Detailed information for compound 1360517

Basic information

Technical information
  • TDR Targets ID: 1360517
  • Name: 2-[[2-(3-chlorophenyl)-5-methyl-1,3-oxazol-4- yl]methylsulfonyl]-N-(3-morpholin-4-ylpropyl) acetamide
  • MW: 455.956 | Formula: C20H26ClN3O5S
  • H donors: 1 H acceptors: 4 LogP: 1.6 Rotable bonds: 10
    Rule of 5 violations (Lipinski): 1
  • SMILES: O=C(CS(=O)(=O)Cc1nc(oc1C)c1cccc(c1)Cl)NCCCN1CCOCC1
  • InChi: 1S/C20H26ClN3O5S/c1-15-18(23-20(29-15)16-4-2-5-17(21)12-16)13-30(26,27)14-19(25)22-6-3-7-24-8-10-28-11-9-24/h2,4-5,12H,3,6-11,13-14H2,1H3,(H,22,25)
  • InChiKey: BWCKMDLVQYLRTJ-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • 2-[[2-(3-chlorophenyl)-5-methyl-oxazol-4-yl]methylsulfonyl]-N-(3-morpholinopropyl)acetamide
  • 2-[[2-(3-chlorophenyl)-5-methyl-4-oxazolyl]methylsulfonyl]-N-(3-morpholinopropyl)acetamide
  • 2-[[2-(3-chlorophenyl)-5-methyl-1,3-oxazol-4-yl]methylsulfonyl]-N-(3-morpholin-4-ylpropyl)ethanamide

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
Homo sapiens ataxin 2 Starlite/ChEMBL No references

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Trypanosoma brucei GTP-binding nuclear protein rtb2, 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
Trypanosoma cruzi GTP-binding nuclear protein rtb2, putative 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 Ran, Ras family GTP-binding protein Get druggable targets OG5_127514 All targets in OG5_127514
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
Plasmodium vivax importin-beta 2, putative Get druggable targets OG5_127843 All targets in OG5_127843
Brugia malayi 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
Plasmodium knowlesi importin beta, 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
Trypanosoma brucei 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 gambiense 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
Schistosoma mansoni ran Get druggable targets OG5_127514 All targets in OG5_127514
Echinococcus multilocularis importin subunit beta 1 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
Neospora caninum GTP-binding nuclear protein Ran, related Get druggable targets OG5_127514 All targets in OG5_127514
Babesia bovis GTP-binding nuclear protein Ran 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
Schistosoma japonicum ko:K07936 GTP-binding nuclear protein Ran, 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
Trichomonas vaginalis importin beta-1, putative 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
Leishmania mexicana importin beta-1 subunit, putative Get druggable targets OG5_127843 All targets in OG5_127843
Plasmodium berghei GTP-binding nuclear protein RAN/TC4, putative Get druggable targets OG5_127514 All targets in OG5_127514
Leishmania mexicana GTP-binding protein, putative Get druggable targets OG5_127514 All targets in OG5_127514
Echinococcus multilocularis GTP binding nuclear protein Ran Get druggable targets OG5_127514 All targets in OG5_127514
Echinococcus granulosus GTP binding nuclear protein Ran 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
Trypanosoma brucei importin beta-1 subunit, putative Get druggable targets OG5_127843 All targets in OG5_127843
Trypanosoma cruzi 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
Schistosoma japonicum Snurportin-1, putative 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
Schistosoma mansoni importin beta-1 Get druggable targets OG5_127843 All targets in OG5_127843
Echinococcus granulosus importin subunit beta 1 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
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
Candida albicans karyopherin-beta Get druggable targets OG5_127843 All targets in OG5_127843
Leishmania infantum GTP-binding protein, putative Get druggable targets OG5_127514 All targets in OG5_127514
Cryptosporidium hominis GTP-binding nuclear protein ran/tc4 Get druggable targets OG5_127514 All targets in OG5_127514
Leishmania braziliensis GTP-binding protein, putative Get druggable targets OG5_127514 All targets in OG5_127514
Schistosoma mansoni ran Get druggable targets OG5_127514 All targets in OG5_127514
Leishmania donovani importin beta-1 subunit, putative Get druggable targets OG5_127843 All targets in OG5_127843
Trypanosoma brucei gambiense GTP-binding nuclear protein rtb2, putative 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
Candida albicans Ran, Ras family GTP-binding protein 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
Plasmodium berghei importin beta, putative Get druggable targets OG5_127843 All targets in OG5_127843
Trichomonas vaginalis Importin beta-1 subunit, putative Get druggable targets OG5_127843 All targets in OG5_127843
Trypanosoma congolense importin beta-1 subunit, putative 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
Cryptosporidium parvum GTP-binding nuclear protein ran/tc4 Get druggable targets OG5_127514 All targets in OG5_127514
Echinococcus granulosus snurportin 1 Get druggable targets OG5_131808 All targets in OG5_131808
Giardia lamblia GTP-binding nuclear protein RAN/TC4 Get druggable targets OG5_127514 All targets in OG5_127514
Plasmodium falciparum importin beta, putative Get druggable targets OG5_127843 All targets in OG5_127843
Leishmania major importin beta-1 subunit, 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
Toxoplasma gondii HEAT repeat-containing protein Get druggable targets OG5_127843 All targets in OG5_127843
Schistosoma mansoni hypothetical protein Get druggable targets OG5_131808 All targets in OG5_131808
Trichomonas vaginalis ran, 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
Leishmania braziliensis 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_127843 All targets in OG5_127843
Brugia malayi Importin beta-1 subunit Get druggable targets OG5_127843 All targets in OG5_127843
Loa Loa (eye worm) nucleolar RNA-associated protein alpha Get druggable targets OG5_131808 All targets in OG5_131808
Plasmodium knowlesi GTP-binding nuclear protein RAN/TC4, putative Get druggable targets OG5_127514 All targets in OG5_127514
Cryptosporidium parvum importin/karyopherin Get druggable targets OG5_127843 All targets in OG5_127843
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
Brugia malayi glutathione reductase 0.0046 0.1077 0.1371
Plasmodium falciparum importin beta, putative 0.0035 0.0773 0.7179
Leishmania major hypothetical protein, conserved 0.003 0.0653 0.6065
Loa Loa (eye worm) Smad1 0.0008 0.0036 0.0036
Plasmodium falciparum ataxin-2 like protein, putative 0.003 0.0653 0.6065
Trichomonas vaginalis glutaminase, putative 0.0265 0.7089 1
Brugia malayi MH2 domain containing protein 0.0116 0.2995 0.3811
Chlamydia trachomatis dihydrolipoyl dehydrogenase 0.0016 0.0255 0.5
Leishmania major GTP-binding protein, putative 0.0026 0.0521 0.4841
Schistosoma mansoni blooms syndrome DNA helicase 0.0018 0.0324 0.0324
Echinococcus granulosus geminin 0.0165 0.4326 0.4326
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.0016 0.0255 0.1033
Loa Loa (eye worm) ATP-dependent DNA helicase 0.001 0.0083 0.0083
Leishmania major ATP-dependent DEAD/H DNA helicase recQ, putative 0.0012 0.0161 0.1492
Schistosoma mansoni transcription factor LCR-F1 0.0035 0.0776 0.0776
Trypanosoma brucei trypanothione reductase 0.0046 0.1077 1
Leishmania major dihydrolipoamide dehydrogenase, putative 0.0016 0.0255 0.2371
Brugia malayi ATP-dependent DNA helicase, RecQ family protein 0.001 0.0083 0.0106
Mycobacterium tuberculosis Probable membrane NADH dehydrogenase NdhA 0.0105 0.2688 0.8837
Loa Loa (eye worm) transcription factor SMAD2 0.0116 0.2995 0.2995
Loa Loa (eye worm) hypothetical protein 0.001 0.0083 0.0083
Loa Loa (eye worm) hypothetical protein 0.0117 0.3033 0.3033
Giardia lamblia GTP-binding nuclear protein RAN/TC4 0.0026 0.0521 1
Trichomonas vaginalis Importin beta-1 subunit, putative 0.0028 0.0593 0.0836
Toxoplasma gondii HEAT repeat-containing protein 0.0035 0.0773 0.7179
Echinococcus granulosus Ataxin 2 N terminaldomain containing protein 0.0014 0.0194 0.0194
Toxoplasma gondii LsmAD domain-containing protein 0.003 0.0653 0.6065
Brugia malayi Smad1 0.0008 0.0036 0.0046
Brugia malayi dihydrolipoyl dehydrogenase, mitochondrial precursor, putative 0.0016 0.0255 0.0325
Schistosoma mansoni hypothetical protein 0.0165 0.4326 0.4326
Schistosoma mansoni smad1 5 8 and 0.0008 0.0036 0.0036
Echinococcus granulosus bloom syndrome protein 0.0023 0.0458 0.0458
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.0016 0.0255 0.1033
Echinococcus multilocularis snurportin 1 0.0372 1 1
Entamoeba histolytica hypothetical protein 0.0035 0.0776 1
Trypanosoma cruzi GTP-binding nuclear protein rtb2, putative 0.0026 0.0521 0.3937
Brugia malayi hypothetical protein 0.0035 0.0776 0.0988
Entamoeba histolytica recQ family helicase, putative 0.0012 0.0161 0.207
Schistosoma mansoni DNA helicase recq5 0.001 0.0083 0.0083
Trypanosoma brucei importin beta-1 subunit, putative 0.0035 0.0773 0.7179
Mycobacterium tuberculosis Dihydrolipoamide dehydrogenase LpdC (lipoamide reductase (NADH)) (lipoyl dehydrogenase) (dihydrolipoyl dehydrogenase) (diaphoras 0.0116 0.3008 1
Brugia malayi glutaminase DH11.1 0.0265 0.7089 0.9023
Trichomonas vaginalis DNA helicase recq, putative 0.0012 0.0161 0.0227
Brugia malayi GTP-binding nuclear protein RAN/TC4 0.0026 0.0521 0.0664
Trichomonas vaginalis DNA helicase recq, putative 0.0023 0.0458 0.0646
Trypanosoma brucei importin beta-1 subunit, putative 0.0035 0.0773 0.7179
Entamoeba histolytica hypothetical protein 0.0035 0.0776 1
Brugia malayi MH2 domain containing protein 0.0008 0.0036 0.0046
Leishmania major 2-oxoglutarate dehydrogenase, e3 component, lipoamidedehydrogenase-like protein 0.0016 0.0255 0.2371
Toxoplasma gondii thioredoxin reductase 0.0046 0.1077 1
Echinococcus granulosus dihydrolipoamide dehydrogenase 0.0016 0.0255 0.0255
Leishmania major importin beta-1 subunit, putative 0.0028 0.0593 0.5505
Toxoplasma gondii GTP-binding nuclear protein ran/tc4 0.0026 0.0521 0.4841
Brugia malayi Thioredoxin reductase 0.0046 0.1077 0.1371
Schistosoma mansoni DNA helicase recq1 0.001 0.0083 0.0083
Plasmodium falciparum dihydrolipoyl dehydrogenase, apicoplast 0.0016 0.0255 0.2371
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0035 0.0776 0.0776
Echinococcus granulosus GTP binding nuclear protein Ran 0.0026 0.0521 0.0521
Brugia malayi MH1 domain containing protein 0.0008 0.0036 0.0046
Brugia malayi MH1 domain containing protein 0.0008 0.0036 0.0046
Echinococcus multilocularis dihydrolipoamide dehydrogenase 0.0016 0.0255 0.0255
Trichomonas vaginalis DNA helicase recq1, putative 0.0023 0.0458 0.0646
Wolbachia endosymbiont of Brugia malayi dihydrolipoamide dehydrogenase E3 component 0.0016 0.0255 0.5
Toxoplasma gondii pyruvate dehydrogenase complex subunit PDH-E3II 0.0016 0.0255 0.2371
Trichomonas vaginalis importin beta-1, putative 0.0028 0.0593 0.0836
Echinococcus multilocularis bloom syndrome protein 0.0023 0.0458 0.0458
Loa Loa (eye worm) MH1 domain-containing protein 0.0008 0.0036 0.0036
Plasmodium vivax ADP-dependent DNA helicase RecQ, putative 0.0016 0.0251 0.2333
Trypanosoma brucei GTP-binding nuclear protein rtb2, putative 0.0026 0.0521 0.4841
Schistosoma mansoni glutaminase 0.0265 0.7089 0.7089
Brugia malayi ATP-dependent DNA helicase, RecQ family protein 0.001 0.0083 0.0106
Brugia malayi alpha keto acid dehydrogenase complex, E3 component, lipoamide dehydrogenase 0.0012 0.014 0.0178
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.0016 0.0255 0.1033
Mycobacterium tuberculosis Probable dehydrogenase 0.0105 0.2688 0.8837
Plasmodium vivax importin-beta 2, putative 0.0035 0.0773 0.7179
Mycobacterium ulcerans glutaminase 0.0265 0.7089 1
Loa Loa (eye worm) thioredoxin reductase 0.0046 0.1077 0.1077
Onchocerca volvulus 0.0293 0.7857 0.5
Trichomonas vaginalis ran, putative 0.0026 0.0521 0.0736
Brugia malayi Bloom's syndrome protein homolog 0.0023 0.0458 0.0583
Trichomonas vaginalis Importin beta-1 subunit, putative 0.0028 0.0593 0.0836
Schistosoma mansoni ran 0.0026 0.0521 0.0521
Plasmodium falciparum ataxin-2 like protein, putative 0.003 0.0653 0.6065
Plasmodium vivax glutathione reductase, putative 0.0046 0.1077 1
Plasmodium vivax GTP-binding nuclear protein RAN/TC4, putative 0.0026 0.0521 0.4841
Echinococcus multilocularis thioredoxin glutathione reductase 0.0046 0.1077 0.1077
Echinococcus multilocularis importin subunit beta 1 0.0035 0.0773 0.0773
Plasmodium falciparum ADP-dependent DNA helicase RecQ 0.002 0.0381 0.3533
Plasmodium falciparum GTP-binding nuclear protein RAN/TC4 0.0026 0.0521 0.4841
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0035 0.0776 0.0776
Plasmodium vivax ataxin-2 like protein, putative 0.003 0.0653 0.6065
Echinococcus multilocularis ATP dependent DNA helicase Q1 0.001 0.0083 0.0083
Echinococcus granulosus mothers against decapentaplegic 5 0.0008 0.0036 0.0036
Schistosoma mansoni smad1 5 8 and 0.0008 0.0036 0.0036
Loa Loa (eye worm) hypothetical protein 0.003 0.0653 0.0653
Trypanosoma cruzi dihydrolipoyl dehydrogenase, putative 0.0016 0.0255 0.1033
Echinococcus multilocularis Smad4 0.0008 0.0036 0.0036
Loa Loa (eye worm) nucleolar RNA-associated protein alpha 0.0372 1 1
Schistosoma mansoni Smad4 0.0008 0.0036 0.0036
Trypanosoma cruzi trypanothione reductase, putative 0.0046 0.1077 1
Echinococcus granulosus TGF beta signal transducer SmadC 0.0008 0.0036 0.0036
Plasmodium falciparum ATP-dependent DNA helicase Q1 0.001 0.0083 0.0772
Schistosoma mansoni hypothetical protein 0.0165 0.4326 0.4326
Echinococcus granulosus Smad4 0.0008 0.0036 0.0036
Echinococcus multilocularis smad 0.0008 0.0036 0.0036
Entamoeba histolytica hypothetical protein 0.0035 0.0776 1
Trypanosoma brucei dihydrolipoamide dehydrogenase 0.0016 0.0255 0.2371
Entamoeba histolytica hypothetical protein 0.0028 0.0593 0.7636
Echinococcus granulosus importin subunit beta 1 0.0035 0.0773 0.0773
Echinococcus multilocularis GTP binding nuclear protein Ran 0.0026 0.0521 0.0521
Mycobacterium tuberculosis Probable NADH dehydrogenase Ndh 0.0105 0.2688 0.8837
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.0016 0.0255 0.1033
Wolbachia endosymbiont of Brugia malayi dihydrolipoamide dehydrogenase E3 component 0.0016 0.0255 0.5
Schistosoma mansoni hypothetical protein 0.0014 0.0194 0.0194
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.0016 0.0255 0.1033
Plasmodium vivax thioredoxin reductase, putative 0.0046 0.1077 1
Mycobacterium tuberculosis NAD(P)H quinone reductase LpdA 0.0116 0.3008 1
Brugia malayi hypothetical protein 0.0293 0.7857 1
Echinococcus granulosus ATP dependent DNA helicase Q5 0.001 0.0083 0.0083
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.0016 0.0255 0.1033
Leishmania major trypanothione reductase 0.0046 0.1077 1
Loa Loa (eye worm) glutaminase 2 0.0265 0.7089 0.7089
Loa Loa (eye worm) glutathione reductase 0.0046 0.1077 0.1077
Plasmodium falciparum dihydrolipoyl dehydrogenase, mitochondrial 0.0016 0.0255 0.2371
Trypanosoma cruzi importin beta-1 subunit, putative 0.0028 0.0593 0.4716
Brugia malayi Pyridine nucleotide-disulphide oxidoreductase, dimerisation domain containing protein 0.0012 0.014 0.0178
Echinococcus multilocularis ATP dependent DNA helicase Q5 0.001 0.0083 0.0083
Plasmodium falciparum thioredoxin reductase 0.0046 0.1077 1
Loa Loa (eye worm) GTP-binding nuclear protein RAN/TC4 0.0026 0.0521 0.0521
Entamoeba histolytica Ran family GTPase 0.0026 0.0521 0.6717
Plasmodium falciparum glutathione reductase 0.0016 0.0255 0.2371
Echinococcus multilocularis TGF beta signal transducer SmadC 0.0008 0.0036 0.0036
Echinococcus multilocularis geminin 0.0165 0.4326 0.4326
Trypanosoma brucei ATP-dependent DEAD/H DNA helicase recQ, putative 0.0012 0.0161 0.1492
Echinococcus granulosus smad 0.0008 0.0036 0.0036
Schistosoma mansoni ran 0.0026 0.0521 0.0521
Loa Loa (eye worm) hypothetical protein 0.0293 0.7857 0.7857
Trypanosoma cruzi PAB1-binding protein , putative 0.003 0.0653 0.5375
Treponema pallidum NADH oxidase 0.0016 0.0255 0.5
Schistosoma mansoni importin beta-1 0.0035 0.0773 0.0773
Loa Loa (eye worm) hypothetical protein 0.0035 0.0773 0.0773
Toxoplasma gondii ATP-dependent DNA helicase, RecQ family protein 0.001 0.0083 0.0772
Mycobacterium tuberculosis Probable oxidoreductase 0.0116 0.3008 1
Mycobacterium tuberculosis Probable nitrite reductase [NAD(P)H] large subunit [FAD flavoprotein] NirB 0.0105 0.2688 0.8837
Echinococcus granulosus ATP dependent DNA helicase Q1 0.001 0.0083 0.0083
Brugia malayi hypothetical protein 0.002 0.0358 0.0455
Brugia malayi hypothetical protein 0.003 0.0653 0.0831
Mycobacterium tuberculosis Probable reductase 0.0105 0.2688 0.8837
Loa Loa (eye worm) glutaminase 0.0265 0.7089 0.7089
Schistosoma mansoni hypothetical protein 0.0372 1 1
Trichomonas vaginalis mercuric reductase, putative 0.0016 0.0255 0.036
Leishmania major dihydrolipoamide dehydrogenase, putative 0.0016 0.0255 0.2371
Loa Loa (eye worm) MH2 domain-containing protein 0.0116 0.2995 0.2995
Mycobacterium tuberculosis NADPH-dependent mycothiol reductase Mtr 0.0046 0.1077 0.2985
Trypanosoma cruzi dihydrolipoyl dehydrogenase, putative 0.0016 0.0255 0.1033
Brugia malayi Importin beta-1 subunit 0.0035 0.0773 0.0984
Schistosoma mansoni smad1 5 8 and 0.0008 0.0036 0.0036
Plasmodium vivax dihydrolipoyl dehydrogenase, apicoplast, putative 0.0016 0.0255 0.2371
Trypanosoma brucei dihydrolipoamide dehydrogenase, point mutation 0.0016 0.0255 0.2371
Toxoplasma gondii NADPH-glutathione reductase 0.0016 0.0255 0.2371
Giardia lamblia NADH oxidase lateral transfer candidate 0.0016 0.0255 0.3929
Trypanosoma brucei dihydrolipoamide dehydrogenase 0.0016 0.0255 0.2371
Trypanosoma brucei dihydrolipoyl dehydrogenase 0.0016 0.0255 0.2371
Trypanosoma cruzi trypanothione reductase, putative 0.0016 0.0255 0.1033
Toxoplasma gondii ATP-dependent DNA helicase, RecQ family protein 0.001 0.0083 0.0772
Brugia malayi RNA, U transporter 1 0.0099 0.2531 0.3222
Echinococcus granulosus thioredoxin glutathione reductase 0.0046 0.1077 0.1077
Schistosoma mansoni smad 0.0008 0.0036 0.0036
Mycobacterium leprae DIHYDROLIPOAMIDE DEHYDROGENASE LPD (LIPOAMIDE REDUCTASE (NADH)) (LIPOYL DEHYDROGENASE) (DIHYDROLIPOYL DEHYDROGENASE) (DIAPHORASE 0.0116 0.3008 1
Schistosoma mansoni dihydrolipoamide dehydrogenase 0.0016 0.0255 0.0255
Toxoplasma gondii ATP-dependent DNA helicase, RecQ family protein 0.0016 0.0246 0.2286
Plasmodium vivax dihydrolipoyl dehydrogenase, mitochondrial, putative 0.0016 0.0255 0.2371
Schistosoma mansoni hypothetical protein 0.0035 0.0776 0.0776
Entamoeba histolytica hypothetical protein 0.0035 0.0776 1
Trypanosoma brucei PAB1-binding protein , putative 0.003 0.0653 0.6065
Plasmodium falciparum thioredoxin reductase 0.0016 0.0255 0.2371
Brugia malayi MH2 domain containing protein 0.0008 0.0036 0.0046
Trichomonas vaginalis glutathione reductase, putative 0.0016 0.0255 0.036
Echinococcus multilocularis Ataxin 2, N terminal,domain containing protein 0.0014 0.0194 0.0194
Leishmania major acetoin dehydrogenase e3 component-like protein 0.0016 0.0255 0.2371
Plasmodium falciparum glutathione reductase 0.0046 0.1077 1
Echinococcus multilocularis mothers against decapentaplegic 5 0.0008 0.0036 0.0036
Trypanosoma cruzi PAB1-binding protein , putative 0.003 0.0653 0.5375
Trypanosoma cruzi GTP-binding nuclear protein rtb2, putative 0.0026 0.0521 0.3937
Loa Loa (eye worm) RecQ helicase 0.0023 0.0458 0.0458
Schistosoma mansoni TGF-beta signal transducer Smad2 0.0008 0.0036 0.0036
Mycobacterium tuberculosis Putative ferredoxin reductase 0.0105 0.2688 0.8837
Loa Loa (eye worm) MH2 domain-containing protein 0.0008 0.0036 0.0036

Activities

Activity type Activity value Assay description Source Reference
Potency (functional) 0.0033 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) 3.6626 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) 13.3714 uM PubChem BioAssay. qHTS for Inhibitors of ATXN expression. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 18.526 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) = 100 um PUBCHEM_BIOASSAY: qHTS Inhibitors of AmpC Beta-Lactamase (assay with detergent). (Class of assay: confirmatory) [Related pubchem assays: 1002 (Confirmation Concentration-Response Assay for Inhibitors of AmpC Beta-Lactamase (assay with detergent)), 585 (Promiscuous and Specific Inhibitors of AmpC Beta-Lactamase (assay without detergent) - a screen old NIH MLSMR collection), 584 (Promiscuous and Specific Inhibitors of AmpC Beta-Lactamase (assay with detergent) - a screen of the old NIH MLSMR collection), 1003 (Confirmation Cuvette-Based Assay for Inhibitors of AmpC Beta-Lactamase (assay with detergent))] 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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