Detailed information for compound 1428204

Basic information

Technical information
  • TDR Targets ID: 1428204
  • Name: 1-[2-(4-chloro-2-prop-2-enylphenoxy)ethyl]imi dazole; oxalic acid
  • MW: 352.77 | Formula: C16H17ClN2O5
  • H donors: 2 H acceptors: 5 LogP: 3.06 Rotable bonds: 7
    Rule of 5 violations (Lipinski): 1
  • SMILES: OC(=O)C(=O)O.C=CCc1cc(Cl)ccc1OCCn1cncc1
  • InChi: 1S/C14H15ClN2O.C2H2O4/c1-2-3-12-10-13(15)4-5-14(12)18-9-8-17-7-6-16-11-17;3-1(4)2(5)6/h2,4-7,10-11H,1,3,8-9H2;(H,3,4)(H,5,6)
  • InChiKey: ZCJVCLWYHQDCAQ-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • 1-[2-(2-allyl-4-chloro-phenoxy)ethyl]imidazole; oxalic acid
  • 1-[2-(2-allyl-4-chlorophenoxy)ethyl]imidazole; oxalic acid
  • 1-[2-(4-chloro-2-prop-2-enyl-phenoxy)ethyl]imidazole; ethanedioic acid
  • 1-[2-(2-allyl-4-chlorophenoxy)ethyl]-1H-imidazole oxalate
  • MLS001163545
  • SMR000497358

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Influenza A virus Nonstructural protein 1 Starlite/ChEMBL No references
Homo sapiens euchromatic histone-lysine N-methyltransferase 2 Starlite/ChEMBL No references
Homo sapiens APEX nuclease (multifunctional DNA repair enzyme) 1 Starlite/ChEMBL No references
Homo sapiens chromobox homolog 1 Starlite/ChEMBL No references
Homo sapiens lysine (K)-specific demethylase 4A Starlite/ChEMBL No references
Giardia intestinalis Putative fructose-1,6-bisphosphate aldolase Starlite/ChEMBL No references

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Entamoeba histolytica exodeoxyribonuclease III, putative Get druggable targets OG5_126768 All targets in OG5_126768
Echinococcus multilocularis jumonji domain containing protein Get druggable targets OG5_127917 All targets in OG5_127917
Neospora caninum hypothetical protein Get druggable targets OG5_126768 All targets in OG5_126768
Trichomonas vaginalis fructose-bisphosphate aldolase, putative Get druggable targets OG5_129214 All targets in OG5_129214
Schistosoma japonicum DNA-(apurinic or apyrimidinic site) lyase 2, putative Get druggable targets OG5_126768 All targets in OG5_126768
Trichomonas vaginalis fructose-bisphosphate aldolase, putative Get druggable targets OG5_129214 All targets in OG5_129214
Entamoeba histolytica fructose-1,6-bisphosphate aldolase, putative Get druggable targets OG5_129214 All targets in OG5_129214
Plasmodium berghei AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative Get druggable targets OG5_126768 All targets in OG5_126768
Echinococcus granulosus Transcription factor JmjC domain containing protein Get druggable targets OG5_127917 All targets in OG5_127917
Candida albicans one of two closely related potential jumonji-like transcription factor genes similar to S. cerevisiae RPH1 (YER169W) damage-resp Get druggable targets OG5_127917 All targets in OG5_127917
Schistosoma mansoni ap endonuclease Get druggable targets OG5_126768 All targets in OG5_126768
Echinococcus multilocularis chromobox protein 1 Get druggable targets OG5_129545 All targets in OG5_129545
Loa Loa (eye worm) jmjC domain-containing protein Get druggable targets OG5_127917 All targets in OG5_127917
Trichomonas vaginalis fructose-bisphosphate aldolase, putative Get druggable targets OG5_129214 All targets in OG5_129214
Mycobacterium tuberculosis Probable exodeoxyribonuclease III protein XthA (exonuclease III) (EXO III) (AP endonuclease VI) Get druggable targets OG5_126768 All targets in OG5_126768
Wolbachia endosymbiont of Brugia malayi exonuclease III Get druggable targets OG5_126768 All targets in OG5_126768
Trypanosoma congolense apurinic/apyrimidinic endonuclease, putative Get druggable targets OG5_126768 All targets in OG5_126768
Trypanosoma brucei gambiense apurinic/apyrimidinic endonuclease, putative Get druggable targets OG5_126768 All targets in OG5_126768
Brugia malayi Pre-SET motif family protein Get druggable targets OG5_131470 All targets in OG5_131470
Echinococcus multilocularis Transcription factor, JmjC domain containing protein Get druggable targets OG5_127917 All targets in OG5_127917
Trichomonas vaginalis fructose-bisphosphate aldolase, putative Get druggable targets OG5_129214 All targets in OG5_129214
Theileria parva hypothetical protein Get druggable targets OG5_129545 All targets in OG5_129545
Plasmodium falciparum AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative Get druggable targets OG5_126768 All targets in OG5_126768
Leishmania mexicana apurinic/apyrimidinic endonuclease-redox protein,AP-endonuclease Get druggable targets OG5_126768 All targets in OG5_126768
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_127917 All targets in OG5_127917
Treponema pallidum fructose-bisphosphate aldolase Get druggable targets OG5_129214 All targets in OG5_129214
Plasmodium knowlesi AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative Get druggable targets OG5_126768 All targets in OG5_126768
Trichomonas vaginalis fructose-bisphosphate aldolase, putative Get druggable targets OG5_129214 All targets in OG5_129214
Trichomonas vaginalis chromobox protein, putative Get druggable targets OG5_129545 All targets in OG5_129545
Schistosoma japonicum ko:K10772 AP endonuclease 2, putative Get druggable targets OG5_126768 All targets in OG5_126768
Echinococcus granulosus chromobox protein 1 Get druggable targets OG5_129545 All targets in OG5_129545
Trichomonas vaginalis ap endonuclease, putative Get druggable targets OG5_126768 All targets in OG5_126768
Leishmania braziliensis apurinic/apyrimidinic endonuclease-redox protein Get druggable targets OG5_126768 All targets in OG5_126768
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_129545 All targets in OG5_129545
Leishmania major apurinic/apyrimidinic endonuclease-redox protein Get druggable targets OG5_126768 All targets in OG5_126768
Trichomonas vaginalis chromobox protein, putative Get druggable targets OG5_129545 All targets in OG5_129545
Trypanosoma brucei apurinic/apyrimidinic endonuclease, putative Get druggable targets OG5_126768 All targets in OG5_126768
Schistosoma japonicum Chromobox protein homolog 5, putative Get druggable targets OG5_129545 All targets in OG5_129545
Loa Loa (eye worm) heterochromatin protein 1 Get druggable targets OG5_129545 All targets in OG5_129545
Treponema pallidum exodeoxyribonuclease (exoA) Get druggable targets OG5_126768 All targets in OG5_126768
Onchocerca volvulus Heterochromatin protein 1 homolog Get druggable targets OG5_129545 All targets in OG5_129545
Loa Loa (eye worm) exodeoxyribonuclease III family protein Get druggable targets OG5_126768 All targets in OG5_126768
Giardia lamblia Endonuclease/Exonuclease/phosphatase Get druggable targets OG5_126768 All targets in OG5_126768
Loa Loa (eye worm) pre-SET domain-containing protein family protein Get druggable targets OG5_131470 All targets in OG5_131470
Mycobacterium ulcerans exodeoxyribonuclease III protein XthA Get druggable targets OG5_126768 All targets in OG5_126768
Schistosoma mansoni chromobox protein Get druggable targets OG5_129545 All targets in OG5_129545
Schistosoma japonicum JmjC domain-containing histone demethylation protein 3C, putative Get druggable targets OG5_127917 All targets in OG5_127917
Echinococcus granulosus jumonji domain containing protein Get druggable targets OG5_127917 All targets in OG5_127917
Schistosoma mansoni ap endonuclease Get druggable targets OG5_126768 All targets in OG5_126768
Leishmania donovani apurinic/apyrimidinic endonuclease-redox protein Get druggable targets OG5_126768 All targets in OG5_126768
Trichomonas vaginalis fructose-bisphosphate aldolase, putative Get druggable targets OG5_129214 All targets in OG5_129214
Trichomonas vaginalis chromobox protein, putative Get druggable targets OG5_129545 All targets in OG5_129545
Schistosoma japonicum Probable JmjC domain-containing histone demethylation protein 3B, putative Get druggable targets OG5_127917 All targets in OG5_127917
Schistosoma japonicum expressed protein Get druggable targets OG5_127917 All targets in OG5_127917
Onchocerca volvulus Get druggable targets OG5_131470 All targets in OG5_131470
Cryptosporidium hominis dna-(apurinic or apyrimidinic site) lyase Get druggable targets OG5_126768 All targets in OG5_126768
Trypanosoma cruzi apurinic/apyrimidinic endonuclease, putative Get druggable targets OG5_126768 All targets in OG5_126768
Plasmodium yoelii hypothetical protein Get druggable targets OG5_127917 All targets in OG5_127917
Brugia malayi Heterochromatin protein 1 Get druggable targets OG5_129545 All targets in OG5_129545
Brugia malayi jmjC domain containing protein Get druggable targets OG5_127917 All targets in OG5_127917
Candida albicans similar to S. cerevisiae APN2 (YBL019W) DNA repair apurinic/apyrimidinic endonuclease Get druggable targets OG5_126768 All targets in OG5_126768
Schistosoma mansoni jumonji domain containing protein Get druggable targets OG5_127917 All targets in OG5_127917
Echinococcus multilocularis DNA (apurinic or apyrimidinic site) lyase Get druggable targets OG5_126768 All targets in OG5_126768
Trypanosoma cruzi apurinic/apyrimidinic endonuclease Get druggable targets OG5_126768 All targets in OG5_126768
Echinococcus multilocularis chromobox protein 1 Get druggable targets OG5_129545 All targets in OG5_129545
Schistosoma mansoni chromobox protein Get druggable targets OG5_129545 All targets in OG5_129545
Candida albicans similar to S. cerevisiae APN2 (YBL019W) DNA repair apurinic/apyrimidinic endonuclease Get druggable targets OG5_126768 All targets in OG5_126768
Echinococcus granulosus DNA apurinic or apyrimidinic site lyase Get druggable targets OG5_126768 All targets in OG5_126768
Trichomonas vaginalis ap endonuclease, putative Get druggable targets OG5_126768 All targets in OG5_126768
Schistosoma japonicum expressed protein Get druggable targets OG5_127917 All targets in OG5_127917
Plasmodium yoelii putative AP endonuclease-related Get druggable targets OG5_126768 All targets in OG5_126768
Giardia lamblia Fructose-bisphosphate aldolase Get druggable targets OG5_129214 All targets in OG5_129214
Onchocerca volvulus Get druggable targets OG5_129545 All targets in OG5_129545
Candida albicans one of two closely related potential jumonji-like transcription factor genes similar to S. cerevisiae RPH1 (YER169W) damage-resp Get druggable targets OG5_127917 All targets in OG5_127917
Candida albicans one of two closely related potential jumonji-like transcription factor genes similar to S. cerevisiae RPH1 (YER169W) damage-resp Get druggable targets OG5_127917 All targets in OG5_127917
Cryptosporidium parvum conserved hypothetical protein Get druggable targets OG5_126768 All targets in OG5_126768
Theileria parva hypothetical protein Get druggable targets OG5_126768 All targets in OG5_126768
Entamoeba histolytica fructose-1,6-bisphosphate aldolase, putative Get druggable targets OG5_129214 All targets in OG5_129214
Leishmania infantum apurinic/apyrimidinic endonuclease-redox protein Get druggable targets OG5_126768 All targets in OG5_126768
Trichomonas vaginalis chromobox protein, putative Get druggable targets OG5_129545 All targets in OG5_129545
Trichomonas vaginalis set domain proteins, putative Get druggable targets OG5_131470 All targets in OG5_131470
Brugia malayi exodeoxyribonuclease III family protein Get druggable targets OG5_126768 All targets in OG5_126768
Echinococcus granulosus chromobox protein 1 Get druggable targets OG5_129545 All targets in OG5_129545
Plasmodium vivax AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative Get druggable targets OG5_126768 All targets in OG5_126768
Toxoplasma gondii exonuclease III APE Get druggable targets OG5_126768 All targets in OG5_126768
Schistosoma japonicum DNA-(apurinic or apyrimidinic site) lyase 2, putative Get druggable targets OG5_126768 All targets in OG5_126768
Trichomonas vaginalis fructose-bisphosphate aldolase, putative Get druggable targets OG5_129214 All targets in OG5_129214
Candida albicans one of two closely related potential jumonji-like transcription factor genes similar to S. cerevisiae RPH1 (YER169W) damage-resp Get druggable targets OG5_127917 All targets in OG5_127917
Trichomonas vaginalis fructose-bisphosphate aldolase, putative Get druggable targets OG5_129214 All targets in OG5_129214
Schistosoma japonicum ko:K10771 AP endonuclease 1, putative Get druggable targets OG5_126768 All targets in OG5_126768
By sequence similarity to non orthologous known druggable targets
Species Potential target Known druggable target Length Alignment span Identity
Candida albicans fructose-bisphosphate aldolase Putative fructose-1,6-bisphosphate aldolase   323 aa 358 aa 22.6 %
Mycobacterium tuberculosis Probable fructose-bisphosphate aldolase Fba Putative fructose-1,6-bisphosphate aldolase   323 aa 361 aa 25.5 %
Mycobacterium tuberculosis Hypothetical protein Nonstructural protein 1   230 aa 202 aa 23.8 %
Mycobacterium ulcerans fructose-bisphosphate aldolase Putative fructose-1,6-bisphosphate aldolase   323 aa 361 aa 26.9 %
Mycobacterium leprae Probable fructose bisphosphate aldolase Fba Putative fructose-1,6-bisphosphate aldolase   323 aa 361 aa 25.8 %
Candida albicans fructose-bisphosphate aldolase Putative fructose-1,6-bisphosphate aldolase   323 aa 358 aa 22.6 %
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Loa Loa (eye worm) pre-SET domain-containing protein family protein 0.0251 0.682 1
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0353 1 1
Loa Loa (eye worm) heterochromatin protein 1 0.0084 0.1588 0.2264
Onchocerca volvulus 0.005 0.0514 0.0583
Onchocerca volvulus 0.0047 0.0434 0.0481
Brugia malayi jmjC domain containing protein 0.0115 0.2563 0.3706
Trypanosoma cruzi Zn-finger in Ran binding protein and others, putative 0.0047 0.0434 0.5
Brugia malayi Heterochromatin protein 1 0.0084 0.1588 0.2264
Echinococcus granulosus histone lysine methyltransferase setb 0.0036 0.0083 0.0043
Brugia malayi Zn-finger in Ran binding protein and others containing protein 0.0047 0.0434 0.0558
Schistosoma mansoni jumonji domain containing protein 0.0092 0.1822 0.5774
Echinococcus granulosus Nuclear pore complex protein Nup153 0.0047 0.0434 0.0407
Loa Loa (eye worm) SWIB/MDM2 domain-containing protein 0.0133 0.3113 0.452
Loa Loa (eye worm) brahma associated protein 0.0133 0.3113 0.452
Leishmania major hypothetical protein, conserved 0.0047 0.0434 0.5
Schistosoma mansoni histone-lysine n-methyltransferase suv9 0.005 0.0514 0.1496
Schistosoma mansoni fusion 0.0047 0.0434 0.1235
Echinococcus multilocularis lysine specific demethylase 5A 0.0043 0.0289 0.0241
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0353 1 1
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0353 1 1
Loa Loa (eye worm) hypothetical protein 0.006 0.0844 0.1164
Trichomonas vaginalis chromobox protein, putative 0.0051 0.0543 0.0543
Treponema pallidum fructose-bisphosphate aldolase 0.0353 1 0.5
Brugia malayi Pre-SET motif family protein 0.0251 0.682 1
Loa Loa (eye worm) jmjC domain-containing protein 0.0073 0.123 0.1735
Trypanosoma brucei mitochondrial RNA binding complex 1 subunit 0.0047 0.0434 0.5
Echinococcus multilocularis chromobox protein 1 0.0084 0.1588 0.159
Brugia malayi brahma associated protein 60 kDa 0.0133 0.3113 0.452
Trypanosoma cruzi mitochondrial RNA binding complex 1 subunit, putative 0.0047 0.0434 0.5
Schistosoma mansoni hypothetical protein 0.0133 0.3113 1
Plasmodium falciparum SWIB/MDM2 domain-containing protein 0.0133 0.3113 1
Schistosoma mansoni chromobox protein 0.0084 0.1588 0.5009
Schistosoma mansoni chromobox protein 0.0084 0.1588 0.5009
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0353 1 1
Brugia malayi YY1-associated factor 2 0.0047 0.0434 0.0558
Trichomonas vaginalis conserved hypothetical protein 0.0133 0.3113 0.3113
Trichomonas vaginalis set domain proteins, putative 0.0286 0.7907 0.7907
Brugia malayi chromobox protein homolog 3 0.0047 0.0431 0.0553
Onchocerca volvulus Heterochromatin protein 1 homolog 0.0047 0.0431 0.0477
Echinococcus multilocularis SWI:SNF matrix associated 0.0133 0.3113 0.3174
Brugia malayi brahma associated protein 60 kDa 0.0133 0.3113 0.452
Schistosoma mansoni hypothetical protein 0.0133 0.3113 1
Trypanosoma cruzi hypothetical protein, conserved 0.0047 0.0434 0.5
Echinococcus granulosus peregrin 0.0035 0.0057 0.0016
Brugia malayi SWIB/MDM2 domain containing protein 0.0133 0.3113 0.452
Schistosoma mansoni cellular tumor antigen P53 0.005 0.0526 0.1534
Loa Loa (eye worm) hypothetical protein 0.0047 0.0434 0.0558
Echinococcus granulosus PHD finger protein rhinoceros 0.0035 0.0057 0.0016
Loa Loa (eye worm) hypothetical protein 0.0037 0.0112 0.0082
Onchocerca volvulus 0.0047 0.0434 0.0481
Onchocerca volvulus Ubiquitin thioesterase ZRANB1 homolog 0.0047 0.0434 0.0481
Schistosoma mansoni zinc finger protein 0.0047 0.0434 0.1235
Chlamydia trachomatis SWIB complex protein 0.0133 0.3113 0.5
Trichomonas vaginalis conserved hypothetical protein 0.0047 0.0431 0.0431
Echinococcus multilocularis histone lysine N methyltransferase SETMAR 0.0036 0.0083 0.0027
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0036 0.0083 0.0086
Echinococcus granulosus Zinc finger RanBP2 type 0.0047 0.0434 0.0407
Echinococcus granulosus zinc finger protein Ran binding 0.0047 0.0434 0.0407
Schistosoma mansoni jumonji/arid domain-containing protein 0.0043 0.0289 0.0758
Schistosoma mansoni hypothetical protein 0.0047 0.0434 0.1235
Mycobacterium leprae Probable fructose bisphosphate aldolase Fba 0.0172 0.4351 0.5
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0353 1 1
Trypanosoma cruzi hypothetical protein, conserved 0.0047 0.0434 0.5
Leishmania major hypothetical protein, conserved 0.0047 0.0434 0.5
Echinococcus multilocularis zinc finger protein Ran binding 0.0047 0.0434 0.0392
Echinococcus multilocularis Nuclear pore complex protein Nup153 0.0047 0.0434 0.0392
Loa Loa (eye worm) hypothetical protein 0.0047 0.0434 0.0558
Leishmania major hypothetical protein, conserved 0.0047 0.0434 0.5
Mycobacterium tuberculosis Probable fructose-bisphosphate aldolase Fba 0.0172 0.4351 0.5
Trichomonas vaginalis conserved hypothetical protein 0.0047 0.0431 0.0431
Echinococcus multilocularis SWI:SNF matrix associated 0.0133 0.3113 0.3174
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0353 1 1
Plasmodium falciparum zinc finger Ran-binding domain-containing protein 2, putative 0.0047 0.0434 0.1235
Loa Loa (eye worm) hypothetical protein 0.0047 0.0431 0.0553
Plasmodium vivax SET domain protein, putative 0.0036 0.0083 0.0086
Giardia lamblia Fructose-bisphosphate aldolase 0.0353 1 1
Entamoeba histolytica fructose-1,6-bisphosphate aldolase, putative 0.0353 1 0.5
Onchocerca volvulus 0.0037 0.0112 0.007
Toxoplasma gondii histone lysine methyltransferase SET/SUV39 0.0036 0.0083 0.0086
Echinococcus multilocularis histone lysine methyltransferase setb histone lysine methyltransferase eggless 0.0036 0.0083 0.0027
Echinococcus granulosus chromobox protein 1 0.0084 0.1588 0.1603
Echinococcus multilocularis jumonji domain containing protein 0.0049 0.0488 0.0448
Toxoplasma gondii Zn-finger in Ran binding protein and others domain-containing protein 0.0047 0.0434 0.1235
Plasmodium falciparum SWIB/MDM2 domain-containing protein 0.0133 0.3113 1
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0353 1 1
Onchocerca volvulus 0.0047 0.0434 0.0481
Trypanosoma cruzi Zn-finger in Ran binding protein and others/FYVE zinc finger, putative 0.0047 0.0434 0.5
Plasmodium vivax hypothetical protein, conserved 0.0133 0.3113 1
Echinococcus multilocularis tumor protein p63 0.0343 0.9687 1
Trypanosoma brucei hypothetical protein, conserved 0.0047 0.0434 0.5
Mycobacterium ulcerans fructose-bisphosphate aldolase 0.0172 0.4351 0.5
Trypanosoma cruzi hypothetical protein, conserved 0.0047 0.0434 0.5
Toxoplasma gondii DNA topoisomerase domain-containing protein 0.0133 0.3113 1
Leishmania major hypothetical protein, conserved 0.0047 0.0434 0.5
Schistosoma mansoni brg-1 associated factor 0.0133 0.3113 1
Echinococcus granulosus tumor protein p63 0.0343 0.9687 1
Schistosoma mansoni TRABID protein (C64 family) 0.0047 0.0434 0.1235
Brugia malayi Zn-finger in Ran binding protein and others containing protein 0.0047 0.0434 0.0558
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0036 0.0083 0.0086
Trichomonas vaginalis chromobox protein, putative 0.0051 0.0543 0.0543
Trypanosoma brucei hypothetical protein, conserved 0.0047 0.0434 0.5
Toxoplasma gondii ran binding protein 0.0047 0.0434 0.1235
Loa Loa (eye worm) hypothetical protein 0.0047 0.0434 0.0558
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0353 1 1
Trypanosoma cruzi mitochondrial RNA binding complex 1 subunit, putative 0.0047 0.0434 0.5
Echinococcus multilocularis chromobox protein 1 0.0084 0.1588 0.159
Loa Loa (eye worm) hypothetical protein 0.0047 0.0434 0.0558
Onchocerca volvulus 0.0047 0.0434 0.0481
Echinococcus multilocularis SWI:SNF matrix associated 0.0133 0.3113 0.3174
Brugia malayi Pre-SET motif family protein 0.0036 0.0083 0.0039
Trypanosoma cruzi WLM domain containing protein, putative 0.0047 0.0434 0.5
Echinococcus multilocularis ring and YY1 binding protein 0.0047 0.0434 0.0392
Leishmania major hypothetical protein, conserved 0.0047 0.0434 0.5
Trypanosoma brucei Zn-finger in Ran binding protein and others/FYVE zinc finger, putative 0.0047 0.0434 0.5
Echinococcus granulosus SWI:SNF matrix associated 0.0133 0.3113 0.3185
Echinococcus multilocularis Zinc finger, RanBP2 type 0.0047 0.0434 0.0392
Trichomonas vaginalis chromobox protein, putative 0.0084 0.1588 0.1588
Chlamydia trachomatis DNA topoisomerase I 0.0133 0.3113 0.5
Echinococcus granulosus lysine specific demethylase 5A 0.0043 0.0289 0.0256
Loa Loa (eye worm) hypothetical protein 0.005 0.0526 0.0693
Schistosoma mansoni RNA binding protein 0.0047 0.0434 0.1235
Loa Loa (eye worm) hypothetical protein 0.0036 0.0083 0.0039
Schistosoma mansoni hypothetical protein 0.0133 0.3113 1
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0036 0.0083 0.0086
Echinococcus granulosus Transcription factor JmjC domain containing protein 0.0115 0.2563 0.2615
Loa Loa (eye worm) hypothetical protein 0.0047 0.0434 0.0558
Trichomonas vaginalis chromobox protein, putative 0.0084 0.1588 0.1588
Loa Loa (eye worm) jmjC domain-containing protein 0.0043 0.0289 0.0343
Echinococcus multilocularis Transcription factor, JmjC domain containing protein 0.0115 0.2563 0.2603
Onchocerca volvulus 0.005 0.0526 0.0597
Brugia malayi Zn-finger in Ran binding protein and others containing protein 0.0047 0.0434 0.0558
Onchocerca volvulus 0.0133 0.3113 0.3894
Brugia malayi Zn-finger in Ran binding protein and others containing protein 0.0047 0.0434 0.0558
Echinococcus granulosus Upstream activation factor subunit UAF30 0.0133 0.3113 0.3185
Onchocerca volvulus Heterochromatin protein 1 homolog 0.0051 0.0543 0.0619
Trypanosoma cruzi Zn-finger in Ran binding protein and others, putative 0.0047 0.0434 0.5
Echinococcus granulosus ring and YY1 binding protein 0.0047 0.0434 0.0407
Brugia malayi jmjC domain containing protein 0.0043 0.0289 0.0343
Echinococcus granulosus chromobox protein 1 0.0084 0.1588 0.1603
Toxoplasma gondii SWIB/MDM2 domain-containing protein 0.0133 0.3113 1
Schistosoma mansoni jumonji/arid domain-containing protein 0.0043 0.0289 0.0758
Echinococcus multilocularis Upstream activation factor subunit UAF30 0.0133 0.3113 0.3174
Trypanosoma cruzi WLM domain containing protein, putative 0.0047 0.0434 0.5
Onchocerca volvulus 0.0286 0.7907 1
Echinococcus granulosus jumonji domain containing protein 0.0049 0.0488 0.0463
Plasmodium vivax SWIB/MDM2 domain-containing protein, putative 0.0133 0.3113 1

Activities

Activity type Activity value Assay description Source Reference
IC50 (functional) 138.84 uM PubChem BioAssay. Discovery of small molecule inhibitors of the oncogenic and cytokinetic protein MgcRacGAP - Primary and Confirmatory Screens. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 0.006 uM PubChem BioAssay. qHTS Assay for Inhibitors of the Human Apurinic/apyrimidinic Endonuclease 1 (APE1). (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) = 3.9811 um PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Influenza NS1 Protein Function. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 7.0795 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) 11.6891 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) = 17.7828 um PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Fructose-1,6-bisphosphate Aldolase from Giardia Lamblia. (Class of assay: confirmatory) [Related pubchem assays: 2472, 2464 ] ChEMBL. No reference
Potency (functional) 17.7828 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) 19.9526 uM PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of JMJD2A-Tudor Domain. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID504402] ChEMBL. No reference
Potency (functional) 20.5962 uM PubChem BioAssay. A quantitative high throughput screen for small molecules that induce DNA re-replication in SW480 colon adenocarcinoma cells. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 44.6684 uM PubChem BioAssay. qHTS for Agonist of gsp, the Etiologic Mutation Responsible for Fibrous Dysplasia/McCune-Albright Syndrome: qHTS. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 50.1187 uM PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of BAZ2B. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID504391] ChEMBL. No reference
Potency (functional) 89.1251 uM PUBCHEM_BIOASSAY: qHTS for Inhibitors of Polymerase Iota. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID588623] 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.
 
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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