Detailed information for compound 1408322

Basic information

Technical information
  • TDR Targets ID: 1408322
  • Name: 2-(3,4-dimethylphenyl)sulfonyl-2-[3-(4-ethylp iperazin-1-yl)quinoxalin-2-yl]acetonitrile
  • MW: 449.568 | Formula: C24H27N5O2S
  • H donors: 0 H acceptors: 5 LogP: 3.33 Rotable bonds: 5
    Rule of 5 violations (Lipinski): 1
  • SMILES: N#CC(S(=O)(=O)c1ccc(c(c1)C)C)c1nc2ccccc2nc1N1CCN(CC1)CC
  • InChi: 1S/C24H27N5O2S/c1-4-28-11-13-29(14-12-28)24-23(26-20-7-5-6-8-21(20)27-24)22(16-25)32(30,31)19-10-9-17(2)18(3)15-19/h5-10,15,22H,4,11-14H2,1-3H3
  • InChiKey: QDRZGVYHJHZZEC-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • 2-(3,4-dimethylphenyl)sulfonyl-2-[3-(4-ethyl-1-piperazinyl)-2-quinoxalinyl]acetonitrile
  • 2-(3,4-dimethylphenyl)sulfonyl-2-[3-(4-ethylpiperazin-1-yl)quinoxalin-2-yl]ethanenitrile
  • MLS000557502
  • SMR000148418
  • STOCK4S-36766
  • (3,4-Dimethyl-benzenesulfonyl)-[3-(4-ethyl-piperazin-1-yl)-quinoxalin-2-yl]-acetonitrile

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens snurportin 1 No references
Homo sapiens RAN, member RAS oncogene family No references
Homo sapiens karyopherin (importin) beta 1 No references

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Echinococcus multilocularis importin subunit beta 1 Get druggable targets OG5_127843 All targets in OG5_127843
Theileria parva GTP-binding nuclear protein ran, putative Get druggable targets OG5_127514 All targets in OG5_127514
Leishmania mexicana importin beta-1 subunit, putative 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
Leishmania major importin beta-1 subunit, putative Get druggable targets OG5_127843 All targets in OG5_127843
Trypanosoma brucei gambiense importin beta-1 subunit, putative Get druggable targets OG5_127843 All targets in OG5_127843
Trypanosoma brucei importin beta-1 subunit, putative Get druggable targets OG5_127843 All targets in OG5_127843
Plasmodium knowlesi GTP-binding nuclear protein RAN/TC4, putative Get druggable targets OG5_127514 All targets in OG5_127514
Trichomonas vaginalis ran, putative Get druggable targets OG5_127514 All targets in OG5_127514
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
Plasmodium yoelii GTP-binding nuclear protein ran/tc4 Get druggable targets OG5_127514 All targets in OG5_127514
Loa Loa (eye worm) hypothetical protein 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
Babesia bovis GTP-binding nuclear protein Ran Get druggable targets OG5_127514 All targets in OG5_127514
Cryptosporidium parvum importin/karyopherin Get druggable targets OG5_127843 All targets in OG5_127843
Brugia malayi RNA, U transporter 1 Get druggable targets OG5_131808 All targets in OG5_131808
Plasmodium berghei GTP-binding nuclear protein RAN/TC4, putative Get druggable targets OG5_127514 All targets in OG5_127514
Trichomonas vaginalis 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
Trypanosoma congolense importin beta-1 subunit, putative Get druggable targets OG5_127843 All targets in OG5_127843
Leishmania donovani importin beta-1 subunit, putative Get druggable targets OG5_127843 All targets in OG5_127843
Neospora caninum GTP-binding nuclear protein Ran, related Get druggable targets OG5_127514 All targets in OG5_127514
Brugia malayi GTP-binding nuclear protein RAN/TC4 Get druggable targets OG5_127514 All targets in OG5_127514
Echinococcus multilocularis snurportin 1 Get druggable targets OG5_131808 All targets in OG5_131808
Plasmodium vivax importin-beta 2, putative Get druggable targets OG5_127843 All targets in OG5_127843
Schistosoma mansoni importin beta-1 Get druggable targets OG5_127843 All targets in OG5_127843
Schistosoma japonicum ko:K07936 GTP-binding nuclear protein Ran, putative Get druggable targets OG5_127514 All targets in OG5_127514
Schistosoma japonicum Importin subunit beta, putative Get druggable targets OG5_127843 All targets in OG5_127843
Trypanosoma congolense GTP-binding nuclear protein rtb2, putative Get druggable targets OG5_127514 All targets in OG5_127514
Echinococcus granulosus snurportin 1 Get druggable targets OG5_131808 All targets in OG5_131808
Trypanosoma brucei importin beta-1 subunit, putative Get druggable targets OG5_127843 All targets in OG5_127843
Theileria parva importin beta, putative Get druggable targets OG5_127843 All targets in OG5_127843
Babesia bovis importin beta subunit, putative Get druggable targets OG5_127843 All targets in OG5_127843
Trichomonas vaginalis importin beta-1, 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
Schistosoma mansoni ran Get druggable targets OG5_127514 All targets in OG5_127514
Schistosoma mansoni ran Get druggable targets OG5_127514 All targets in OG5_127514
Plasmodium berghei importin beta, putative Get druggable targets OG5_127843 All targets in OG5_127843
Giardia lamblia GTP-binding nuclear protein RAN/TC4 Get druggable targets OG5_127514 All targets in OG5_127514
Trypanosoma brucei GTP-binding nuclear protein rtb2, putative Get druggable targets OG5_127514 All targets in OG5_127514
Schistosoma mansoni hypothetical protein Get druggable targets OG5_131808 All targets in OG5_131808
Loa Loa (eye worm) nucleolar RNA-associated protein alpha Get druggable targets OG5_131808 All targets in OG5_131808
Neospora caninum hypothetical protein Get druggable targets OG5_127843 All targets in OG5_127843
Leishmania major GTP-binding protein, putative Get druggable targets OG5_127514 All targets in OG5_127514
Cryptosporidium parvum GTP-binding nuclear protein ran/tc4 Get druggable targets OG5_127514 All targets in OG5_127514
Trypanosoma cruzi importin beta-1 subunit, putative 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 importin beta-1 subunit Get druggable targets OG5_127843 All targets in OG5_127843
Echinococcus granulosus GTP binding nuclear protein Ran Get druggable targets OG5_127514 All targets in OG5_127514
Schistosoma japonicum Importin subunit beta-1, 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
Plasmodium falciparum importin beta, 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
Trypanosoma cruzi GTP-binding nuclear protein rtb2, putative Get druggable targets OG5_127514 All targets in OG5_127514
Brugia malayi Importin beta-1 subunit Get druggable targets OG5_127843 All targets in OG5_127843
Leishmania braziliensis importin beta-1 subunit, putative Get druggable targets OG5_127843 All targets in OG5_127843
Leishmania donovani 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
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
Trichomonas vaginalis Importin beta-1 subunit, putative 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
Trypanosoma cruzi GTP-binding nuclear protein rtb2, putative Get druggable targets OG5_127514 All targets in OG5_127514
Plasmodium falciparum GTP-binding nuclear protein RAN/TC4 Get druggable targets OG5_127514 All targets in OG5_127514
Trypanosoma brucei gambiense GTP-binding nuclear protein rtb2, 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
Toxoplasma gondii HEAT repeat-containing protein Get druggable targets OG5_127843 All targets in OG5_127843
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
Entamoeba histolytica hypothetical protein Get druggable targets OG5_127843 All targets in OG5_127843
Entamoeba histolytica Ran family GTPase 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
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
Trichomonas vaginalis soluble guanylate cyclase gcy, putative 0.0026 0.0018 0.004
Loa Loa (eye worm) hypothetical protein 0.006 0.0288 0.0619
Trichomonas vaginalis conserved hypothetical protein 0.0026 0.0018 0.004
Trichomonas vaginalis adenylate and guanylate cyclases, putative 0.0026 0.0018 0.004
Schistosoma mansoni importin beta-1 0.0035 0.0086 0.0073
Loa Loa (eye worm) hypothetical protein 0.008 0.0449 0.098
Trypanosoma cruzi STE/STE11 serine/threonine-protein kinase, putative 0.0026 0.0018 0.0013
Trypanosoma cruzi PAS-domain containing phosphoglycerate kinase, putative 0.0026 0.0018 0.0013
Loa Loa (eye worm) FKBP-type peptidyl-prolyl cis-trans isomerase-33 0.008 0.0449 0.098
Echinococcus granulosus heat shock protein 90 0.0031 0.0057 0.0101
Echinococcus granulosus acetylcholinesterase 0.0079 0.0434 0.0947
Leishmania major heat shock protein 83-1 0.0039 0.0121 0.0244
Loa Loa (eye worm) hypothetical protein 0.0504 0.3823 0.8561
Mycobacterium ulcerans hypothetical protein 0.008 0.0449 0.0888
Loa Loa (eye worm) FAD binding domain-containing protein 0.0066 0.0335 0.0725
Leishmania major peptidylprolyl isomerase-like protein 0.0584 0.4463 1
Brugia malayi RNA, U transporter 1 0.0099 0.0598 0.1315
Loa Loa (eye worm) nucleolar RNA-associated protein alpha 0.0372 0.2772 0.6199
Toxoplasma gondii heat shock protein HSP90 0.0039 0.0121 0.2489
Brugia malayi flavodoxin family protein 0.0041 0.0134 0.0274
Leishmania major PAS-domain containing phosphoglycerate kinase, putative 0.0026 0.0018 0.0013
Giardia lamblia 70 kDa peptidylprolyl isomerase, putative 0.0584 0.4463 1
Trichomonas vaginalis fk506 binding protein, putative 0.008 0.0449 0.1005
Giardia lamblia FKBP-type peptidyl-prolyl cis-trans isomerase 0.0584 0.4463 1
Echinococcus granulosus heat shock protein 0.0039 0.0121 0.0244
Leishmania major heat shock protein 83-1 0.0039 0.0121 0.0244
Treponema pallidum peptidyl-prolyl cis-trans isomerase, FKBP-type (slyD) 0.008 0.0449 0.0888
Trypanosoma brucei peptidyl-prolyl cis-trans isomerase, putative 0.0584 0.4463 1
Leishmania major protein kinase, putative 0.0026 0.0018 0.0013
Entamoeba histolytica type A flavoprotein, putative 0.0041 0.0134 0.0274
Leishmania major heat shock protein 83-1 0.0039 0.0121 0.0244
Loa Loa (eye worm) hypothetical protein 0.0035 0.0086 0.0165
Trypanosoma cruzi Flavodoxin/Radical SAM superfamily/Wyosine base formation, putative 0.0041 0.0134 0.0274
Leishmania major heat shock protein 83-1 0.0039 0.0121 0.0244
Entamoeba histolytica type A flavoprotein, putative 0.0041 0.0134 0.0274
Trypanosoma brucei heat shock protein, putative 0.0039 0.0121 0.0244
Echinococcus multilocularis heat shock protein 0.0039 0.0121 0.0143
Giardia lamblia FKBP-type peptidyl-prolyl cis-trans isomerase 0.008 0.0449 0.098
Plasmodium falciparum nitric oxide synthase, putative 0.0107 0.0661 0.1482
Schistosoma mansoni hypothetical protein 0.008 0.0449 0.0437
Echinococcus multilocularis aryl hydrocarbon receptor 0.0026 0.0018 0.0008
Loa Loa (eye worm) heat shock protein 90 0.0039 0.0121 0.0244
Trichomonas vaginalis sulfite reductase, putative 0.0107 0.0661 0.1482
Trypanosoma cruzi STE/STE11 serine/threonine-protein kinase, putative 0.0026 0.0018 0.0013
Schistosoma mansoni immunophilin 0.0504 0.3823 0.3815
Loa Loa (eye worm) acetylcholinesterase 1 0.0079 0.0434 0.0947
Echinococcus multilocularis acetylcholinesterase 0.0079 0.0434 0.0555
Trypanosoma cruzi peptidyl-prolyl cis-trans isomerase, putative 0.008 0.0449 0.098
Loa Loa (eye worm) FKBP-type peptidyl-prolyl cis-trans isomerase-12 0.0584 0.4463 1
Trypanosoma brucei importin beta-1 subunit, putative 0.0035 0.0086 0.0165
Schistosoma mansoni hypothetical protein 0.0041 0.0136 0.0124
Toxoplasma gondii heat shock protein 90, putative 0.0039 0.0121 0.2489
Schistosoma mansoni family A2 unassigned peptidase (A02 family) 0.0232 0.1661 0.1651
Mycobacterium ulcerans putative regulatory protein 0.0075 0.0406 0.0792
Plasmodium vivax hypothetical protein, conserved 0.0041 0.0134 0.0274
Echinococcus granulosus aryl hydrocarbon receptor 0.0026 0.0018 0.0013
Trichomonas vaginalis conserved hypothetical protein 0.0026 0.0018 0.004
Plasmodium vivax endoplasmin, putative 0.0039 0.0121 0.0244
Giardia lamblia Grp94/Hsp90 0.0031 0.0057 0.0101
Echinococcus granulosus heat shock protein heat shock protein 90 alpha 0.0031 0.0057 0.0101
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0043 0.0154 0.0319
Leishmania major heat shock protein 83-1 0.0039 0.0121 0.0244
Echinococcus granulosus acetylcholinesterase 0.0079 0.0434 0.0947
Loa Loa (eye worm) FKBP5 protein 0.0584 0.4463 1
Trypanosoma cruzi heat shock protein 85, putative 0.0039 0.0121 0.0244
Loa Loa (eye worm) hypothetical protein 0.0107 0.0661 0.1458
Giardia lamblia Nitric oxide synthase, inducible 0.0095 0.0564 0.124
Onchocerca volvulus 0.008 0.0449 1
Brugia malayi FKBP-type peptidyl-prolyl cis-trans isomerase-33, BmFKBP-33 0.008 0.0449 0.098
Trichomonas vaginalis NADPH fad oxidoreductase, putative 0.0095 0.0564 0.1264
Plasmodium vivax peptidyl-prolyl cis-trans isomerase, putative 0.008 0.0449 0.098
Trichomonas vaginalis NADPH cytochrome P450, putative 0.0041 0.0134 0.0301
Brugia malayi flavodoxin family protein 0.0107 0.0661 0.1458
Treponema pallidum peptidyl-prolyl cis-trans isomerase, FKBP-type, 22 kDa (fklB) 0.0584 0.4463 1
Brugia malayi FKBP-type peptidyl-prolyl cis-trans isomerase-12, BmFKBP-12 0.0584 0.4463 1
Trypanosoma cruzi STE group serine/threonine-protein kinase, putative 0.0026 0.0018 0.0013
Brugia malayi hypoxia-induced factor 1 0.0314 0.2309 0.516
Trichomonas vaginalis NADPH cytochrome P450, putative 0.0041 0.0134 0.0301
Schistosoma mansoni hypothetical protein 0.0043 0.0154 0.0142
Trichomonas vaginalis fk506-binding protein, putative 0.008 0.0449 0.1005
Brugia malayi bHLH-PAS transcription factor 0.0075 0.0406 0.0885
Trichomonas vaginalis adenylate and guanylate cyclases, putative 0.0026 0.0018 0.004
Trypanosoma cruzi STE group serine/threonine-protein kinase, putative 0.0026 0.0018 0.0013
Trichomonas vaginalis adenylate and guanylate cyclases, putative 0.0026 0.0018 0.004
Toxoplasma gondii HEAT repeat-containing protein 0.0035 0.0086 0.168
Brugia malayi Calcitonin receptor-like protein seb-1 0.006 0.0288 0.0619
Loa Loa (eye worm) hypothetical protein 0.0079 0.0434 0.0947
Trichomonas vaginalis heat shock protein, putative 0.0039 0.0121 0.0271
Trypanosoma brucei Heat shock protein 83, putative 0.0039 0.0121 0.0244
Echinococcus multilocularis NADPH cytochrome P450 reductase 0.0107 0.0661 0.0854
Loa Loa (eye worm) endoplasmin 0.0039 0.0121 0.0244
Brugia malayi FAD binding domain containing protein 0.0107 0.0661 0.1458
Toxoplasma gondii peptidyl-prolyl cis-trans isomerase, FKBP-type domain-containing protein 0.008 0.0449 1
Plasmodium vivax importin-beta 2, putative 0.0035 0.0086 0.0165
Trypanosoma brucei NADPH--cytochrome P450 reductase, putative 0.0107 0.0661 0.1458
Trichomonas vaginalis heat shock protein, putative 0.0031 0.0057 0.0128
Trypanosoma cruzi Flavodoxin/Radical SAM superfamily/Wyosine base formation, putative 0.0041 0.0134 0.0274
Echinococcus multilocularis Aryl hydrocarbon receptor nuclear 0.0026 0.0018 0.0008
Echinococcus granulosus endoplasmin 0.0031 0.0057 0.0101
Trichomonas vaginalis NADPH cytochrome P450, putative 0.0041 0.0134 0.0301
Trypanosoma cruzi NADPH--cytochrome P450 reductase, putative 0.0041 0.0134 0.0274
Entamoeba histolytica hypothetical protein 0.0043 0.0154 0.0319
Echinococcus multilocularis heat shock protein 90 0.0031 0.0057 0.0059
Entamoeba histolytica hypothetical protein 0.0043 0.0154 0.0319
Trypanosoma cruzi cytochrome P450 reductase, putative 0.0107 0.0661 0.1458
Leishmania major peptidyl-prolyl cis-trans isomerase, macrophage infectivity potentiator precursor, putative 0.008 0.0449 0.098
Trypanosoma brucei heat shock protein, putative 0.0039 0.0121 0.0244
Trypanosoma cruzi FKBP-type peptidylprolyl cis-trans isomerase, putative 0.008 0.0449 0.098
Mycobacterium leprae PROBABLE TRIGGER FACTOR (TF) PROTEIN TIG 0.008 0.0449 1
Trypanosoma brucei FK506-binding protein (FKBP)-type peptidyl-prolyl isomerase, putative 0.0584 0.4463 1
Trypanosoma cruzi PAS-domain containing phosphoglycerate kinase, putative 0.0026 0.0018 0.0013
Trypanosoma brucei NADPH-dependent diflavin oxidoreductase 1 0.0107 0.0661 0.1458
Trichomonas vaginalis Importin beta-1 subunit, putative 0.0028 0.0033 0.0074
Echinococcus multilocularis peptidyl prolyl cis trans isomerase FKBP4 0.0584 0.4463 0.5854
Trypanosoma cruzi peptidyl-prolyl cis-trans isomerase, putative 0.0584 0.4463 1
Loa Loa (eye worm) hypothetical protein 0.0079 0.0434 0.0947
Plasmodium vivax 70 kDa peptidylprolyl isomerase, putative 0.0584 0.4463 1
Trichomonas vaginalis importin beta-1, putative 0.0028 0.0033 0.0074
Giardia lamblia FKBP-type peptidyl-prolyl cis-trans isomerase 0.008 0.0449 0.098
Brugia malayi Carboxylesterase family protein 0.0079 0.0434 0.0947
Brugia malayi PAS domain containing protein 0.0101 0.0616 0.1357
Leishmania major FKBP-type peptidyl-prolyl cis-trans isomerase, putative 0.008 0.0449 0.098
Trypanosoma cruzi p450 reductase, putative 0.0107 0.0661 0.1458
Brugia malayi hypothetical protein 0.034 0.2519 0.5632
Brugia malayi MH2 domain containing protein 0.0144 0.0957 0.2123
Trichomonas vaginalis immunophilin, putative 0.0584 0.4463 1
Loa Loa (eye worm) FKBP-type peptidyl-prolyl cis-trans isomerase-13 0.008 0.0449 0.098
Schistosoma mansoni transcription factor LCR-F1 0.0043 0.0154 0.0142
Leishmania major lipophosphoglycan biosynthetic protein, putative,heat shock protein 90, putative,glucose regulated protein 94, putative 0.0031 0.0057 0.0101
Trichomonas vaginalis fk506-binding protein, putative 0.0584 0.4463 1
Trypanosoma cruzi importin beta-1 subunit, putative 0.0028 0.0033 0.0047
Echinococcus granulosus peptidyl prolyl cis trans isomerase FKBP4 0.0584 0.4463 1
Toxoplasma gondii flavodoxin domain-containing protein 0.0053 0.0231 0.5022
Echinococcus granulosus NADPH dependent diflavin oxidoreductase 1 0.0107 0.0661 0.1458
Echinococcus multilocularis NADPH dependent diflavin oxidoreductase 1 0.0107 0.0661 0.0854
Trypanosoma brucei FKBP-type peptidylprolyl cis-trans isomerase, putative 0.008 0.0449 0.098
Loa Loa (eye worm) FAD binding domain-containing protein 0.0107 0.0661 0.1458
Trypanosoma brucei heat shock protein, putative 0.0039 0.0121 0.0244
Giardia lamblia Hypothetical protein 0.008 0.0449 0.098
Schistosoma mansoni heat shock protein 0.0039 0.0121 0.0109
Mycobacterium ulcerans formate dehydrogenase H FdhF 0.0107 0.0661 0.1371
Plasmodium falciparum heat shock protein 90 0.0039 0.0121 0.0271
Entamoeba histolytica hypothetical protein 0.0043 0.0154 0.0319
Trypanosoma brucei heat shock protein, putative 0.0039 0.0121 0.0244
Trypanosoma cruzi FKBP-type peptidylprolyl cis-trans isomerase, putative 0.008 0.0449 0.098
Plasmodium falciparum S-adenosyl-L-methionine-dependent tRNA 4-demethylwyosine synthase, putative 0.0041 0.0134 0.0301
Loa Loa (eye worm) hypothetical protein 0.0041 0.0136 0.0278
Trypanosoma cruzi peptidyl-prolyl cis-trans isomerase, putative 0.0584 0.4463 1
Trypanosoma cruzi Heat shock protein 83, putative 0.0039 0.0121 0.0244
Brugia malayi Importin beta-1 subunit 0.0035 0.0086 0.0165
Trypanosoma brucei importin beta-1 subunit, putative 0.0035 0.0086 0.0165
Leishmania major importin beta-1 subunit, putative 0.0028 0.0033 0.0047
Entamoeba histolytica type A flavoprotein, putative 0.0041 0.0134 0.0274
Leishmania major NADPH-cytochrome p450 reductase-like protein 0.0107 0.0661 0.1458
Trichomonas vaginalis NADPH cytochrome P450, putative 0.0041 0.0134 0.0301
Leishmania major heat shock protein 83-1 0.0039 0.0121 0.0244
Schistosoma mansoni family S9 non-peptidase homologue (S09 family) 0.0079 0.0434 0.0422
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.006 0.0288 0.0619
Loa Loa (eye worm) aryl Hydrocarbon receptor Associated protein family member 0.0026 0.0018 0.0013
Entamoeba histolytica hypothetical protein 0.0043 0.0154 0.0319
Leishmania major heat shock protein 83-1 0.0039 0.0121 0.0244
Leishmania major peptidyl-prolyl cis-trans isomerase, putative 0.008 0.0449 0.098
Schistosoma mansoni heat shock protein 0.0039 0.0121 0.0109
Giardia lamblia Heat shock protein HSP 90-alpha 0.0039 0.0121 0.0244
Brugia malayi latrophilin 2 splice variant baaae 0.0041 0.0136 0.0278
Loa Loa (eye worm) transcription factor SMAD2 0.0144 0.0957 0.2123
Entamoeba histolytica heat shock protein 90, putative 0.0039 0.0121 0.0244
Entamoeba histolytica peptidyl-prolyl cis-trans isomerase, FKBP-type , putative 0.008 0.0449 0.098
Trypanosoma brucei heat shock protein, putative 0.0039 0.0121 0.0244
Trichomonas vaginalis guanylate cyclase, putative 0.0026 0.0018 0.004
Toxoplasma gondii peptidyl-prolyl cis-trans isomerase, FKBP-type domain-containing protein 0.008 0.0449 1
Onchocerca volvulus 0.008 0.0449 1
Trypanosoma brucei peptidyl-prolyl cis-trans isomerase, putative 0.008 0.0449 0.098
Echinococcus granulosus FK506 binding protein 2 0.008 0.0449 0.098
Schistosoma mansoni immunophilin 0.0584 0.4463 0.4457
Echinococcus multilocularis fk506 binding protein 0.0584 0.4463 0.5854
Trypanosoma cruzi heat shock protein 85, putative 0.0031 0.0057 0.0101
Echinococcus multilocularis heat shock protein 90 0.0039 0.0121 0.0143
Brugia malayi heat shock protein 90 0.0039 0.0121 0.0244
Trypanosoma brucei heat shock protein, putative 0.0039 0.0121 0.0244
Entamoeba histolytica type A flavoprotein, putative 0.0041 0.0134 0.0274
Leishmania major cytochrome P450 reductase, putative 0.0095 0.0564 0.124
Echinococcus multilocularis carboxylesterase 5A 0.0079 0.0434 0.0555
Plasmodium vivax flavodoxin domain containing protein 0.0095 0.0564 0.124
Loa Loa (eye worm) carboxylesterase 0.0079 0.0434 0.0947
Trichomonas vaginalis conserved hypothetical protein 0.008 0.0449 0.1005
Plasmodium falciparum GTP-binding nuclear protein RAN/TC4 0.0026 0.0012 0.0028
Leishmania major hypothetical protein, conserved 0.0041 0.0134 0.0274
Trichomonas vaginalis Importin beta-1 subunit, putative 0.0028 0.0033 0.0074
Trichomonas vaginalis adenylate cyclase, putative 0.0026 0.0018 0.004
Echinococcus granulosus methionine synthase reductase 0.0066 0.0335 0.0725
Schistosoma mansoni hypothetical protein 0.0372 0.2772 0.2763
Echinococcus multilocularis 0.008 0.0449 0.0574
Leishmania major heat shock protein 83-1 0.0039 0.0121 0.0244
Treponema pallidum flavodoxin 0.0041 0.0134 0.0175
Brugia malayi Carboxylesterase family protein 0.0079 0.0434 0.0947
Trypanosoma cruzi peptidyl-prolyl cis-trans isomerase, putative 0.008 0.0449 0.098
Trypanosoma brucei heat shock protein 90, putative 0.0039 0.0121 0.0244
Schistosoma mansoni 5-methyl tetrahydrofolate-homocysteine methyltransferase reductase 0.0066 0.0335 0.0323
Leishmania major fk506-binding protein 1-like protein 0.0584 0.4463 1
Entamoeba histolytica heat shock protein 90, putative 0.0039 0.0121 0.0244
Trichomonas vaginalis heat shock protein, putative 0.0031 0.0057 0.0128
Echinococcus multilocularis transfer RNA-Lys 0.0075 0.0406 0.0518
Wolbachia endosymbiont of Brugia malayi FKBP-type peptidylprolyl isomerase 0.008 0.0449 1
Schistosoma mansoni aryl hydrocarbon receptor 0.0101 0.0616 0.0605
Leishmania major protein kinase, putative 0.0026 0.0018 0.0013
Trichomonas vaginalis guanylate cyclase, putative 0.0026 0.0018 0.004
Echinococcus multilocularis methionine synthase reductase 0.0066 0.0335 0.0424
Trypanosoma brucei hypothetical protein, conserved 0.008 0.0449 0.098
Echinococcus multilocularis FK506 binding protein 8, 38 kDa 0.008 0.0449 0.0574
Echinococcus multilocularis endoplasmin 0.0031 0.0057 0.0059
Echinococcus granulosus peptidyl prolyl cis trans isomerase FKBP4 0.0504 0.3823 0.8561
Plasmodium falciparum NADPH--cytochrome P450 reductase, putative 0.0041 0.0134 0.0301
Entamoeba histolytica peptidyl-prolyl cis-trans isomerase, FKBP-type, putative 0.0584 0.4463 1
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0043 0.0154 0.0187
Loa Loa (eye worm) hypothetical protein 0.034 0.2519 0.5632
Trypanosoma brucei NADPH--cytochrome P450 reductase, putative 0.0107 0.0661 0.1458
Leishmania major p450 reductase, putative 0.0107 0.0661 0.1458
Giardia lamblia Hypothetical protein 0.0095 0.0564 0.124
Trypanosoma cruzi heat shock protein 85, putative 0.0039 0.0121 0.0244
Loa Loa (eye worm) FKBP-type peptidyl-prolyl cis-trans isomerase-30 0.008 0.0449 0.098
Chlamydia trachomatis peptidyl-prolyl cis-trans isomerase 0.008 0.0449 1
Schistosoma mansoni endoplasmin 0.0039 0.0121 0.0109
Echinococcus granulosus NADPH cytochrome P450 reductase 0.0107 0.0661 0.1458
Leishmania major heat shock protein 83-1 0.0039 0.0121 0.0244
Plasmodium vivax NADPH-cytochrome p450 reductase, putative 0.0107 0.0661 0.1458
Toxoplasma gondii peptidyl-prolyl isomerase FKBP12, putative 0.008 0.0449 1
Leishmania major heat shock protein 83-1 0.0039 0.0121 0.0244
Plasmodium vivax heat shock protein 86, putative 0.0039 0.0121 0.0244
Trichomonas vaginalis ran, putative 0.0026 0.0012 0.0028
Echinococcus multilocularis snurportin 1 0.0372 0.2772 0.3629
Plasmodium falciparum importin beta, putative 0.0035 0.0086 0.0192
Trypanosoma cruzi FK506-binding protein (FKBP)-type peptidyl-prolyl isomerase, putative 0.0584 0.4463 1
Brugia malayi FKBP-type peptidyl-prolyl cis-trans isomerase-30, BmFKBP-30 0.008 0.0449 0.098
Trypanosoma cruzi NADPH-dependent FMN/FAD containing oxidoreductase, putative 0.0107 0.0661 0.1458
Trypanosoma cruzi macrophage infectivity potentiator, precursor, putative 0.008 0.0449 0.098
Trypanosoma cruzi heat shock protein 90, putative 0.0039 0.0121 0.0244
Loa Loa (eye worm) MH2 domain-containing protein 0.0144 0.0957 0.2123
Leishmania major heat shock protein 83-1 0.0039 0.0121 0.0244
Wolbachia endosymbiont of Brugia malayi FKBP-type peptidylprolyl isomerase 0.008 0.0449 1
Toxoplasma gondii flavodoxin domain-containing protein 0.0053 0.0231 0.5022
Mycobacterium leprae PROBABLE CHAPERONE PROTEIN HTPG (HEAT SHOCK PROTEIN) (HSP90 FAMILY PROTEIN) (HIGH TEMPERATURE PROTEIN G) 0.0031 0.0057 0.091
Chlamydia trachomatis sulfite reductase 0.0066 0.0335 0.69
Leishmania major heat shock protein 83-1 0.0039 0.0121 0.0244
Leishmania major heat shock protein 83-1 0.0039 0.0121 0.0244
Echinococcus granulosus peptidyl prolyl cis trans isomerase FKBP1A 0.0584 0.4463 1
Echinococcus multilocularis importin subunit beta 1 0.0035 0.0086 0.0096
Trichomonas vaginalis peptidylprolyl isomerase, putative 0.0584 0.4463 1
Trypanosoma brucei NADPH-cytochrome p450 reductase, putative 0.0107 0.0661 0.1458
Trichomonas vaginalis heat shock protein, putative 0.0031 0.0057 0.0128
Leishmania major heat shock protein 83-1 0.0039 0.0121 0.0244
Loa Loa (eye worm) hypoxia-induced factor 1 0.0314 0.2309 0.516
Trypanosoma cruzi FK506-binding protein (FKBP)-type peptidyl-prolyl isomerase, putative 0.0584 0.4463 1
Brugia malayi FKBP-type peptidyl-prolyl cis-trans isomerase-59, BmFKBP59 0.0584 0.4463 1
Trypanosoma brucei heat shock protein 90, putative 0.0039 0.0121 0.0244
Leishmania major heat shock protein 83-1 0.0039 0.0121 0.0244
Brugia malayi FKBP-type peptidyl-prolyl cis-trans isomerase-13, BmFKBP-13 0.008 0.0449 0.098
Loa Loa (eye worm) flavodoxin family protein 0.0041 0.0134 0.0274
Loa Loa (eye worm) pigment dispersing factor receptor c 0.006 0.0288 0.0619
Brugia malayi FAD binding domain containing protein 0.0066 0.0335 0.0725
Schistosoma mansoni single-minded 0.0101 0.0616 0.0605
Leishmania major heat shock protein 83-1 0.0039 0.0121 0.0244
Schistosoma mansoni NADPH flavin oxidoreductase 0.0054 0.0238 0.0226
Leishmania major heat shock protein 83-1 0.0039 0.0121 0.0244
Schistosoma mansoni diflavin oxidoreductase 0.0053 0.0231 0.0219
Echinococcus granulosus heat shock protein 90 0.0039 0.0121 0.0244
Brugia malayi Endoplasmin precursor 0.0039 0.0121 0.0244
Entamoeba histolytica peptidyl-prolyl cis-trans isomerase, putative 0.008 0.0449 0.098
Plasmodium falciparum peptidyl-prolyl cis-trans isomerase FKBP35 0.0584 0.4463 1
Toxoplasma gondii peptidyl-prolyl cis-trans isomerase, FKBP-type domain-containing protein 0.008 0.0449 1
Trypanosoma brucei S-adenosyl-L-methionine-dependent tRNA 4-demethylwyosine synthase, putative 0.0041 0.0134 0.0274
Giardia lamblia Heat shock protein HSP 90-alpha 0.0031 0.0057 0.0101
Echinococcus granulosus Aryl hydrocarbon receptor nuclear 0.0026 0.0018 0.0013
Trichomonas vaginalis adenylate cyclase, type VII, putative 0.0026 0.0018 0.004
Echinococcus granulosus FK506 binding protein 8 38 kDa 0.008 0.0449 0.098
Trypanosoma brucei macrophage infectivity potentiator, precursor, putative 0.008 0.0449 0.098
Trichomonas vaginalis conserved hypothetical protein 0.008 0.0449 0.1005
Trichomonas vaginalis peptidylprolyl isomerase, putative 0.0584 0.4463 1
Mycobacterium tuberculosis Probable trigger factor (TF) protein Tig 0.008 0.0449 1
Entamoeba histolytica peptidyl-prolyl cis-trans isomerase, FKBP-type , putative 0.0584 0.4463 1
Schistosoma mansoni immunophilin FK506 binding protein FKBP12 0.0584 0.4463 0.4457
Trypanosoma cruzi heat shock protein 85, putative 0.0039 0.0121 0.0244
Trichomonas vaginalis fk506-binding protein, putative 0.008 0.0449 0.1005
Schistosoma mansoni endoplasmin 0.0039 0.0121 0.0109
Echinococcus granulosus importin subunit beta 1 0.0035 0.0086 0.0165
Trypanosoma brucei heat shock protein, putative 0.0039 0.0121 0.0244
Echinococcus granulosus carboxylesterase 5A 0.0079 0.0434 0.0947
Trypanosoma cruzi heat shock protein 90, putative 0.0031 0.0057 0.0101
Trichomonas vaginalis conserved hypothetical protein 0.0026 0.0018 0.004
Echinococcus multilocularis peptidyl prolyl cis trans isomerase FKBP4 0.0504 0.3823 0.5012
Trypanosoma brucei heat shock protein, putative 0.0039 0.0121 0.0244
Loa Loa (eye worm) hypothetical protein 0.0026 0.0018 0.0013
Entamoeba histolytica hypothetical protein 0.0028 0.0033 0.0047
Onchocerca volvulus 0.0075 0.0406 0.9012
Schistosoma mansoni cytochrome P450 reductase 0.0107 0.0661 0.065
Echinococcus multilocularis acetylcholinesterase 0.0079 0.0434 0.0555
Brugia malayi hypothetical protein 0.0043 0.0154 0.0319
Giardia lamblia FKBP-type peptidyl-prolyl cis-trans isomerase 0.008 0.0449 0.098
Mycobacterium ulcerans FK-506 binding protein, peptidyl-prolyl cis-trans isomerase 0.0584 0.4463 1
Trypanosoma cruzi cytochrome P450 reductase, putative 0.0107 0.0661 0.1458
Schistosoma mansoni fk506 binding protein 0.008 0.0449 0.0437
Plasmodium falciparum peptidyl-prolyl cis-trans isomerase, putative 0.008 0.0449 0.1005
Echinococcus granulosus single minded 2 0.0075 0.0406 0.0885
Entamoeba histolytica type A flavoprotein, putative 0.0041 0.0134 0.0274
Echinococcus multilocularis atpase aaa+ type core atpase aaa type core 0.0979 0.7615 1
Schistosoma mansoni immunophilin 0.0584 0.4463 0.4457
Echinococcus granulosus snurportin 1 0.0372 0.2772 0.6199

Activities

Activity type Activity value Assay description Source Reference
Potency (functional) 11.5821 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 (functional) = 35.4813 um PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Human alpha-Glucosidase as a Potential Chaperone Treatment of Pompe Disease. (Class of assay: confirmatory) [Related pubchem assays: 997 ] ChEMBL. No reference
Potency (functional) = 35.4813 um PUBCHEM_BIOASSAY: qHTS Assay for Activators of Human alpha-Glucosidase as a Potential Chaperone Treatment of Pompe Disease. (Class of assay: confirmatory) [Related pubchem assays: 1467, 2100, 2112, 1473, 1466 ] ChEMBL. No reference
Potency (functional) = 39.8107 um PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Human Jumonji Domain Containing 2E (JMJD2E). (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) = 39.8107 um PUBCHEM_BIOASSAY: qHTS Assay for Promiscuous and Specific Inhibitors of Cruzain (without detergent). (Class of assay: confirmatory) [Related pubchem assays: 2158 (Confirmation qHTS Assay for Inhibitors of Cruzain), 2249 (Probe Development Summary of Promiscuous Inhibitors (Artifacts) of Cruzain), 2161 (qHTS Assay for Inhibitors of Papain: Counterscreen for Cruzain Assay), 1478 (qHTS Assay for Promiscuous and Specific Inhibitors of Cruzain (with detergent))] ChEMBL. No reference
Potency (functional) 100 uM PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Rango (Ran-regulated importin-beta cargo) - Importin beta complex formation. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID540273] 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.
 
In any case, if you have information about papers containing relevant validation data for this target, please log in using your TDR Targets username and password and send them to us using the corresponding form in this page (only visible to registered users) or contact us.

External resources for this compound

Bibliographic References

No literature references available for this target.

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