicase RecQ, putative Get druggable targets OG5_126644 All targets in OG5_126644
Entamoeba histolytica recQ family helicase, putative Get druggable targets OG5_126644 All targets in OG5_126644
By sequence similarity to non orthologous known druggable targets
Species Potential target Known druggable target Length Alignment span Identity
Echinococcus granulosus expressed protein Ferritin light chain   175 aa 146 aa 28.8 %
Giardia lamblia U5 small nuclear ribonucleoprotein 200 kDa helicase, putative RecQ helicase-like 649 aa 521 aa 19.8 %
Echinococcus multilocularis expressed protein Ferritin light chain   175 aa 146 aa 30.1 %
Schistosoma mansoni ferritin Ferritin light chain   175 aa 171 aa 43.9 %
Schistosoma japonicum Ferritin, putative Ferritin light chain   175 aa 144 aa 24.3 %
Brugia malayi MH2 domain containing protein SMAD family member 2 467 aa 405 aa 31.6 %
Schistosoma mansoni apoferritin-2 Ferritin light chain   175 aa 146 aa 28.8 %
Schistosoma mansoni apoferritin-2 Ferritin light chain   175 aa 142 aa 29.6 %
Mycobacterium tuberculosis Hypothetical protein Nonstructural protein 1   230 aa 202 aa 23.8 %
Schistosoma mansoni ferritin Ferritin light chain   175 aa 171 aa 44.4 %
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0036 0.054 0.0675
Giardia lamblia GTP-binding nuclear protein RAN/TC4 0.0026 0.0309 1
Echinococcus granulosus 5'partial|histone lysine N methyltransferase SETDB2 0.0035 0.0511 0.063
Trichomonas vaginalis ran, putative 0.0026 0.0309 0.0065
Toxoplasma gondii histone lysine methyltransferase SET/SUV39 0.0036 0.054 0.6437
Echinococcus multilocularis isocitrate dehydrogenase 0.005 0.0839 0.1041
Schistosoma mansoni tar DNA-binding protein 0.0336 0.72 0.9001
Echinococcus multilocularis ATP dependent DNA helicase Q5 0.0024 0.0271 0.033
Echinococcus granulosus hepatocyte nuclear factor 4 alpha 0.0012 0.001 0.0004
Schistosoma mansoni DNA helicase recq1 0.0024 0.0271 0.0339
Schistosoma mansoni TGF-beta signal transducer Smad2 0.0025 0.029 0.0363
Schistosoma mansoni steroid hormone receptor ad4bp 0.0012 0.001 0.0013
Loa Loa (eye worm) transcription factor SMAD2 0.0364 0.7828 0.7825
Echinococcus multilocularis histone lysine N methyltransferase SETMAR 0.0036 0.054 0.0667
Treponema pallidum ATP-dependent DNA helicase 0.0012 0.001 0.5
Schistosoma mansoni tar DNA-binding protein 0.0336 0.72 0.9001
Echinococcus multilocularis cadherin EGF LAG seven pass G type receptor 0.0146 0.2986 0.3727
Trypanosoma brucei PAB1-binding protein , putative 0.0027 0.0337 0.1162
Trypanosoma brucei GTP-binding nuclear protein rtb2, putative 0.0026 0.0309 0.0662
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0036 0.054 0.0675
Onchocerca volvulus 0.0036 0.054 0.0871
Toxoplasma gondii isocitrate dehydrogenase 0.005 0.0839 1
Echinococcus multilocularis TGF beta signal transducer SmadC 0.0025 0.029 0.0354
Schistosoma mansoni photoreceptor-specific nuclear receptor related 0.0012 0.001 0.0013
Echinococcus granulosus bloom syndrome protein 0.0024 0.0271 0.033
Schistosoma mansoni tar DNA-binding protein 0.0336 0.72 0.9001
Loa Loa (eye worm) isocitrate dehydrogenase 0.005 0.0839 0.083
Toxoplasma gondii HEAT repeat-containing protein 0.0035 0.0513 0.6112
Echinococcus granulosus GTP binding nuclear protein Ran 0.0026 0.0309 0.0377
Echinococcus multilocularis NADP dependent isocitrate dehydrogenase 0.005 0.0839 0.1041
Trypanosoma cruzi GTP-binding nuclear protein rtb2, putative 0.0026 0.0309 0.36
Loa Loa (eye worm) nucleolar RNA-associated protein alpha 0.0372 0.8 0.7997
Echinococcus multilocularis Nuclear hormone receptor family member nhr 41 0.0012 0.001 0.0004
Toxoplasma gondii GTP-binding nuclear protein ran/tc4 0.0026 0.0309 0.3678
Toxoplasma gondii ATP-dependent DNA helicase, RecQ family protein 0.0012 0.001 0.0123
Brugia malayi ATP-dependent DNA helicase, RecQ family protein 0.0024 0.0271 0.0261
Schistosoma mansoni hypothetical protein 0.0146 0.2986 0.3732
Plasmodium falciparum ataxin-2 like protein, putative 0.0027 0.0337 0.1162
Echinococcus granulosus COUP TF:Svp nuclear hormone receptor 0.0012 0.001 0.0004
Schistosoma mansoni thyroid hormone receptor 0.0012 0.001 0.0013
Echinococcus granulosus ATP dependent DNA helicase Q1 0.0024 0.0271 0.033
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0012 0.001 0.0004
Echinococcus multilocularis GPCR, family 2 0.0146 0.2986 0.3727
Brugia malayi Isocitrate dehydrogenase 0.005 0.0839 0.083
Schistosoma mansoni smad1 5 8 and 0.0025 0.029 0.0363
Echinococcus multilocularis hepatocyte nuclear factor 4 alpha 0.0012 0.001 0.0004
Trypanosoma brucei importin beta-1 subunit, putative 0.0035 0.0513 0.4258
Schistosoma mansoni Smad4 0.0025 0.029 0.0363
Echinococcus granulosus TGF beta signal transducer SmadC 0.0025 0.029 0.0354
Schistosoma mansoni nuclear hormone receptor nor-1/nor-2 0.0012 0.001 0.0013
Trypanosoma cruzi importin beta-1 subunit, putative 0.0028 0.0367 0.4299
Loa Loa (eye worm) hypothetical protein 0.0462 1 1
Trypanosoma cruzi GTP-binding nuclear protein rtb2, putative 0.0026 0.0309 0.36
Echinococcus granulosus NADP dependent isocitrate dehydrogenase 0.005 0.0839 0.1041
Echinococcus multilocularis GTP binding nuclear protein Ran 0.0026 0.0309 0.0377
Trypanosoma cruzi PAB1-binding protein , putative 0.0027 0.0337 0.3942
Schistosoma mansoni retinoid-x-receptor (RXR) 0.0012 0.001 0.0013
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0462 1 1
Leishmania major isocitrate dehydrogenase [NADP], mitochondrial precursor, putative 0.005 0.0839 1
Brugia malayi ATP-dependent DNA helicase, RecQ family protein 0.0024 0.0271 0.0261
Schistosoma mansoni smad 0.0025 0.029 0.0363
Schistosoma mansoni FTZ-F1 nuclear receptor-like protein 0.0012 0.001 0.0013
Schistosoma mansoni tar DNA-binding protein 0.0336 0.72 0.9001
Schistosoma mansoni ran 0.0026 0.0309 0.0386
Loa Loa (eye worm) MH2 domain-containing protein 0.0364 0.7828 0.7825
Loa Loa (eye worm) TAR-binding protein 0.0336 0.72 0.7197
Trypanosoma brucei importin beta-1 subunit, putative 0.0035 0.0513 0.4258
Loa Loa (eye worm) hypothetical protein 0.0146 0.2986 0.2979
Brugia malayi hypothetical protein 0.0017 0.0125 0.0115
Echinococcus multilocularis isocitrate dehydrogenase 2 (NADP+) 0.005 0.0839 0.1041
Plasmodium vivax importin-beta 2, putative 0.0035 0.0513 0.6112
Brugia malayi MH1 domain containing protein 0.0025 0.029 0.028
Schistosoma mansoni nuclear hormone receptor 0.0012 0.001 0.0013
Schistosoma mansoni Tr4/Tr2 (homologue) 0.0012 0.001 0.0013
Schistosoma mansoni ran 0.0026 0.0309 0.0386
Loa Loa (eye worm) hypothetical protein 0.0012 0.001 0.00000000021952
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.0336 0.72 0.7197
Echinococcus granulosus ATP dependent DNA helicase Q5 0.0024 0.0271 0.033
Schistosoma mansoni hypothetical protein 0.0146 0.2986 0.3732
Entamoeba histolytica recQ family DNA helicase 0.0012 0.001 0.0281
Loa Loa (eye worm) pre-SET domain-containing protein family protein 0.0251 0.5324 0.5319
Schistosoma mansoni hypothetical protein 0.0316 0.6753 0.8442
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0012 0.001 0.0004
Toxoplasma gondii isocitrate dehydrogenase 0.005 0.0839 1
Toxoplasma gondii ATP-dependent DNA helicase, RecQ family protein 0.0024 0.0271 0.323
Echinococcus granulosus retinoic acid receptor rxr beta a 0.0012 0.001 0.0004
Schistosoma mansoni smad1 5 8 and 0.0025 0.029 0.0363
Brugia malayi hypothetical protein 0.0027 0.0337 0.0327
Echinococcus granulosus tar DNA binding protein 0.0336 0.72 0.9
Echinococcus granulosus Smad4 0.0025 0.029 0.0354
Brugia malayi MH1 domain containing protein 0.0014 0.0044 0.0034
Trypanosoma cruzi PAB1-binding protein , putative 0.0027 0.0337 0.3942
Schistosoma mansoni coup transcription factor 0.0012 0.001 0.0013
Echinococcus multilocularis NADP dependent isocitrate dehydrogenase 0.005 0.0839 0.1041
Brugia malayi Calcitonin receptor-like protein seb-1 0.0462 1 1
Plasmodium vivax GTP-binding nuclear protein RAN/TC4, putative 0.0026 0.0309 0.3678
Trichomonas vaginalis importin beta-1, putative 0.0028 0.0367 0.0164
Schistosoma mansoni hypothetical protein 0.0012 0.0007 0.0009
Loa Loa (eye worm) RNA binding protein 0.0336 0.72 0.7197
Echinococcus multilocularis FTZ F1 alpha 0.0012 0.001 0.0004
Plasmodium falciparum importin beta, putative 0.0035 0.0513 0.4258
Brugia malayi Bloom's syndrome protein homolog 0.0024 0.0271 0.0261
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.0146 0.2986 0.3727
Schistosoma mansoni histone-lysine n-methyltransferase suv9 0.0036 0.054 0.0675
Echinococcus granulosus Nuclear hormone receptor family member nhr 41 0.0012 0.001 0.0004
Echinococcus granulosus histone lysine methyltransferase setb 0.0036 0.054 0.0667
Echinococcus granulosus GPCR family 2 0.0146 0.2986 0.3727
Echinococcus multilocularis ecdysone induced protein 78C 0.0012 0.001 0.0004
Brugia malayi RNA binding protein 0.0336 0.72 0.7197
Echinococcus multilocularis smad 0.0025 0.029 0.0354
Echinococcus granulosus snurportin 1 0.0372 0.8 1
Echinococcus multilocularis histone lysine methyltransferase setb histone lysine methyltransferase eggless 0.0036 0.054 0.0667
Plasmodium vivax SET domain protein, putative 0.0036 0.054 0.6437
Entamoeba histolytica recQ family helicase, putative 0.0024 0.0271 0.7393
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0012 0.001 0.0004
Brugia malayi MH2 domain containing protein 0.0364 0.7828 0.7825
Echinococcus granulosus FTZ F1 alpha 0.0012 0.001 0.0004
Loa Loa (eye worm) hypothetical protein 0.0024 0.0271 0.0261
Trypanosoma cruzi ATP-dependent DEAD/H DNA helicase recQ, putative 0.0024 0.0271 0.3145
Schistosoma mansoni thyroid hormone receptor 0.0012 0.001 0.0013
Trypanosoma brucei isocitrate dehydrogenase, putative 0.005 0.0839 1
Schistosoma mansoni RAR-like nuclear receptor 0.0012 0.001 0.0013
Brugia malayi MH1 domain containing protein 0.0014 0.0044 0.0034
Brugia malayi Pre-SET motif family protein 0.0036 0.054 0.053
Brugia malayi RNA, U transporter 1 0.0099 0.194 0.1931
Brugia malayi MH2 domain containing protein 0.0025 0.029 0.028
Plasmodium vivax ataxin-2 like protein, putative 0.0027 0.0337 0.4016
Loa Loa (eye worm) nuclear factor I 0.0014 0.0044 0.0034
Schistosoma mansoni hypothetical protein 0.0146 0.2986 0.3732
Schistosoma mansoni blooms syndrome DNA helicase 0.0012 0.001 0.0013
Echinococcus multilocularis ATP dependent DNA helicase Q1 0.0024 0.0271 0.033
Brugia malayi RNA recognition motif domain containing protein 0.0336 0.72 0.7197
Toxoplasma gondii ATP-dependent DNA helicase, RecQ family protein 0.0024 0.0271 0.323
Trypanosoma cruzi isocitrate dehydrogenase, putative 0.005 0.0839 1
Trypanosoma cruzi isocitrate dehydrogenase [NADP], mitochondrial precursor, putative 0.005 0.0839 1
Leishmania major hypothetical protein, conserved 0.0027 0.0337 0.1162
Echinococcus granulosus ecdysone induced protein 78C 0.0012 0.001 0.0004
Loa Loa (eye worm) hypothetical protein 0.0316 0.6753 0.675
Plasmodium falciparum isocitrate dehydrogenase [NADP], mitochondrial 0.005 0.0839 1
Plasmodium vivax ADP-dependent DNA helicase RecQ, putative 0.0012 0.001 0.0123
Plasmodium falciparum ataxin-2 like protein, putative 0.0027 0.0337 0.1162
Trypanosoma brucei isocitrate dehydrogenase [NADP], mitochondrial precursor, putative 0.005 0.0839 1
Plasmodium vivax isocitrate dehydrogenase [NADP], mitochondrial, putative 0.005 0.0839 1
Schistosoma mansoni hypothetical protein 0.0146 0.2986 0.3732
Loa Loa (eye worm) MH2 domain-containing protein 0.0025 0.029 0.028
Echinococcus multilocularis importin subunit beta 1 0.0035 0.0513 0.0633
Brugia malayi Smad1 0.0025 0.029 0.028
Trichomonas vaginalis Importin beta-1 subunit, putative 0.0028 0.0367 0.0164
Toxoplasma gondii LsmAD domain-containing protein 0.0027 0.0337 0.4016
Onchocerca volvulus 0.0286 0.6096 1
Loa Loa (eye worm) MH1 domain-containing protein 0.0025 0.029 0.028
Echinococcus granulosus importin subunit beta 1 0.0035 0.0513 0.0633
Loa Loa (eye worm) hypothetical protein 0.0036 0.054 0.0531
Loa Loa (eye worm) RecQ helicase 0.0024 0.0271 0.0261
Echinococcus multilocularis tar DNA binding protein 0.0336 0.72 0.9
Leishmania major GTP-binding protein, putative 0.0026 0.0309 0.0662
Echinococcus multilocularis NADP dependent isocitrate dehydrogenase 0.005 0.0839 0.1041
Echinococcus multilocularis bloom syndrome protein 0.0024 0.0271 0.033
Echinococcus granulosus smad 0.0025 0.029 0.0354
Schistosoma mansoni retinoic acid receptor RXR 0.0012 0.001 0.0013
Schistosoma mansoni DNA helicase recq5 0.0024 0.0271 0.0339
Brugia malayi Importin beta-1 subunit 0.0035 0.0513 0.0503
Schistosoma mansoni hypothetical protein 0.0372 0.8 1
Brugia malayi MH1 domain containing protein 0.0025 0.029 0.028
Echinococcus granulosus FTZ F1 nuclear receptor protein 0.0012 0.001 0.0004
Echinococcus multilocularis Smad4 0.0025 0.029 0.0354
Echinococcus multilocularis COUP TF:Svp nuclear hormone receptor 0.0012 0.001 0.0004
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.0146 0.2986 0.2978
Loa Loa (eye worm) latrophilin receptor protein 2 0.0146 0.2986 0.2979
Entamoeba histolytica hypothetical protein 0.0028 0.0367 1
Leishmania major importin beta-1 subunit, putative 0.0028 0.0367 0.1682
Loa Loa (eye worm) Smad1 0.0025 0.029 0.028
Loa Loa (eye worm) GTP-binding nuclear protein RAN/TC4 0.0026 0.0309 0.0299
Brugia malayi Latrophilin receptor protein 2 0.0146 0.2986 0.2978
Schistosoma mansoni smad1 5 8 and 0.0025 0.029 0.0363
Entamoeba histolytica Ran family GTPase 0.0026 0.0309 0.842
Schistosoma mansoni nuclear receptor 2DBD-gamma 0.0012 0.001 0.0013
Plasmodium falciparum GTP-binding nuclear protein RAN/TC4 0.0026 0.0309 0.0662
Brugia malayi TAR-binding protein 0.0336 0.72 0.7197
Loa Loa (eye worm) hypothetical protein 0.0014 0.0044 0.0034
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.0146 0.2986 0.3727
Loa Loa (eye worm) ATP-dependent DNA helicase 0.0024 0.0271 0.0261
Loa Loa (eye worm) hypothetical protein 0.0027 0.0337 0.0327
Schistosoma mansoni tar DNA-binding protein 0.0336 0.72 0.9001
Echinococcus granulosus mothers against decapentaplegic 5 0.0025 0.029 0.0354
Schistosoma mansoni importin beta-1 0.0035 0.0513 0.0641
Echinococcus multilocularis thyroid hormone receptor alpha 0.0012 0.001 0.0004
Schistosoma mansoni NADP-specific isocitrate dehydrogenase 0.005 0.0839 0.1049
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0012 0.001 0.0004
Loa Loa (eye worm) hypothetical protein 0.0035 0.0513 0.0503
Brugia malayi latrophilin 2 splice variant baaae 0.0316 0.6753 0.675
Brugia malayi isocitrate dehydrogenase 0.005 0.0839 0.083
Brugia malayi GTP-binding nuclear protein RAN/TC4 0.0026 0.0309 0.0299
Brugia malayi Pre-SET motif family protein 0.0251 0.5324 0.5319
Echinococcus multilocularis mothers against decapentaplegic 5 0.0025 0.029 0.0354
Echinococcus multilocularis FTZ F1 nuclear receptor protein 0.0012 0.001 0.0004
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0036 0.054 0.0675
Trichomonas vaginalis set domain proteins, putative 0.0286 0.6096 1
Mycobacterium tuberculosis Probable isocitrate dehydrogenase [NADP] Icd1 (oxalosuccinate decarboxylase) (IDH) (NADP+-specific ICDH) (IDP) 0.005 0.0839 0.5
Trichomonas vaginalis Importin beta-1 subunit, putative 0.0028 0.0367 0.0164
Echinococcus multilocularis snurportin 1 0.0372 0.8 1
Brugia malayi MH2 domain containing protein 0.0025 0.029 0.028
Echinococcus granulosus cadherin EGF LAG seven pass G type receptor 0.0146 0.2986 0.3727

Activities

Activity type Activity value Assay description Source Reference
Potency (functional) = 0.1585 um PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of RecQ-Like Dna Helicase 1 (RECQ1). (Class of assay: confirmatory) [Related pubchem assays: 594 (Rhodamine region spectral profiling screen), 593 (Fluorescein region spectral profiling screen), 2367 (Probe Development Summary for Inhibitors of RecQ-Like Dna Helicase 1 (RECQ1)), 2353 (qHTS Validation Assay for Inhibitors of RecQ-Like Dna Helicase 1 (RECQ1))] ChEMBL. No reference
Potency (functional) 0.2818 uM PubChem BioAssay. Inhibitors of USP1/UAF1: Primary Screen. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 1.4125 uM PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Histone Lysine Methyltransferase G9a. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID504404] ChEMBL. No reference
Potency (functional) 2.5929 uM PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of RanGTP induced Rango (Ran-regulated importin-beta cargo) - Importin beta complex dissociation. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID540262] ChEMBL. No reference
Potency (binding) = 6.3096 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 (functional) = 7.9433 um PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Influenza NS1 Protein Function. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 10.4179 uM PUBCHEM_BIOASSAY: Primary qHTS for delayed death inhibitors of the malarial parasite plastid, 96 hour incubation. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488745, AID488752, AID488774, AID504848, AID504850] ChEMBL. No reference
Potency (functional) 13.1154 uM PUBCHEM_BIOASSAY: Primary qHTS for delayed death inhibitors of the malarial parasite plastid, 48 hour incubation. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488752, AID488774, AID504848, AID504850] ChEMBL. No reference
Potency (functional) = 14.1254 um PUBCHEM_BIOASSAY: VP16 counterscreen qHTS for inhibitors of ROR gamma transcriptional activity. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 15.8489 uM PUBCHEM_BIOASSAY: qHTS for Inhibitors of TGF-b. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID588856, AID588860] ChEMBL. No reference
Potency (binding) = 22.3872 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 (functional) 35.4813 uM PUBCHEM_BIOASSAY: qHTS for Inhibitors of TGF-b: Cytotox Counterscreen. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID588855, AID588860] ChEMBL. No reference
Potency (functional) 50.1187 uM PubChem BioAssay. qHTS of PTHR Inhibitors: Primary Screen. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 56.2341 uM PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of JMJD2A-Tudor Domain. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID504402] ChEMBL. No reference
Potency (functional) 56.2341 uM PUBCHEM_BIOASSAY: HTS for Inhibitors of HP1-beta Chromodomain Interactions with Methylated Histone Tails. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488962] ChEMBL. No reference
Potency (functional) 70.7946 uM PUBCHEM_BIOASSAY: HTS for Inhibitors of HP1-beta Chromodomain Interactions with Methylated Histone Tails. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488962] ChEMBL. No reference

Phenotypes

Whole-cell/tissue/organism interactions

Species name Source Reference Is orphan
Plasmodium falciparum ChEMBL23

Many chemical entities in TDR Targets come from high-throughput screenings with whole cells or tissue samples, and not all assayed compounds have been tested against a single a single target protein, probably because they get ruled out during screening process. Even if these compounds may have not been of interest in the original screening, they may come as interesting leads for other screening assays. Furthermore, we may be able to propose drug-target associations using chemical similarities and network patterns.

Annotated phenotypes:

We have no manually annotated phenotypes for this drug. What does this mean? / Care to help?
In TDR Targets, information about phenotypes that are caused by drugs, or by genetic manipulation of cells (e.g. gene knockouts or knockdowns) is manually curated from the literature. These descriptions help to describe the potential of the target for drug development. If no information is available for this gene or if the information is incomplete, this may mean that i) the papers containing this information either appeared after the curation effort for this organism was carried out or they were inadvertently missed by curators; or that ii) the curation effort for this organism has not yet started.
 
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External resources for this compound

Bibliographic References

No literature references available for this target.

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