Detailed information for compound 1358897

Basic information

Technical information
  • TDR Targets ID: 1358897
  • Name: 6-(2,5-dimethoxyphenyl)-3-(3-propan-2-yloxyph enyl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadia zine
  • MW: 410.489 | Formula: C21H22N4O3S
  • H donors: 0 H acceptors: 2 LogP: 4.29 Rotable bonds: 6
    Rule of 5 violations (Lipinski): 1
  • SMILES: COc1ccc(c(c1)C1=Nn2c(SC1)nnc2c1cccc(c1)OC(C)C)OC
  • InChi: 1S/C21H22N4O3S/c1-13(2)28-16-7-5-6-14(10-16)20-22-23-21-25(20)24-18(12-29-21)17-11-15(26-3)8-9-19(17)27-4/h5-11,13H,12H2,1-4H3
  • InChiKey: BJHKYFFVKNFAFN-UHFFFAOYSA-N  


Substructure search Similarity search

Network

Hover on a compound node to display the structore

Synonyms

  • 6-(2,5-dimethoxyphenyl)-3-(3-isopropoxyphenyl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine
  • ST5423297
  • SMR000043124
  • MLS000041418
  • ZINC04325529

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens snurportin 1 No references
Homo sapiens neuropeptide S receptor 1 Starlite/ChEMBL No references
Homo sapiens RAN, member RAS oncogene family No references
Homo sapiens nuclear factor, erythroid 2-like 2 Starlite/ChEMBL No references
Homo sapiens ATPase family, AAA domain containing 5 Starlite/ChEMBL No references
Homo sapiens lamin A/C Starlite/ChEMBL No references
Influenza A virus Nonstructural protein 1 Starlite/ChEMBL No references
Homo sapiens karyopherin (importin) beta 1 No references
Homo sapiens microtubule-associated protein tau Starlite/ChEMBL No references

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Loa Loa (eye worm) GTP-binding nuclear protein RAN/TC4 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
Schistosoma mansoni importin beta-1 Get druggable targets OG5_127843 All targets in OG5_127843
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_128723 All targets in OG5_128723
Echinococcus granulosus snurportin 1 Get druggable targets OG5_131808 All targets in OG5_131808
Brugia malayi Intermediate filament tail domain containing protein Get druggable targets OG5_128723 All targets in OG5_128723
Schistosoma japonicum Lamin-C, putative Get druggable targets OG5_128723 All targets in OG5_128723
Schistosoma japonicum ko:K07936 GTP-binding nuclear protein Ran, putative 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
Echinococcus multilocularis importin subunit beta 1 Get druggable targets OG5_127843 All targets in OG5_127843
Schistosoma mansoni microtubule-associated protein tau Get druggable targets OG5_133504 All targets in OG5_133504
Entamoeba histolytica 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
Plasmodium yoelii 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 japonicum Importin subunit beta-1, 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
Schistosoma japonicum ko:K04380 microtubule-associated protein tau, putative Get druggable targets OG5_133504 All targets in OG5_133504
Brugia malayi intermediate filament protein Get druggable targets OG5_128723 All targets in OG5_128723
Echinococcus granulosus GTP binding nuclear protein Ran Get druggable targets OG5_127514 All targets in OG5_127514
Loa Loa (eye worm) nucleolar RNA-associated protein alpha Get druggable targets OG5_131808 All targets in OG5_131808
Leishmania major importin beta-1 subunit, putative Get druggable targets OG5_127843 All targets in OG5_127843
Cryptosporidium hominis importin-beta2 Get druggable targets OG5_127843 All targets in OG5_127843
Candida albicans karyopherin-beta Get druggable targets OG5_127843 All targets in OG5_127843
Echinococcus multilocularis neuropeptide receptor A26 Get druggable targets OG5_136011 All targets in OG5_136011
Loa Loa (eye worm) intermediate filament protein Get druggable targets OG5_128723 All targets in OG5_128723
Schistosoma japonicum IPR000276,Rhodopsin-like GPCR superfamily,domain-containing Get druggable targets OG5_136011 All targets in OG5_136011
Schistosoma japonicum Intermediate filament protein ifa-1, putative Get druggable targets OG5_128723 All targets in OG5_128723
Babesia bovis importin beta subunit, putative 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
Leishmania mexicana importin beta-1 subunit, putative Get druggable targets OG5_127843 All targets in OG5_127843
Schistosoma japonicum expressed protein Get druggable targets OG5_128723 All targets in OG5_128723
Neospora caninum hypothetical protein 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
Trypanosoma brucei gambiense importin beta-1 subunit, putative Get druggable targets OG5_127843 All targets in OG5_127843
Echinococcus multilocularis lamin Get druggable targets OG5_128723 All targets in OG5_128723
Giardia lamblia GTP-binding nuclear protein RAN/TC4 Get druggable targets OG5_127514 All targets in OG5_127514
Schistosoma mansoni intermediate filament proteins Get druggable targets OG5_128723 All targets in OG5_128723
Trypanosoma brucei 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
Candida albicans Ran, Ras family GTP-binding protein Get druggable targets OG5_127514 All targets in OG5_127514
Echinococcus granulosus cytoplasmic intermediate filament protein Get druggable targets OG5_128723 All targets in OG5_128723
Trypanosoma congolense importin beta-1 subunit, putative Get druggable targets OG5_127843 All targets in OG5_127843
Cryptosporidium parvum importin/karyopherin 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 importin beta-1 subunit, putative Get druggable targets OG5_127843 All targets in OG5_127843
Echinococcus granulosus intermediate filament protein Get druggable targets OG5_128723 All targets in OG5_128723
Trypanosoma cruzi GTP-binding nuclear protein rtb2, putative 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
Plasmodium falciparum GTP-binding nuclear protein RAN/TC4 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
Echinococcus granulosus microtubule associated protein 2 Get druggable targets OG5_133504 All targets in OG5_133504
Trichomonas vaginalis ran, putative Get druggable targets OG5_127514 All targets in OG5_127514
Echinococcus granulosus neuropeptide receptor A26 Get druggable targets OG5_136011 All targets in OG5_136011
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_128723 All targets in OG5_128723
Loa Loa (eye worm) intermediate filament tail domain-containing protein Get druggable targets OG5_128723 All targets in OG5_128723
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_128723 All targets in OG5_128723
Echinococcus multilocularis musashi Get druggable targets OG5_128723 All targets in OG5_128723
Brugia malayi GTP-binding nuclear protein RAN/TC4 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
Onchocerca volvulus Get druggable targets OG5_128723 All targets in OG5_128723
Theileria parva GTP-binding nuclear protein ran, 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
Neospora caninum GTP-binding nuclear protein Ran, related 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 mexicana GTP-binding protein, putative Get druggable targets OG5_127514 All targets in OG5_127514
Echinococcus multilocularis cytoplasmic intermediate filament protein Get druggable targets OG5_128723 All targets in OG5_128723
Plasmodium yoelii importin beta-1 subunit Get druggable targets OG5_127843 All targets in OG5_127843
Echinococcus multilocularis lamin dm0 Get druggable targets OG5_128723 All targets in OG5_128723
Plasmodium knowlesi GTP-binding nuclear protein RAN/TC4, putative 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
Echinococcus multilocularis snurportin 1 Get druggable targets OG5_131808 All targets in OG5_131808
Plasmodium vivax GTP-binding nuclear protein RAN/TC4, putative Get druggable targets OG5_127514 All targets in OG5_127514
Schistosoma japonicum ko:K07611 lamin, putative Get druggable targets OG5_128723 All targets in OG5_128723
Echinococcus granulosus neuropeptide s receptor Get druggable targets OG5_136011 All targets in OG5_136011
Brugia malayi RNA, U transporter 1 Get druggable targets OG5_131808 All targets in OG5_131808
Schistosoma mansoni hypothetical protein Get druggable targets OG5_131808 All targets in OG5_131808
Schistosoma japonicum expressed protein Get druggable targets OG5_128723 All targets in OG5_128723
Toxoplasma gondii GTP-binding nuclear protein ran/tc4 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 multilocularis atpase aaa+ type core atpase aaa type core Get druggable targets OG5_139225 All targets in OG5_139225
Schistosoma mansoni ran 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
Echinococcus granulosus lamin dm0 Get druggable targets OG5_128723 All targets in OG5_128723
Plasmodium berghei GTP-binding nuclear protein RAN/TC4, putative Get druggable targets OG5_127514 All targets in OG5_127514
Entamoeba histolytica Ran family GTPase 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
Toxoplasma gondii HEAT repeat-containing 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
Trichomonas vaginalis importin beta-1, 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
Onchocerca volvulus Get druggable targets OG5_128723 All targets in OG5_128723
Plasmodium berghei importin beta, putative Get druggable targets OG5_127843 All targets in OG5_127843
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_128723 All targets in OG5_128723
Leishmania infantum importin beta-1 subunit, putative Get druggable targets OG5_127843 All targets in OG5_127843
Echinococcus multilocularis neuropeptide s receptor Get druggable targets OG5_136011 All targets in OG5_136011
Schistosoma japonicum Importin subunit beta, 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
Echinococcus granulosus lamin Get druggable targets OG5_128723 All targets in OG5_128723
Candida albicans karyopherin-beta Get druggable targets OG5_127843 All targets in OG5_127843
Schistosoma mansoni lamin Get druggable targets OG5_128723 All targets in OG5_128723
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_127843 All targets in OG5_127843
Schistosoma mansoni ran 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
Schistosoma mansoni lamin Get druggable targets OG5_128723 All targets in OG5_128723
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_128723 All targets in OG5_128723
Echinococcus multilocularis microtubule associated protein 2 Get druggable targets OG5_133504 All targets in OG5_133504
Leishmania infantum GTP-binding protein, 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
By sequence similarity to non orthologous known druggable targets
Species Potential target Known druggable target Length Alignment span Identity
Mycobacterium tuberculosis Hypothetical protein Nonstructural protein 1   230 aa 202 aa 23.8 %
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Trypanosoma brucei calcium-activated potassium channel, putative 0.0062 0.0209 1
Trichomonas vaginalis voltage and ligand gated potassium channel, putative 0.0062 0.0209 1
Schistosoma mansoni hypothetical protein 0.0372 0.2335 0.2332
Loa Loa (eye worm) hypothetical protein 0.0062 0.0209 0.0209
Loa Loa (eye worm) hypothetical protein 0.0062 0.0209 0.0209
Brugia malayi Twik (KCNK-like) family of potassium channels, alpha subunit 39B 0.0062 0.0209 0.1178
Loa Loa (eye worm) hypothetical protein 0.0329 0.2044 0.2044
Brugia malayi latrophilin 2 splice variant baaae 0.0041 0.0063 0.0339
Schistosoma mansoni twik family of potassium channels-related 0.0062 0.0209 0.0205
Brugia malayi hypothetical protein 0.0286 0.1743 1
Brugia malayi Twik (KCNK-like) family of potassium channels, alpha subunit 21 0.0062 0.0209 0.1178
Trypanosoma cruzi calcium-activated potassium channel, putative 0.0062 0.0209 0.5
Schistosoma mansoni hypothetical protein 0.0041 0.0063 0.0059
Onchocerca volvulus 0.0058 0.0181 0.8619
Loa Loa (eye worm) abnormal chemotaxis protein 14 0.0051 0.0131 0.0131
Echinococcus granulosus twik family of potassium channels 0.0062 0.0209 0.0205
Echinococcus granulosus microtubule associated protein 2 0.0833 0.5508 0.5506
Onchocerca volvulus 0.0062 0.0209 1
Loa Loa (eye worm) TWK-28 protein 0.0062 0.0209 0.0209
Brugia malayi hypothetical protein 0.0062 0.0209 0.1178
Loa Loa (eye worm) hypothetical protein 0.0062 0.021 0.021
Echinococcus granulosus Niemann Pick C1 protein 0.017 0.0948 0.0944
Loa Loa (eye worm) hypothetical protein 0.0062 0.0209 0.0209
Echinococcus multilocularis small conductance calcium activated potassium 0.1487 1 1
Echinococcus granulosus Two pore potassium channel protein sup 9 0.0062 0.0209 0.0205
Trypanosoma brucei calcium/potassium channel (CAKC), putative 0.0062 0.0209 1
Loa Loa (eye worm) hypothetical protein 0.0062 0.0209 0.0209
Brugia malayi Twik (KCNK-like) family of potassium channels, alpha subunit 35 0.0062 0.0209 0.1178
Plasmodium falciparum potassium channel 0.0062 0.0209 1
Brugia malayi hypothetical protein 0.0043 0.0079 0.043
Schistosoma mansoni hypothetical protein 0.0049 0.0118 0.0114
Brugia malayi Twik (KCNK-like) family of potassium channels, alpha subunit 12 0.0062 0.0209 0.1178
Loa Loa (eye worm) hypothetical protein 0.0641 0.4187 0.4187
Loa Loa (eye worm) hypothetical protein 0.0062 0.0209 0.0209
Schistosoma mansoni calcium-activated potassium channel 0.0971 0.6451 0.6449
Schistosoma mansoni calcium-activated potassium channel 0.1487 1 1
Echinococcus multilocularis Niemann Pick C1 protein 0.0119 0.0597 0.0594
Brugia malayi Twik (KCNK-like) family of potassium channels, alpha subunit 30. 0.0062 0.0209 0.1178
Brugia malayi Twik (KCNK-like) family of potassium channels, alpha subunit 38. C. elegans sup-9 ortholog 0.0062 0.0209 0.1178
Trypanosoma cruzi calcium/potassium channel (CAKC), putative 0.0062 0.0209 0.5
Loa Loa (eye worm) hypothetical protein 0.0286 0.1743 0.1743
Onchocerca volvulus 0.0062 0.0209 1
Echinococcus granulosus potassium channel subfamily K 8 0.0062 0.0209 0.0205
Toxoplasma gondii ion channel protein 0.0062 0.0209 1
Trypanosoma cruzi ion transport protein, putative 0.0062 0.0209 0.5
Schistosoma mansoni twik family of potassium channels-related 0.0062 0.0209 0.0205
Loa Loa (eye worm) intermediate filament tail domain-containing protein 0.0033 0.0004 0.0004
Brugia malayi CHE-14 protein 0.0051 0.0131 0.0729
Loa Loa (eye worm) hypothetical protein 0.0062 0.0209 0.0209
Loa Loa (eye worm) TWK-7 protein 0.0062 0.0209 0.0209
Echinococcus multilocularis importin subunit beta 1 0.0035 0.002 0.0016
Loa Loa (eye worm) hypothetical protein 0.0119 0.0597 0.0597
Schistosoma mansoni twik family of potassium channels-related 0.0062 0.0209 0.0205
Loa Loa (eye worm) hypothetical protein 0.0062 0.0209 0.0209
Schistosoma mansoni twik family of potassium channels-related 0.0062 0.0209 0.0205
Loa Loa (eye worm) hypothetical protein 0.0062 0.0209 0.0209
Onchocerca volvulus 0.0062 0.0209 1
Trichomonas vaginalis voltage and ligand gated potassium channel, putative 0.0062 0.0209 1
Echinococcus multilocularis microtubule associated protein 2 0.0833 0.5508 0.5506
Echinococcus granulosus tumor protein p63 0.0408 0.2585 0.2582
Loa Loa (eye worm) large conductance calcium-activated potassium channel alpha subunit ai 0.0062 0.0209 0.0209
Brugia malayi Calcitonin receptor-like protein seb-1 0.006 0.0194 0.1092
Loa Loa (eye worm) hypothetical protein 0.0062 0.0209 0.0209
Brugia malayi Twik (KCNK-like) family of potassium channels, alpha subunit 32 0.0062 0.0209 0.1178
Echinococcus granulosus Protein patched homolog 1 0.0051 0.0131 0.0127
Echinococcus granulosus importin subunit beta 1 0.0035 0.002 0.0016
Schistosoma mansoni hypothetical protein 0.0049 0.0118 0.0114
Echinococcus granulosus potassium channel subfamily K 8 0.0062 0.0209 0.0205
Loa Loa (eye worm) hypothetical protein 0.0062 0.0209 0.0209
Schistosoma mansoni hypothetical protein 0.0049 0.0118 0.0114
Giardia lamblia Hypothetical protein 0.0062 0.0209 0.5
Echinococcus granulosus snurportin 1 0.0372 0.2335 0.2332
Brugia malayi Twik (KCNK-like) family of potassium channels, alpha subunit 17 0.0062 0.0209 0.1178
Echinococcus granulosus potassium channel subfamily K 0.0062 0.0209 0.0205
Loa Loa (eye worm) hypothetical protein 0.0062 0.0209 0.0209
Leishmania major potassium channel subunit-like protein 0.0062 0.0209 0.5
Brugia malayi Twik (KCNK-like) family of potassium channels, alpha subunit 19. C. elegans unc-58 ortholog 0.0062 0.0209 0.1178
Schistosoma mansoni cellular tumor antigen P53 0.006 0.0191 0.0187
Loa Loa (eye worm) hypothetical protein 0.0062 0.0209 0.0209
Echinococcus multilocularis protein patched 0.0051 0.0131 0.0127
Brugia malayi Twik (KCNK-like) family of potassium channels, alpha subunit 7 0.0062 0.0209 0.1178
Echinococcus granulosus sterol regulatory element binding protein 0.0051 0.0131 0.0127
Schistosoma mansoni calcium-activated potassium channel 0.0062 0.0209 0.0205
Echinococcus multilocularis tumor protein p63 0.0408 0.2585 0.2582
Echinococcus multilocularis TWiK family of potassium channels protein 7 0.0062 0.0209 0.0205
Plasmodium vivax potassium channel, putative 0.0062 0.0209 1
Loa Loa (eye worm) hypothetical protein 0.0062 0.0209 0.0209
Mycobacterium tuberculosis Possible transmembrane cation transporter 0.0062 0.0209 0.5
Echinococcus multilocularis Niemann Pick C1 protein 0.017 0.0948 0.0944
Echinococcus multilocularis survival motor neuron protein 1 0.0286 0.1743 0.1739
Mycobacterium ulcerans transmembrane cation transporter 0.0062 0.0209 0.5
Onchocerca volvulus 0.0062 0.0209 1
Schistosoma mansoni hypothetical protein 0.0062 0.0209 0.0205
Loa Loa (eye worm) hypothetical protein 0.0062 0.0209 0.0209
Trypanosoma cruzi ion transport protein, putative 0.0062 0.0209 0.5
Loa Loa (eye worm) nucleolar RNA-associated protein alpha 0.0372 0.2335 0.2335
Schistosoma mansoni survival motor neuron protein 0.0058 0.0181 0.0177
Schistosoma mansoni twik family of potassium channels-related 0.0062 0.0209 0.0205
Loa Loa (eye worm) hypothetical protein 0.0062 0.0209 0.0209
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0043 0.0079 0.0075
Onchocerca volvulus 0.0062 0.0209 1
Trichomonas vaginalis voltage and ligand gated potassium channel, putative 0.0062 0.0209 1
Schistosoma mansoni transcription factor LCR-F1 0.0043 0.0079 0.0075
Toxoplasma gondii ion channel protein 0.0062 0.0209 1
Schistosoma mansoni twik family of potassium channels-related 0.0062 0.0209 0.0205
Schistosoma mansoni hypothetical protein 0.0049 0.0118 0.0114
Echinococcus multilocularis snurportin 1 0.0372 0.2335 0.2332
Echinococcus multilocularis sterol regulatory element binding protein 0.0051 0.0131 0.0127
Brugia malayi Twik (KCNK-like) family of potassium channels, alpha subunit 39A 0.0062 0.0209 0.1178
Loa Loa (eye worm) hypothetical protein 0.0062 0.0209 0.0209
Loa Loa (eye worm) hypothetical protein 0.0062 0.0209 0.0209
Loa Loa (eye worm) hypothetical protein 0.0454 0.2901 0.2901
Trypanosoma cruzi calcium-activated potassium channel, putative 0.0062 0.0209 0.5
Plasmodium vivax potassium channel, putative 0.0062 0.0209 1
Plasmodium falciparum potassium channel 0.0062 0.0209 1
Leishmania major ion transport protein-like protein 0.0062 0.0209 0.5
Trypanosoma cruzi calcium/potassium channel (CAKC), putative 0.0062 0.0209 0.5
Brugia malayi Twik (KCNK-like) family of potassium channels, alpha subunit 13 0.0062 0.0209 0.1178
Schistosoma mansoni twik family of potassium channels-related 0.0062 0.0209 0.0205
Schistosoma mansoni importin beta-1 0.0035 0.002 0.0016
Brugia malayi Twik (KCNK-like) family of potassium channels, alpha subunit 5 0.0062 0.0209 0.1178
Schistosoma mansoni hypothetical protein 0.0043 0.0079 0.0075
Loa Loa (eye worm) hypothetical protein 0.0062 0.0209 0.0209
Brugia malayi Iron-sulfur cluster assembly accessory protein 0.0058 0.0181 0.1015
Loa Loa (eye worm) hypothetical protein 0.006 0.0191 0.0191
Onchocerca volvulus 0.0062 0.0209 1
Loa Loa (eye worm) hypothetical protein 0.0062 0.0209 0.0209
Echinococcus multilocularis potassium channel subfamily K 8 0.0062 0.0209 0.0205
Mycobacterium ulcerans ion transport protein 0.0062 0.0209 0.5
Trypanosoma cruzi hypothetical protein, conserved 0.0062 0.0209 0.5
Echinococcus granulosus expressed conserved protein 0.0112 0.0548 0.0544
Echinococcus granulosus neuropeptide receptor A26 0.0558 0.3618 0.3616
Loa Loa (eye worm) hypothetical protein 0.0062 0.0209 0.0209
Echinococcus multilocularis Two pore potassium channel protein sup 9 0.0062 0.0209 0.0205
Echinococcus granulosus survival motor neuron protein 1 0.0286 0.1743 0.1739
Leishmania major hypothetical protein, conserved 0.0062 0.0209 0.5
Loa Loa (eye worm) hypothetical protein 0.1487 1 1
Loa Loa (eye worm) hypothetical protein 0.0062 0.0209 0.0209
Loa Loa (eye worm) potassium voltage-gated channel subfamily Q member 5 0.0062 0.0209 0.0209
Loa Loa (eye worm) hypothetical protein 0.0062 0.0209 0.0209
Loa Loa (eye worm) hypothetical protein 0.0062 0.0209 0.0209
Brugia malayi RNA, U transporter 1 0.0099 0.0461 0.2627
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0043 0.0079 0.0075
Brugia malayi hypothetical protein 0.0062 0.0209 0.1178
Loa Loa (eye worm) intermediate filament protein 0.0033 0.0004 0.0004
Brugia malayi Twik (KCNK-like) family of potassium channels, alpha subunit 24 0.0062 0.0209 0.1178
Onchocerca volvulus 0.0062 0.0209 1
Brugia malayi Importin beta-1 subunit 0.0035 0.002 0.0089
Echinococcus multilocularis calcium activated potassium channel variant 0.0062 0.0209 0.0205
Loa Loa (eye worm) hypothetical protein 0.0062 0.0209 0.0209
Schistosoma mansoni microtubule-associated protein tau 0.0833 0.5508 0.5506
Loa Loa (eye worm) hypothetical protein 0.0062 0.0209 0.0209
Echinococcus granulosus twik family of potassium channels 0.0062 0.0209 0.0205
Echinococcus multilocularis twik family of potassium channels 0.0062 0.0209 0.0205
Loa Loa (eye worm) hypothetical protein 0.0051 0.0131 0.0131
Echinococcus multilocularis protein dispatched 1 0.0058 0.018 0.0176
Echinococcus granulosus neuropeptide s receptor 0.0558 0.3618 0.3616
Schistosoma mansoni hypothetical protein 0.0058 0.0181 0.0177
Brugia malayi Twik (KCNK-like) family of potassium channels, alpha subunit 28 0.0062 0.0209 0.1178
Loa Loa (eye worm) hypothetical protein 0.0062 0.0209 0.0209
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.006 0.0194 0.1092
Leishmania major hypothetical protein, conserved 0.0062 0.0209 0.5
Loa Loa (eye worm) hypothetical protein 0.0062 0.0209 0.0209
Echinococcus granulosus TWiK family of potassium channels protein 7 0.0062 0.0209 0.0205
Brugia malayi Twik (KCNK-like) family of potasium channels, alpha subunit 40 0.0062 0.0209 0.1178
Loa Loa (eye worm) S-phase kinase-associated protein 1A 0.0062 0.0209 0.0209
Echinococcus multilocularis neuropeptide s receptor 0.0558 0.3618 0.3616
Brugia malayi Niemann-Pick C1 protein precursor 0.0119 0.0597 0.3412
Echinococcus multilocularis potassium channel subfamily K 8 0.0062 0.0209 0.0205
Trichomonas vaginalis voltage and ligand gated potassium channel, putative 0.0062 0.0209 1
Echinococcus granulosus calcium activated potassium channel variant 0.0062 0.0209 0.0205
Onchocerca volvulus 0.0062 0.0209 1
Echinococcus multilocularis twik family of potassium channels 0.0062 0.0209 0.0205
Loa Loa (eye worm) hypothetical protein 0.0062 0.0209 0.0209
Loa Loa (eye worm) hypothetical protein 0.0062 0.0209 0.0209
Loa Loa (eye worm) hypothetical protein 0.0062 0.0209 0.0209
Loa Loa (eye worm) hypothetical protein 0.0035 0.002 0.002
Leishmania major calcium/potassium channel (CAKC), putative 0.0062 0.0209 0.5
Entamoeba histolytica calcium-gated potassium channel protein, putative 0.0062 0.0209 0.2507
Loa Loa (eye worm) hypothetical protein 0.0062 0.0209 0.0209
Loa Loa (eye worm) pigment dispersing factor receptor c 0.006 0.0194 0.0194
Loa Loa (eye worm) hypothetical protein 0.006 0.0194 0.0194
Schistosoma mansoni calcium-activated potassium channel 0.0062 0.0209 0.0205
Schistosoma mansoni niemann-pick C1 (NPC1) 0.0121 0.061 0.0606
Echinococcus granulosus Niemann Pick C1 protein 0.0119 0.0597 0.0594
Echinococcus multilocularis potassium channel subfamily K 0.0062 0.0209 0.0205
Schistosoma mansoni twik family of potassium channels-related 0.0062 0.0209 0.0205
Onchocerca volvulus 0.006 0.0191 0.9115
Loa Loa (eye worm) hypothetical protein 0.0041 0.0063 0.0063
Loa Loa (eye worm) hypothetical protein 0.0062 0.0209 0.0209
Echinococcus multilocularis atpase aaa+ type core atpase aaa type core 0.0979 0.651 0.6509
Loa Loa (eye worm) uncoordinated protein 58 0.0062 0.0209 0.0209
Schistosoma mansoni patched 1 0.0051 0.0131 0.0127
Loa Loa (eye worm) hypothetical protein 0.0033 0.0004 0.0004
Brugia malayi Twik (KCNK-like) family of potassium channels, alpha subunit 45 0.0062 0.0209 0.1178
Echinococcus multilocularis expressed conserved protein 0.0112 0.0548 0.0544
Loa Loa (eye worm) hypothetical protein 0.0062 0.0209 0.0209
Trypanosoma cruzi hypothetical protein, conserved 0.0062 0.0209 0.5
Trichomonas vaginalis voltage and ligand gated potassium channel, putative 0.0062 0.0209 1
Echinococcus multilocularis neuropeptide receptor A26 0.0558 0.3618 0.3616
Schistosoma mansoni hypothetical protein 0.1487 1 1
Entamoeba histolytica Niemann-Pick C1 protein, putative 0.0119 0.0597 1

Activities

Activity type Activity value Assay description Source Reference
Potency (functional) 0.8196 uM PUBCHEM_BIOASSAY: qHTS for Inhibitors of binding or entry into cells for Lassa Virus. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID463114, AID540249] ChEMBL. No reference
Potency (functional) 0.8199 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) = 4.4668 um PUBCHEM_BIOASSAY: qHTS for Inhibitors of Tau Fibril Formation, Thioflavin T Binding. (Class of assay: confirmatory) [Related pubchem assays: 596 ] ChEMBL. No reference
Potency (functional) = 5.0119 um PUBCHEM_BIOASSAY: qHTS Assay for Modulators of Lamin A Splicing. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 5.1735 uM PUBCHEM_BIOASSAY: Nrf2 qHTS screen for inhibitors. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID493153, AID493163, AID504648] ChEMBL. No reference
Potency (functional) 8.2753 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) 8.2753 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) = 15.8489 um PUBCHEM_BIOASSAY: qHTS Assay for Antagonists of the Neuropeptide S Receptor: cAMP Signal Transduction. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 18.3564 uM PUBCHEM_BIOASSAY: qHTS screen for small molecules that inhibit ELG1-dependent DNA repair in human embryonic kidney (HEK293T) cells expressing luciferase-tagged ELG1. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID493107, AID493125] ChEMBL. No reference
Potency (functional) = 19.9526 um PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Influenza NS1 Protein Function. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) = 25.1189 um PUBCHEM_BIOASSAY: qHTS Assay for Agonists of the Thyroid Stimulating Hormone Receptor. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) = 25.1189 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) = 25.1189 um PUBCHEM_BIOASSAY: qHTS Assay for Agonists of the Thyroid Stimulating Hormone Receptor: Activators of Intracellular cAMP Concentrations in Parental HEK 293. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) = 28.1838 um PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of HPGD (15-Hydroxyprostaglandin Dehydrogenase). (Class of assay: confirmatory) [Related pubchem assays: 2429 (Confirmation qHTS Assay for Inhibitors of HPGD (15-Hydroxyprostaglandin Dehydrogenase)), 2407 (Probe Development Summary for Inhibitors of HPGD (15-Hydroxyprostaglandin Dehydrogenase)), 2427 (Thermal Shift Assay for Inhibitors of HPGD (15-Hydroxyprostaglandin Dehydrogenase))] ChEMBL. No reference
Potency (functional) 31.6228 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) = 35.4813 um PUBCHEM_BIOASSAY: qHTS Multiplex Assay to Identify Dual Action Probes in a Cell Model of Huntington: Aggregate Formation (GFP). (Class of assay: confirmatory) [Related pubchem assays: 1482, 1471 ] ChEMBL. No reference
Potency (functional) = 39.8107 um PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Aldehyde Dehydrogenase 1 (ALDH1A1). (Class of assay: confirmatory) [Related pubchem assays: 1030 (qHTS Validation Assay for Inhibitors of aldehyde dehydrogenase 1 (ALDH1A1))] ChEMBL. No reference
Potency (functional) = 39.8107 um PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Bacillus subtilis Sfp phosphopantetheinyl transferase (PPTase). (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 39.8107 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) 44.6684 uM PubChem BioAssay. qHTS of PTHR Inhibitors: Primary Screen. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 95.2834 uM PubChem BioAssay. qHTS Assay to Find Inhibitors of Pin1. (Class of assay: confirmatory) ChEMBL. No reference

Phenotypes

Whole-cell/tissue/organism interactions

Species name Source Reference Is orphan
Plasmodium falciparum ChEMBL23
Homo sapiens 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.
 
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.

If you have references for this compound, please enter them in a user comment (below) or Contact us.