Detailed information for compound 1875272

Basic information

Technical information
  • TDR Targets ID: 1875272
  • Name: 5-furan-2-yl-4-(3-furan-2-ylprop-2-enylidenea mino)-2H-1,2,4-triazole-3-thione
  • MW: 286.309 | Formula: C13H10N4O2S
  • H donors: 0 H acceptors: 2 LogP: 1.93 Rotable bonds: 4
    Rule of 5 violations (Lipinski): 1
  • SMILES: Sc1nnc(n1/N=C/C=C/c1ccco1)c1ccco1
  • InChi: 1S/C13H10N4O2S/c20-13-16-15-12(11-6-3-9-19-11)17(13)14-7-1-4-10-5-2-8-18-10/h1-9H,(H,16,20)/b4-1+,14-7+
  • InChiKey: GFBXSWZKKQOHQG-QGUONYHJSA-N  


Substructure search Similarity search

Network

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Synonyms

  • 5-furan-2-yl-4-[[(E)-3-furan-2-ylprop-2-enylidene]amino]-2H-1,2,4-triazole-3-thione
  • 5-(2-furyl)-4-[3-(2-furyl)prop-2-enylideneamino]-2H-1,2,4-triazole-3-thione
  • 5-(2-furyl)-4-[[(E)-3-(2-furyl)prop-2-enylidene]amino]-2H-1,2,4-triazole-3-thione
  • 5-(2-furyl)-4-{[3-(2-furyl)-2-propen-1-ylidene]amino}-4H-1,2,4-triazole-3-thiol
  • MLS000676860
  • SMR000271867
  • ST044780

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Trypanosoma brucei hypothetical protein, conserved Starlite/ChEMBL No references
Homo sapiens Rap guanine nucleotide exchange factor (GEF) 3 Starlite/ChEMBL No references
Homo sapiens nuclear factor, erythroid 2-like 2 Starlite/ChEMBL No references
Homo sapiens hydroxyprostaglandin dehydrogenase 15-(NAD) Starlite/ChEMBL No references
Homo sapiens regulator of G-protein signaling 4 Starlite/ChEMBL No references
Mus musculus RAR-related orphan receptor gamma Starlite/ChEMBL No references
Homo sapiens euchromatic histone-lysine N-methyltransferase 2 Starlite/ChEMBL No references
Homo sapiens muscleblind-like splicing regulator 1 Starlite/ChEMBL No references
Homo sapiens lysine (K)-specific demethylase 4A Starlite/ChEMBL No references
Homo sapiens polymerase (DNA directed) iota Starlite/ChEMBL No references
Homo sapiens peptidylprolyl cis/trans isomerase, NIMA-interacting 1 Starlite/ChEMBL No references

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Brugia malayi Pin1-type peptidyl-prolyl cis-trans isomerase, BmPin1 Get druggable targets OG5_128367 All targets in OG5_128367
Candida albicans peptidylprolyl cis/trans isomerase isolated by functional complementation of S. cerevisiae ESS1 (YJR017C) which interacts with t Get druggable targets OG5_128367 All targets in OG5_128367
Brugia malayi jmjC domain containing protein Get druggable targets OG5_127917 All targets in OG5_127917
Brugia malayi Muscleblind-like protein Get druggable targets OG5_132352 All targets in OG5_132352
Trichomonas vaginalis conserved hypothetical protein Get druggable targets OG5_128367 All targets in OG5_128367
Plasmodium yoelii hypothetical protein Get druggable targets OG5_127917 All targets in OG5_127917
Leishmania braziliensis peptidyl-prolyl cis-trans isomerase/rotamase, putative,PPIase, putative Get druggable targets OG5_128367 All targets in OG5_128367
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_132352 All targets in OG5_132352
Echinococcus multilocularis muscleblind protein 1 Get druggable targets OG5_132352 All targets in OG5_132352
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
Echinococcus granulosus expressed protein Get druggable targets OG5_128367 All targets in OG5_128367
Echinococcus multilocularis expressed protein Get druggable targets OG5_141764 All targets in OG5_141764
Leishmania mexicana hypothetical protein, conserved Get druggable targets OG5_146801 All targets in OG5_146801
Trypanosoma congolense peptidyl-prolyl cis-trans isomerase/rotamase, putative Get druggable targets OG5_128367 All targets in OG5_128367
Babesia bovis peptidyl-prolyl cis-trans isomerase, putative Get druggable targets OG5_128367 All targets in OG5_128367
Trypanosoma brucei hypothetical protein, conserved Get druggable targets OG5_146801 All targets in OG5_146801
Brugia malayi N-terminal motif family protein Get druggable targets OG5_131726 All targets in OG5_131726
Entamoeba histolytica peptidyl-prolyl cis-trans isomerase, putative Get druggable targets OG5_128367 All targets in OG5_128367
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 rotamase, putative Get druggable targets OG5_128367 All targets in OG5_128367
Leishmania infantum peptidyl-prolyl cis-trans isomerase/rotamase, putative,PPIase, putative Get druggable targets OG5_128367 All targets in OG5_128367
Trichomonas vaginalis set domain proteins, putative Get druggable targets OG5_131470 All targets in OG5_131470
Leishmania donovani peptidyl-prolyl cis-trans isomerase/rotamase, putative Get druggable targets OG5_128367 All targets in OG5_128367
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_127917 All targets in OG5_127917
Brugia malayi Pre-SET motif family protein Get druggable targets OG5_131470 All targets in OG5_131470
Schistosoma japonicum Probable JmjC domain-containing histone demethylation protein 3B, putative Get druggable targets OG5_127917 All targets in OG5_127917
Trypanosoma cruzi hypothetical protein, conserved Get druggable targets OG5_146801 All targets in OG5_146801
Onchocerca volvulus Rap guanine nucleotide exchange factor 1 homolog Get druggable targets OG5_131726 All targets in OG5_131726
Trypanosoma brucei gambiense peptidyl-prolyl cis-trans isomerase/rotamase, putative,PPIase, putative Get druggable targets OG5_128367 All targets in OG5_128367
Echinococcus granulosus jumonji domain containing protein Get druggable targets OG5_127917 All targets in OG5_127917
Schistosoma japonicum expressed protein Get druggable targets OG5_127917 All targets in OG5_127917
Schistosoma japonicum JmjC domain-containing histone demethylation protein 3C, putative Get druggable targets OG5_127917 All targets in OG5_127917
Echinococcus multilocularis jumonji domain containing protein Get druggable targets OG5_127917 All targets in OG5_127917
Trypanosoma congolense HpcH/HpaI aldolase/citrate lyase family, putative Get druggable targets OG5_146801 All targets in OG5_146801
Onchocerca volvulus Get druggable targets OG5_131470 All targets in OG5_131470
Theileria parva peptidyl-prolyl cis-trans isomerase, putative Get druggable targets OG5_128367 All targets in OG5_128367
Loa Loa (eye worm) pre-SET domain-containing protein family protein Get druggable targets OG5_131470 All targets in OG5_131470
Echinococcus granulosus Transcription factor JmjC domain containing protein Get druggable targets OG5_127917 All targets in OG5_127917
Loa Loa (eye worm) jmjC domain-containing protein Get druggable targets OG5_127917 All targets in OG5_127917
Leishmania infantum hypothetical protein, conserved Get druggable targets OG5_146801 All targets in OG5_146801
Schistosoma japonicum ko:K09578 peptidyl-prolyl cis-trans isomerase NIMA-interacting 1, putative Get druggable targets OG5_128367 All targets in OG5_128367
Trypanosoma cruzi hypothetical protein, conserved Get druggable targets OG5_146801 All targets in OG5_146801
Leishmania donovani HpcH/HpaI aldolase/citrate lyase family, putative Get druggable targets OG5_146801 All targets in OG5_146801
Candida albicans peptidylprolyl cis/trans isomerase isolated by functional complementation of S. cerevisiae ESS1 (YJR017C) which interacts with t Get druggable targets OG5_128367 All targets in OG5_128367
Leishmania major peptidyl-prolyl cis-trans isomerase/rotamase, putative,PPIase, putative Get druggable targets OG5_128367 All targets in OG5_128367
Echinococcus multilocularis expressed protein Get druggable targets OG5_128367 All targets in OG5_128367
Leishmania mexicana peptidyl-prolyl cis-trans isomerase/rotamase, putative,PPIase, putative Get druggable targets OG5_128367 All targets in OG5_128367
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_131726 All targets in OG5_131726
Echinococcus granulosus muscleblind protein Get druggable targets OG5_132352 All targets in OG5_132352
Toxoplasma gondii peptidylprolyl isomerase Get druggable targets OG5_128367 All targets in OG5_128367
Loa Loa (eye worm) Pin1-type peptidyl-prolyl cis-trans isomerase Get druggable targets OG5_128367 All targets in OG5_128367
Trypanosoma cruzi peptidyl-prolyl cis-trans isomerase Get druggable targets OG5_128367 All targets in OG5_128367
Leishmania major hypothetical protein, conserved Get druggable targets OG5_146801 All targets in OG5_146801
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 rotamase, putative Get druggable targets OG5_128367 All targets in OG5_128367
Schistosoma japonicum expressed protein Get druggable targets OG5_127917 All targets in OG5_127917
Trypanosoma brucei peptidyl-prolyl cis-trans isomerase/rotamase, putative Get druggable targets OG5_128367 All targets in OG5_128367
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_132352 All targets in OG5_132352
Trypanosoma cruzi peptidyl-prolyl cis-trans isomerase Get druggable targets OG5_128367 All targets in OG5_128367
Leishmania braziliensis hypothetical protein, conserved Get druggable targets OG5_146801 All targets in OG5_146801
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 rotamase Get druggable targets OG5_128367 All targets in OG5_128367
Schistosoma mansoni jumonji domain containing protein Get druggable targets OG5_127917 All targets in OG5_127917
Echinococcus multilocularis muscleblind protein Get druggable targets OG5_132352 All targets in OG5_132352
Neospora caninum peptidyl-prolyl cis-trans isomerase NIMA- interacting 1, putative Get druggable targets OG5_128367 All targets in OG5_128367
Trypanosoma brucei gambiense hypothetical protein, conserved Get druggable targets OG5_146801 All targets in OG5_146801
Echinococcus multilocularis Transcription factor, JmjC domain containing protein Get druggable targets OG5_127917 All targets in OG5_127917
Echinococcus granulosus expressed protein Get druggable targets OG5_141764 All targets in OG5_141764
By sequence similarity to non orthologous known druggable targets
Species Potential target Known druggable target Length Alignment span Identity
Plasmodium falciparum steroid dehydrogenase, putative hydroxyprostaglandin dehydrogenase 15-(NAD) 266 aa 216 aa 22.2 %
Leishmania major peptidyl-prolyl cis-trans isomerase, putative peptidylprolyl cis/trans isomerase, NIMA-interacting 1 163 aa 133 aa 27.8 %
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Onchocerca volvulus 0.0286 0.3972 1
Schistosoma mansoni axis inhibition protein axin 0.0023 0.0159 0.0186
Brugia malayi jmjC domain containing protein 0.0115 0.1495 0.4312
Schistosoma mansoni jumonji domain containing protein 0.0092 0.1152 0.135
Trypanosoma brucei DNA polymerase kappa, putative 0.0016 0.0056 0.0156
Trypanosoma brucei DNA polymerase eta, putative 0.0023 0.0161 0.0451
Toxoplasma gondii histone lysine methyltransferase SET/SUV39 0.0036 0.0346 0.877
Brugia malayi hypothetical protein 0.0043 0.0453 0.1306
Loa Loa (eye worm) hypothetical protein 0.006 0.0698 0.2014
Echinococcus granulosus glutamate receptor ionotropic kainate 3 0.0049 0.0541 0.0541
Trypanosoma cruzi DNA polymerase kappa, putative 0.0023 0.0161 0.0451
Loa Loa (eye worm) metabotropic glutamate receptor 8 0.0025 0.0191 0.055
Trichomonas vaginalis conserved hypothetical protein 0.004 0.0408 0.0654
Echinococcus granulosus dna polymerase eta 0.0023 0.0161 0.0161
Trypanosoma brucei unspecified product 0.0016 0.0056 0.0156
Loa Loa (eye worm) hypothetical protein 0.0023 0.0159 0.0458
Loa Loa (eye worm) RGC/RGC protein kinase 0.0025 0.0191 0.055
Loa Loa (eye worm) hypothetical protein 0.0036 0.0346 0.0997
Echinococcus multilocularis dna polymerase eta 0.0023 0.0161 0.0161
Onchocerca volvulus 0.0025 0.0191 0.048
Brugia malayi Pre-SET motif family protein 0.0251 0.3468 1
Brugia malayi PHD-finger family protein 0.0035 0.0334 0.0962
Echinococcus granulosus jumonji domain containing protein 0.0049 0.0534 0.0534
Leishmania major DNA polymerase eta, putative 0.0023 0.0161 0.0451
Trypanosoma brucei DNA polymerase kappa, putative 0.0023 0.0161 0.0451
Trypanosoma cruzi DNA polymerase kappa, putative 0.0023 0.0161 0.0451
Echinococcus multilocularis glutamate receptor subunit protein glur 0.0049 0.0541 0.0541
Echinococcus multilocularis histone lysine N methyltransferase SETMAR 0.0036 0.0346 0.0346
Loa Loa (eye worm) hypothetical protein 0.0025 0.0191 0.055
Brugia malayi Regulator of G protein signaling domain containing protein 0.0023 0.0159 0.0458
Schistosoma mansoni jumonji/arid domain-containing protein 0.0043 0.0441 0.0517
Echinococcus multilocularis histone lysine methyltransferase setb histone lysine methyltransferase eggless 0.0036 0.0346 0.0346
Schistosoma mansoni regulator of G protein signaling 3 rgs3 0.0023 0.0159 0.0186
Echinococcus granulosus regulator of G protein signaling 7 0.0034 0.0314 0.0314
Loa Loa (eye worm) hypothetical protein 0.0025 0.0191 0.055
Loa Loa (eye worm) glutamate receptor 2 0.0049 0.0541 0.1559
Trypanosoma brucei unspecified product 0.0023 0.0161 0.0451
Brugia malayi ImpB/MucB/SamB family protein 0.0023 0.0161 0.0464
Brugia malayi jmjC domain containing protein 0.0043 0.0441 0.1272
Brugia malayi Muscleblind-like protein 0.018 0.2439 0.7033
Trypanosoma brucei unspecified product 0.0016 0.0056 0.0156
Echinococcus multilocularis metabotropic glutamate receptor 2 0.0025 0.0191 0.0191
Schistosoma mansoni rotamase 0.004 0.0408 0.0478
Trypanosoma cruzi hypothetical protein, conserved 0.0257 0.3549 1
Brugia malayi hypothetical protein 0.0023 0.0159 0.0458
Trichomonas vaginalis rotamase, putative 0.0039 0.0394 0.0618
Treponema pallidum amino acid ABC transporter, periplasmic binding protein (hisJ) 0.0127 0.1662 0.5
Mycobacterium ulcerans citrate (pro-3S)-lyase subunit beta 0.003 0.0252 0.0607
Echinococcus multilocularis glutamate receptor NMDA 0.0525 0.7443 0.7443
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0013 0.0009 0.0011
Entamoeba histolytica hypothetical protein 0.0043 0.0453 1
Echinococcus granulosus histone lysine methyltransferase setb 0.0036 0.0346 0.0346
Schistosoma mansoni glutamate receptor NMDA 0.0049 0.0541 0.0634
Brugia malayi PXA domain containing protein 0.0023 0.0159 0.0458
Loa Loa (eye worm) hypothetical protein 0.0218 0.2985 0.8606
Schistosoma mansoni protein kinase 0.0025 0.0191 0.0224
Trypanosoma brucei DNA polymerase kappa, putative 0.0023 0.0161 0.0451
Trypanosoma brucei DNA polymerase IV, putative 0.0023 0.0161 0.0451
Mycobacterium ulcerans citrate (pro-3S)-lyase subunit beta 0.003 0.0252 0.0607
Trypanosoma cruzi DNA polymerase kappa, putative 0.0023 0.0161 0.0451
Schistosoma mansoni hypothetical protein 0.0049 0.0541 0.0634
Schistosoma mansoni glutamate receptor kainate 0.0049 0.0541 0.0634
Echinococcus multilocularis metabotropic glutamate receptor 5 0.0025 0.0191 0.0191
Entamoeba histolytica hypothetical protein 0.0043 0.0453 1
Echinococcus multilocularis jumonji domain containing protein 0.0049 0.0534 0.0534
Echinococcus granulosus beta-adrenergic receptor kinase 0.0023 0.0159 0.0159
Loa Loa (eye worm) hypothetical protein 0.0025 0.0191 0.055
Schistosoma mansoni serine/threonine protein kinase 0.0023 0.0159 0.0186
Entamoeba histolytica peptidyl-prolyl cis-trans isomerase, putative 0.0039 0.0394 0.7999
Brugia malayi regulator of G-protein signaling egl-10 0.0034 0.0314 0.0906
Echinococcus granulosus expressed protein 0.0451 0.6361 0.6361
Trypanosoma brucei DNA polymerase IV, putative 0.0023 0.0161 0.0451
Trypanosoma cruzi extracellular receptor, putative 0.0025 0.0191 0.0535
Trichomonas vaginalis set domain proteins, putative 0.0286 0.3972 1
Loa Loa (eye worm) hypothetical protein 0.0025 0.0191 0.055
Trichomonas vaginalis DNA polymerase eta, putative 0.0023 0.0161 0.0006
Echinococcus granulosus metabotropic glutamate receptor 2 0.0025 0.0191 0.0191
Echinococcus granulosus glutamate receptor subunit protein glur 0.0049 0.0541 0.0541
Trypanosoma cruzi DNA polymerase eta, putative 0.0023 0.0161 0.0451
Schistosoma mansoni glutamate receptor kainate 0.0049 0.0541 0.0634
Loa Loa (eye worm) hypothetical protein 0.0023 0.0159 0.0458
Trichomonas vaginalis Citrate lyase beta chain, putative 0.003 0.0252 0.0245
Echinococcus multilocularis muscleblind protein 1 0.018 0.2439 0.2439
Echinococcus multilocularis A kinase anchor protein 10, mitochondrial 0.0023 0.0159 0.0159
Echinococcus granulosus peregrin 0.0035 0.0334 0.0334
Loa Loa (eye worm) hypothetical protein 0.0025 0.0191 0.055
Brugia malayi A-kinase anchor protein 10, precursor 0.0023 0.0159 0.0458
Echinococcus multilocularis expressed protein 0.0451 0.6361 0.6361
Echinococcus granulosus regulator of G protein signaling 7 0.0034 0.0314 0.0314
Schistosoma mansoni glutamate receptor AMPA 0.0049 0.0541 0.0634
Trypanosoma cruzi 2,4-dihydroxyhept-2-ene-1,7-dioic acid aldolase, putative 0.003 0.0252 0.0708
Brugia malayi Glutamate receptor 1 precursor 0.0049 0.0541 0.1559
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0036 0.0346 0.0406
Echinococcus granulosus Ribosomal protein S1 RNA binding domain 0.0049 0.0541 0.0541
Echinococcus multilocularis Transcription factor, JmjC domain containing protein 0.0115 0.1495 0.1495
Trypanosoma brucei hypothetical protein, conserved 0.0257 0.3549 1
Echinococcus granulosus receptor type guanylyl cyclase 0.0025 0.0191 0.0191
Trypanosoma brucei DNA polymerase kappa, putative 0.0023 0.0161 0.0451
Trypanosoma brucei DNA polymerase kappa, putative 0.0016 0.0056 0.0156
Schistosoma mansoni bromodomain-containing nuclear protein 1 brd1 0.0035 0.0334 0.0391
Echinococcus multilocularis regulator of G protein signaling 7 0.0034 0.0314 0.0314
Schistosoma mansoni regulator of G protein signaling 17 19 20 (rgs17 19 20) 0.0023 0.0159 0.0186
Schistosoma mansoni serine/threonine protein kinase 0.0023 0.0159 0.0186
Echinococcus multilocularis Glutamate receptor, ionotropic kainate 2 0.0075 0.0908 0.0908
Schistosoma mansoni histone-lysine n-methyltransferase suv9 0.0036 0.0346 0.0406
Schistosoma mansoni serine/threonine protein kinase 0.0023 0.0159 0.0186
Trypanosoma brucei DNA polymerase kappa, putative 0.0023 0.0161 0.0451
Trypanosoma brucei DNA polymerase kappa, putative 0.0023 0.0161 0.0451
Echinococcus multilocularis expressed protein 0.004 0.0408 0.0408
Loa Loa (eye worm) hypothetical protein 0.0025 0.0191 0.055
Loa Loa (eye worm) hypothetical protein 0.0025 0.0191 0.055
Toxoplasma gondii peptidylprolyl isomerase 0.0039 0.0394 1
Echinococcus granulosus Glutamate receptor ionotropic kainate 2 0.0075 0.0908 0.0908
Echinococcus multilocularis glutamate receptor ionotropic kainate 0.0049 0.0541 0.0541
Echinococcus granulosus dna polymerase kappa 0.0023 0.0161 0.0161
Schistosoma mansoni glutamate receptor kainate 0.0049 0.0541 0.0634
Echinococcus multilocularis dna polymerase kappa 0.0023 0.0161 0.0161
Leishmania major peptidyl-prolyl cis-trans isomerase/rotamase, putative,PPIase, putative 0.0039 0.0394 0.1109
Schistosoma mansoni transcription factor LCR-F1 0.0043 0.0453 0.0531
Echinococcus granulosus expressed protein 0.004 0.0408 0.0408
Echinococcus multilocularis regulator of G protein signaling 0.0023 0.0159 0.0159
Echinococcus granulosus glutamate receptor ionotrophic AMPA 3 0.0075 0.0908 0.0908
Loa Loa (eye worm) glutamate receptor 1 0.0049 0.0541 0.1559
Echinococcus multilocularis glutamate receptor, ionotrophic, AMPA 3 0.0075 0.0908 0.0908
Loa Loa (eye worm) hypothetical protein 0.0023 0.0159 0.0458
Echinococcus granulosus tyrosine kinase 0.0025 0.0191 0.0191
Loa Loa (eye worm) PXA domain-containing protein 0.0023 0.0159 0.0458
Brugia malayi Glutamate receptor 2 precursor 0.0049 0.0541 0.1559
Echinococcus multilocularis terminal deoxycytidyl transferase rev1 0.0023 0.0161 0.0161
Echinococcus multilocularis axis inhibition protein axin 0.0023 0.0159 0.0159
Schistosoma mansoni axis inhibition protein axin 0.0023 0.0159 0.0186
Echinococcus granulosus metabotropic glutamate receptor 5 0.0025 0.0191 0.0191
Treponema pallidum amino acid ABC transporter, periplasmic binding protein 0.0127 0.1662 0.5
Brugia malayi F/Y-rich N-terminus family protein 0.0013 0.0009 0.0026
Echinococcus multilocularis PHD finger protein rhinoceros 0.0035 0.0334 0.0334
Giardia lamblia PHD finger protein 15 0.0035 0.0334 1
Trypanosoma brucei DNA polymerase kappa, putative 0.0023 0.0161 0.0451
Trypanosoma cruzi peptidyl-prolyl cis-trans isomerase 0.0039 0.0394 0.1109
Trypanosoma brucei DNA polymerase kappa, putative 0.0023 0.0161 0.0451
Loa Loa (eye worm) jmjC domain-containing protein 0.0043 0.0441 0.1272
Trypanosoma cruzi DNA polymerase kappa, putative 0.0023 0.0161 0.0451
Trypanosoma brucei DNA polymerase kappa, putative 0.0023 0.0161 0.0451
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0043 0.0453 0.0453
Echinococcus granulosus glutamate receptor ionotropic kainate 0.0049 0.0541 0.0541
Brugia malayi ImpB/MucB/SamB family protein 0.0023 0.0161 0.0464
Mycobacterium tuberculosis Probable glutamine-binding lipoprotein GlnH (GLNBP) 0.0127 0.1662 1
Toxoplasma gondii PHD-finger domain-containing protein 0.0035 0.0334 0.8459
Brugia malayi N-terminal motif family protein 0.0218 0.2985 0.8606
Echinococcus granulosus citrate lyase subunit beta protein 0.003 0.0252 0.0252
Mycobacterium ulcerans hypothetical protein 0.003 0.0252 0.0607
Brugia malayi hypothetical protein 0.0025 0.0191 0.055
Schistosoma mansoni z-protein (S1r protein) 0.0034 0.0314 0.0369
Entamoeba histolytica deoxycytidyl transferase, putative 0.0023 0.0161 0.0077
Schistosoma mansoni regulator of G protein signaling 0.0023 0.0159 0.0186
Echinococcus granulosus A kinase anchor protein 10 mitochondrial 0.0023 0.0159 0.0159
Mycobacterium tuberculosis Conserved protein 0.003 0.0252 0.0607
Echinococcus multilocularis receptor type guanylyl cyclase 0.0025 0.0191 0.0191
Mycobacterium ulcerans hypothetical protein 0.003 0.0252 0.0607
Schistosoma mansoni hypothetical protein 0.0035 0.0334 0.0391
Schistosoma mansoni regulator of G protein signaling 17 19 20 (rgs17 19 20) 0.0023 0.0159 0.0186
Loa Loa (eye worm) RGC/RGC protein kinase 0.0025 0.0191 0.055
Echinococcus granulosus glutamate receptor 2 0.0025 0.0191 0.0191
Leishmania major DNA polymerase kappa, putative,DNA polymerase IV, putative 0.0023 0.0161 0.0451
Wolbachia endosymbiont of Brugia malayi parvulin-like peptidyl-prolyl isomerase, PPID 0.0012 0.0001 0.5
Schistosoma mansoni glutamate receptor NMDA 0.06 0.8529 1
Echinococcus multilocularis beta adrenergic receptor kinase 0.0023 0.0159 0.0159
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0043 0.0453 0.0453
Echinococcus multilocularis lysine specific demethylase 5A 0.0043 0.0441 0.0441
Echinococcus multilocularis nmda type glutamate receptor 0.0702 1 1
Mycobacterium tuberculosis Probable citrate (pro-3S)-lyase (beta subunit) CitE (citrase) (citratase) (citritase) (citridesmolase) (citrase aldolase) 0.003 0.0252 0.0607
Trypanosoma cruzi 2,4-dihydroxyhept-2-ene-1,7-dioic acid aldolase, putative 0.003 0.0252 0.0708
Echinococcus multilocularis Ribosomal protein S1, RNA binding domain 0.0049 0.0541 0.0541
Echinococcus multilocularis regulator of G protein signaling 3 0.0023 0.0159 0.0159
Entamoeba histolytica hypothetical protein 0.0043 0.0453 1
Echinococcus granulosus glutamate receptor 2 0.0075 0.0908 0.0908
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0036 0.0346 0.0406
Schistosoma mansoni ATP-binding cassette transporter 0.0049 0.0541 0.0634
Echinococcus granulosus lysine specific demethylase 5A 0.0043 0.0441 0.0441
Leishmania major hypothetical protein, conserved 0.0257 0.3549 1
Toxoplasma gondii PHD-finger domain-containing protein 0.0035 0.0334 0.8459
Schistosoma mansoni regulator of G protein signaling 0.0023 0.0159 0.0186
Loa Loa (eye worm) hypothetical protein 0.018 0.2439 0.7033
Loa Loa (eye worm) ImpB/MucB/SamB family protein 0.0023 0.0161 0.0464
Echinococcus granulosus terminal deoxycytidyl transferase rev1 0.0023 0.0161 0.0161
Echinococcus multilocularis citrate lyase subunit beta protein 0.003 0.0252 0.0252
Brugia malayi PXA domain containing protein 0.0023 0.0159 0.0458
Loa Loa (eye worm) hypothetical protein 0.018 0.2439 0.7033
Schistosoma mansoni metabotropic glutamate receptor 0.0025 0.0191 0.0224
Onchocerca volvulus Alhambra homolog 0.0035 0.0334 0.084
Schistosoma mansoni jumonji/arid domain-containing protein 0.0043 0.0441 0.0517
Trypanosoma brucei DNA polymerase IV, putative 0.0023 0.0161 0.0451
Echinococcus multilocularis regulator of G protein signaling 7 0.0034 0.0314 0.0314
Loa Loa (eye worm) hypothetical protein 0.0034 0.0314 0.0906
Trypanosoma cruzi hypothetical protein, conserved 0.0257 0.3549 1
Echinococcus granulosus 5'partial|histone lysine N methyltransferase SETDB2 0.0035 0.0327 0.0327
Loa Loa (eye worm) metabotropic GABA-B receptor subtype 2 0.0025 0.0191 0.055
Loa Loa (eye worm) hypothetical protein 0.0025 0.0191 0.055
Mycobacterium ulcerans citrate lyase beta subunit, CitE_2 0.003 0.0252 0.0607
Schistosoma mansoni terminal deoxycytidyl transferase 0.0023 0.0161 0.0189
Schistosoma mansoni DNA polymerase eta 0.0023 0.0161 0.0189
Echinococcus granulosus atrial natriuretic peptide receptor 0.0025 0.0191 0.0191
Brugia malayi Receptor family ligand binding region containing protein 0.0025 0.0191 0.055
Loa Loa (eye worm) hypothetical protein 0.0025 0.0191 0.055
Loa Loa (eye worm) AGC/GRK/GRK protein kinase 0.0023 0.0159 0.0458
Brugia malayi metabotropic glutamate receptor type 2 0.0025 0.0191 0.055
Echinococcus granulosus axis inhibition protein axin 0.0023 0.0159 0.0159
Loa Loa (eye worm) RGS-3 protein 0.0023 0.0159 0.0458
Brugia malayi hypothetical protein 0.0023 0.0159 0.0458
Echinococcus granulosus Glutamate receptor ionotropic kainate 2 0.0075 0.0908 0.0908
Schistosoma mansoni regulator of G protein signaling 0.0034 0.0314 0.0369
Brugia malayi Receptor family ligand binding region containing protein 0.0025 0.0191 0.055
Onchocerca volvulus 0.0036 0.0346 0.0871
Echinococcus multilocularis glutamate receptor 2 0.0049 0.0541 0.0541
Plasmodium vivax SET domain protein, putative 0.0036 0.0346 1
Echinococcus granulosus axis inhibition protein axin 0.0023 0.0159 0.0159
Schistosoma mansoni tyrosine kinase 0.0025 0.0191 0.0224
Echinococcus granulosus regulator of G protein signaling 3 0.0023 0.0159 0.0159
Loa Loa (eye worm) jmjC domain-containing protein 0.0073 0.0877 0.253
Echinococcus granulosus Regulator of G protein signaling 20 0.0023 0.0159 0.0159
Echinococcus granulosus nmda type glutamate receptor 0.0551 0.7811 0.7811
Trypanosoma cruzi peptidyl-prolyl cis-trans isomerase 0.0039 0.0394 0.1109
Echinococcus multilocularis atrial natriuretic peptide receptor 0.0025 0.0191 0.0191
Echinococcus granulosus regulator of G protein signaling 3 0.0023 0.0159 0.0159
Echinococcus granulosus Transcription factor JmjC domain containing protein 0.0115 0.1495 0.1495
Mycobacterium ulcerans glutamine-binding lipoprotein GlnH 0.0127 0.1662 1
Echinococcus multilocularis glutamate (NMDA) receptor subunit 0.0049 0.0541 0.0541
Brugia malayi Pin1-type peptidyl-prolyl cis-trans isomerase, BmPin1 0.004 0.0408 0.1176
Loa Loa (eye worm) hypothetical protein 0.0023 0.0159 0.0458
Echinococcus multilocularis regulator of G protein signaling 3 0.0023 0.0159 0.0159
Echinococcus multilocularis tyrosine kinase 0.0025 0.0191 0.0191
Echinococcus granulosus glutamate NMDA receptor subunit 0.0049 0.0541 0.0541
Trypanosoma brucei DNA polymerase kappa, putative 0.0023 0.0161 0.0451
Loa Loa (eye worm) PHD-finger family protein 0.0035 0.0334 0.0962
Echinococcus multilocularis NMDA receptor 0.0049 0.0541 0.0541
Brugia malayi Metabotropic glutamate receptor precursor. 0.0025 0.0191 0.055
Onchocerca volvulus Rap guanine nucleotide exchange factor 1 homolog 0.0218 0.2985 0.7515
Brugia malayi metabotropic GABA-B receptor subtype 2 0.0025 0.0191 0.055
Brugia malayi Guanylyl cyclase protein 23 0.0025 0.0191 0.055
Loa Loa (eye worm) AGC/GRK/BARK protein kinase 0.0023 0.0159 0.0458
Loa Loa (eye worm) receptor family ligand binding region containing protein 0.0025 0.0191 0.055
Onchocerca volvulus Atrial natriuretic peptide receptor 3 homolog 0.0025 0.0191 0.048
Trypanosoma brucei peptidyl-prolyl cis-trans isomerase/rotamase, putative 0.0039 0.0394 0.1109
Brugia malayi Probable G protein-coupled receptor kinase F19C6.1, putative 0.0023 0.0159 0.0458
Brugia malayi Bromodomain containing protein 0.0035 0.0334 0.0962
Plasmodium falciparum phd finger protein, putative 0.0035 0.0334 0.5
Chlamydia trachomatis glutamine binding protein 0.0127 0.1662 0.5
Echinococcus multilocularis axis inhibition protein axin 0.0023 0.0159 0.0159
Trypanosoma brucei DNA polymerase kappa, putative 0.0016 0.0056 0.0156
Leishmania major DNA polymerase kappa, putative 0.0023 0.0161 0.0451
Chlamydia trachomatis arginine ABC transporter substrate-binding protein ArtJ 0.0127 0.1662 0.5
Loa Loa (eye worm) hypothetical protein 0.0023 0.0159 0.0458
Trypanosoma brucei DNA polymerase kappa, putative 0.0023 0.0161 0.0451
Schistosoma mansoni hypothetical protein 0.0043 0.0453 0.0531
Brugia malayi Pre-SET motif family protein 0.0036 0.0346 0.0997
Echinococcus multilocularis Glutamate receptor, ionotropic kainate 2 0.0075 0.0908 0.0908
Loa Loa (eye worm) hypothetical protein 0.0023 0.0161 0.0464
Loa Loa (eye worm) RGC/RGC protein kinase 0.0025 0.0191 0.055
Onchocerca volvulus 0.0025 0.0191 0.048
Echinococcus multilocularis glutamate receptor 2 0.0025 0.0191 0.0191
Schistosoma mansoni glutamate receptor AMPA 0.0049 0.0541 0.0634
Leishmania major extracellular receptor, putative 0.0025 0.0191 0.0535
Schistosoma mansoni tyrosine kinase 0.0025 0.0191 0.0224
Loa Loa (eye worm) Pin1-type peptidyl-prolyl cis-trans isomerase 0.004 0.0408 0.1176
Schistosoma mansoni regulator of G protein signaling 0.0023 0.0159 0.0186
Echinococcus granulosus Glutamate receptor ionotropic kainate 2 0.0075 0.0908 0.0908
Loa Loa (eye worm) hypothetical protein 0.0035 0.0334 0.0962
Entamoeba histolytica hypothetical protein 0.0043 0.0453 1
Loa Loa (eye worm) glutamate receptor 0.0025 0.0191 0.055
Echinococcus granulosus glutamate receptor NMDA 0.0525 0.7443 0.7443
Loa Loa (eye worm) G protein signaling regulator EGL-10 0.0034 0.0314 0.0906
Echinococcus multilocularis nmda type glutamate receptor 0.0551 0.7811 0.7811
Trichomonas vaginalis DNA polymerase IV / kappa, putative 0.0023 0.0161 0.0006
Echinococcus multilocularis muscleblind protein 0.018 0.2439 0.2439
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0036 0.0346 0.0406
Echinococcus multilocularis Glutamate receptor, ionotropic kainate 3 0.0176 0.238 0.238
Echinococcus multilocularis glutamate receptor 2 0.0075 0.0908 0.0908
Schistosoma mansoni regulator of G protein signaling 0.0023 0.0159 0.0186
Trichomonas vaginalis rotamase, putative 0.004 0.0408 0.0654
Echinococcus multilocularis Glutamate receptor, ionotropic kainate 2 0.0075 0.0908 0.0908
Schistosoma mansoni metabotropic glutamate receptor 0.0025 0.0191 0.0224
Echinococcus granulosus PHD finger protein rhinoceros 0.0035 0.0334 0.0334
Echinococcus multilocularis peregrin 0.0035 0.0334 0.0334
Brugia malayi regulator of G-protein signaling rgs-7 0.0023 0.0159 0.0458
Loa Loa (eye worm) pre-SET domain-containing protein family protein 0.0251 0.3468 1
Echinococcus granulosus muscleblind protein 0.018 0.2439 0.2439
Brugia malayi Regulator of G protein signaling domain containing protein 0.0023 0.0159 0.0458
Echinococcus multilocularis Regulator of G protein signaling 20 0.0023 0.0159 0.0159
Leishmania major 2,4-dihydroxyhept-2-ene-1,7-dioic acid aldolase, putative 0.003 0.0252 0.0708
Schistosoma mansoni rab geranylgeranyl transferase alpha subunit 0.0023 0.0161 0.0189
Entamoeba histolytica hypothetical protein 0.0025 0.0191 0.1091

Activities

Activity type Activity value Assay description Source Reference
Potency (functional) 1.4125 uM PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Histone Lysine Methyltransferase G9a. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID504404] ChEMBL. No reference
Potency (functional) 3.5481 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) = 7.0795 um PUBCHEM_BIOASSAY: qHTS for inhibitors of ROR gamma transcriptional activity. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 7.9433 uM PubChem BioAssay. qHTS of Trypanosoma Brucei Inhibitors. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) = 10 um PUBCHEM_BIOASSAY: VP16 counterscreen qHTS for inhibitors of ROR gamma transcriptional activity. (Class of assay: confirmatory) ChEMBL. No reference
Potency (binding) 10 uM PubChem BioAssay. qHTS Assay for Inhibitors of MBNL1-poly(CUG) RNA binding. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 10 uM PubChem BioAssay. qHTS for Antagonist of cAMP-regulated guanine nucleotide exchange factor 3 (EPAC1): primary screen. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 11.2202 uM PUBCHEM_BIOASSAY: qHTS for Inhibitors of Polymerase Iota. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID588623] ChEMBL. No reference
Potency (functional) 12.5893 uM PubChem BioAssay. qHTS of Nrf2 Activators. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) = 14.1254 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) 16.9441 uM PubChem BioAssay. qHTS Assay to Find Inhibitors of Pin1. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 19.9526 uM PUBCHEM_BIOASSAY: Inhibitors of Regulator of G Protein Signaling (RGS) 4: qHTS. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID504856] ChEMBL. No reference
Potency (functional) = 25.1189 um PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors Targeting the Menin-MLL Interaction in MLL Related Leukemias: Competition With Fluorescein Labeled MLL-derived Peptide. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) = 25.1189 um PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors Targeting the Menin-MLL Interaction in MLL Related Leukemias: Competition With Texas Red Labeled MLL-derived Mutant Peptide. (Class of assay: confirmatory) ChEMBL. No reference
Potency (binding) = 28.1838 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) 28.1838 uM PUBCHEM_BIOASSAY: qHTS for Inhibitors of Polymerase Eta. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID588636] ChEMBL. No reference
Potency (functional) = 35.4813 um PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of DNA Polymerase Beta. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 35.4813 uM PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Mammalian Selenoprotein Thioredoxin Reductase 1 (TrxR1): qHTS. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488771] ChEMBL. No reference
Potency (functional) 35.4813 uM PubChem BioAssay. qHTS for Inhibitors of WRN Helicase. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) = 56.2341 um PUBCHEM_BIOASSAY: qHTS Assay for the Inhibitors of Schistosoma Mansoni Peroxiredoxins. (Class of assay: confirmatory) [Related pubchem assays: 1011 (Confirmation Concentration-Response Assay for Inhibitors of the Schistosoma mansoni Redox Cascade ), 448 (Schistosoma Mansoni Peroxiredoxins (Prx2) and thioredoxin glutathione reductase (TGR) coupled assay)] ChEMBL. No reference
Potency (functional) 56.2341 uM PUBCHEM_BIOASSAY: HTS for Inhibitors of HP1-beta Chromodomain Interactions with Methylated Histone Tails. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488962] ChEMBL. No reference
Potency (functional) 79.4328 uM PUBCHEM_BIOASSAY: qHTS for Inhibitors of Polymerase Kappa. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID588638] ChEMBL. No reference
Potency (functional) 84.9214 uM PubChem BioAssay. qHTS for Inhibitors of Polymerase Eta: Confirmatory Assay for Cherry-picked Compounds. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 89.1251 uM PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of BAZ2B. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID504391] 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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