Detailed information for compound 1556501

Basic information

Technical information
  • TDR Targets ID: 1556501
  • Name: 4-ethyl-8-methoxy-2H-[1,2,4]triazino[4,5-a]in dol-1-one
  • MW: 243.261 | Formula: C13H13N3O2
  • H donors: 1 H acceptors: 3 LogP: 2.14 Rotable bonds: 2
    Rule of 5 violations (Lipinski): 1
  • SMILES: COc1ccc2c(c1)cc1n2c(CC)nnc1O
  • InChi: 1S/C13H13N3O2/c1-3-12-14-15-13(17)11-7-8-6-9(18-2)4-5-10(8)16(11)12/h4-7H,3H2,1-2H3,(H,15,17)
  • InChiKey: BAFRCOLHBOVZQY-UHFFFAOYSA-N  


Substructure search Similarity search

Network

Hover on a compound node to display the structore

Synonyms

No synonyms found for this compound

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens glucagon-like peptide 1 receptor Starlite/ChEMBL No references
Homo sapiens nuclear factor, erythroid 2-like 2 Starlite/ChEMBL No references
Homo sapiens geminin, DNA replication inhibitor Starlite/ChEMBL No references

Predicted pathogen targets for this compound

By orthology
No druggable targets predicted by orthology data
By sequence similarity to non orthologous known druggable targets
Species Potential target Known druggable target Length Alignment span Identity
Brugia malayi Hypothetical 65.5 kDa Trp-Asp repeats containing protein F02E8.5 inchromosome X geminin, DNA replication inhibitor 209 aa 176 aa 27.8 %
Loa Loa (eye worm) pigment dispersing factor receptor c glucagon-like peptide 1 receptor 463 aa 388 aa 25.8 %
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Schistosoma mansoni photoreceptor-specific nuclear receptor related 0.0033 0.0678 0.0829
Toxoplasma gondii histone lysine methyltransferase SET/SUV39 0.0033 0.0693 0.2914
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0033 0.0678 0.0779
Plasmodium falciparum AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.0021 0.0209 0.3098
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.0035 0.0756 0.0869
Schistosoma mansoni hypothetical protein 0.0035 0.0756 0.0932
Echinococcus granulosus histone lysine methyltransferase setb 0.0033 0.0693 0.0847
Loa Loa (eye worm) nuclear hormone receptor family member nhr-14 0.0033 0.0678 0.0779
Loa Loa (eye worm) hypothetical protein 0.0017 0.0052 0.006
Loa Loa (eye worm) hypothetical protein 0.0024 0.0334 0.0384
Brugia malayi Nuclear hormone receptor family member nhr-31 0.0033 0.0678 0.0779
Brugia malayi hypothetical protein 0.0028 0.0484 0.0556
Brugia malayi Nuclear hormone receptor family member nhr-41 0.0033 0.0678 0.0779
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0033 0.0678 0.0779
Schistosoma mansoni tar DNA-binding protein 0.0066 0.2022 0.2606
Loa Loa (eye worm) hypothetical protein 0.0028 0.0484 0.0556
Mycobacterium tuberculosis Fatty-acid-AMP ligase FadD30 (fatty-acid-AMP synthetase) (fatty-acid-AMP synthase) 0.0018 0.0085 0.022
Loa Loa (eye worm) latrophilin receptor protein 2 0.0035 0.0756 0.0869
Echinococcus multilocularis COUP TF:Svp nuclear hormone receptor 0.0033 0.0678 0.0829
Loa Loa (eye worm) nuclear hormone receptor family member nhr-49 0.0033 0.0678 0.0779
Brugia malayi hypothetical protein 0.0017 0.0052 0.006
Toxoplasma gondii LsmAD domain-containing protein 0.0028 0.0484 0.1656
Entamoeba histolytica acyl-CoA synthetase, putative 0.0024 0.0334 0.1398
Brugia malayi RNA recognition motif domain containing protein 0.0066 0.2022 0.2323
Trichomonas vaginalis set domain proteins, putative 0.0264 1 1
Brugia malayi nuclear receptor NHR-88 0.0033 0.0678 0.0779
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0033 0.0678 0.0779
Mycobacterium leprae PROBABLE FATTY-ACID-CoA LIGASE FADD2 (FATTY-ACID-CoA SYNTHETASE) (FATTY-ACID-CoA SYNTHASE) 0.0024 0.0334 0.5
Loa Loa (eye worm) hypothetical protein 0.0017 0.0052 0.006
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.011 0.3793 0.4357
Echinococcus multilocularis tar DNA binding protein 0.0066 0.2022 0.2606
Mycobacterium ulcerans aldehyde dehydrogenase 0.0062 0.1869 1
Loa Loa (eye worm) hypothetical protein 0.0033 0.0678 0.0779
Mycobacterium ulcerans fatty-acid-CoA ligase 0.0024 0.0334 0.1394
Loa Loa (eye worm) nuclear hormone receptor-like 1 0.0017 0.0052 0.006
Brugia malayi photoreceptor-specific nuclear receptor 0.0033 0.0678 0.0779
Brugia malayi Nuclear hormone receptor-like 1 0.0033 0.0678 0.0779
Schistosoma mansoni Tr4/Tr2 (homologue) 0.0033 0.0678 0.0829
Echinococcus granulosus hepatocyte nuclear factor 4 alpha 0.0033 0.0678 0.0829
Treponema pallidum exodeoxyribonuclease (exoA) 0.0021 0.0209 0.5
Brugia malayi Nuclear hormone receptor family member nhr-3 0.0033 0.0678 0.0779
Brugia malayi Nuclear hormone receptor-like 1 0.0017 0.0052 0.006
Loa Loa (eye worm) hypothetical protein 0.0033 0.0678 0.0779
Brugia malayi intermediate filament protein 0.003 0.0563 0.0646
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0033 0.0678 0.0779
Loa Loa (eye worm) TAR-binding protein 0.0066 0.2022 0.2323
Mycobacterium ulcerans acyl-CoA synthetase 0.0024 0.0334 0.1394
Toxoplasma gondii aldehyde dehydrogenase 0.0062 0.1869 1
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD2 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0024 0.0334 0.1583
Loa Loa (eye worm) hypothetical protein 0.011 0.3793 0.4357
Echinococcus multilocularis lamin dm0 0.003 0.0563 0.0676
Schistosoma mansoni retinoid-x-receptor (RXR) 0.0033 0.0678 0.0829
Mycobacterium ulcerans acyl-CoA synthetase 0.0024 0.0334 0.1394
Entamoeba histolytica acyl-coA synthetase, putative 0.0024 0.0334 0.1398
Echinococcus granulosus tar DNA binding protein 0.0066 0.2022 0.2606
Loa Loa (eye worm) nuclear hormone receptor family member nhr-40 0.0033 0.0678 0.0779
Loa Loa (eye worm) hypothetical protein 0.0033 0.0678 0.0779
Loa Loa (eye worm) hypothetical protein 0.0033 0.0678 0.0779
Brugia malayi Intermediate filament tail domain containing protein 0.003 0.0563 0.0646
Brugia malayi ecdysteroid receptor 0.0033 0.0678 0.0779
Onchocerca volvulus Huntingtin homolog 0.0127 0.4461 0.4269
Mycobacterium ulcerans hypothetical protein 0.0024 0.0334 0.1394
Echinococcus granulosus geminin 0.0205 0.7612 1
Loa Loa (eye worm) hypothetical protein 0.0033 0.0678 0.0779
Brugia malayi hypothetical protein 0.0018 0.0082 0.0094
Onchocerca volvulus Protein ultraspiracle homolog 0.0033 0.0678 0.0356
Mycobacterium tuberculosis Probable chain -fatty-acid-CoA ligase FadD13 (fatty-acyl-CoA synthetase) 0.0024 0.0334 0.1583
Schistosoma mansoni coup transcription factor 0.0033 0.0678 0.0829
Schistosoma mansoni ap endonuclease 0.0021 0.0209 0.0207
Schistosoma mansoni transcription factor LCR-F1 0.0043 0.1105 0.1392
Entamoeba histolytica hypothetical protein 0.0043 0.1105 1
Brugia malayi AMP-binding enzyme family protein 0.0024 0.0334 0.0384
Schistosoma mansoni hypothetical protein 0.0075 0.2388 0.309
Echinococcus multilocularis musashi 0.003 0.0563 0.0676
Loa Loa (eye worm) hypothetical protein 0.0017 0.0052 0.006
Leishmania major 4-coumarate:coa ligase-like protein 0.0024 0.0334 0.0754
Loa Loa (eye worm) hypothetical protein 0.0075 0.2388 0.2742
Loa Loa (eye worm) hypothetical protein 0.0017 0.0052 0.006
Echinococcus multilocularis lamin 0.003 0.0563 0.0676
Loa Loa (eye worm) nuclear hormone receptor family member nhr-41 0.0033 0.0678 0.0779
Echinococcus multilocularis histone lysine N methyltransferase SETMAR 0.0033 0.0693 0.0847
Brugia malayi AMP-binding enzyme family protein 0.0024 0.0334 0.0384
Loa Loa (eye worm) RNA binding protein 0.0066 0.2022 0.2323
Echinococcus multilocularis Mitotic checkpoint protein PRCC, C terminal 0.014 0.501 0.6559
Echinococcus multilocularis FTZ F1 alpha 0.0033 0.0678 0.0829
Loa Loa (eye worm) hypothetical protein 0.0033 0.0678 0.0779
Entamoeba histolytica hypothetical protein 0.0043 0.1105 1
Loa Loa (eye worm) intermediate filament protein 0.003 0.0563 0.0646
Loa Loa (eye worm) hypothetical protein 0.0035 0.0756 0.0869
Trypanosoma brucei PAB1-binding protein , putative 0.0028 0.0484 1
Loa Loa (eye worm) hypothetical protein 0.0029 0.0541 0.0621
Echinococcus granulosus GPCR family 2 0.0035 0.0756 0.0932
Loa Loa (eye worm) pre-SET domain-containing protein family protein 0.0232 0.8707 1
Trypanosoma cruzi PAB1-binding protein , putative 0.0028 0.0484 1
Brugia malayi Nuclear hormone receptor family member nhr-1 0.0033 0.0678 0.0779
Leishmania major 4-coumarate:coa ligase-like protein 0.0024 0.0334 0.0754
Schistosoma mansoni aldehyde dehydrogenase 0.0062 0.1869 0.2404
Plasmodium vivax ataxin-2 like protein, putative 0.0028 0.0484 0.6561
Echinococcus granulosus lamin 0.003 0.0563 0.0676
Loa Loa (eye worm) hypothetical protein 0.0127 0.4461 0.5123
Schistosoma mansoni intermediate filament proteins 0.003 0.0563 0.0676
Plasmodium falciparum ataxin-2 like protein, putative 0.0028 0.0484 1
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0033 0.0678 0.0779
Schistosoma mansoni hypothetical protein 0.0035 0.0756 0.0932
Schistosoma mansoni hypothetical protein 0.0035 0.0756 0.0932
Echinococcus granulosus Nuclear hormone receptor family member nhr 41 0.0033 0.0678 0.0829
Echinococcus granulosus ecdysone induced protein 78C 0.0033 0.0678 0.0829
Brugia malayi TAR-binding protein 0.0066 0.2022 0.2323
Brugia malayi Pre-SET motif family protein 0.0033 0.0693 0.0795
Echinococcus granulosus COUP TF:Svp nuclear hormone receptor 0.0033 0.0678 0.0829
Brugia malayi steroid hormone receptor 0.0033 0.0678 0.0779
Schistosoma mansoni nuclear hormone receptor 0.0033 0.0678 0.0829
Brugia malayi hypothetical protein 0.0127 0.4461 0.5123
Schistosoma mansoni hypothetical protein 0.0205 0.7612 1
Schistosoma mansoni tar DNA-binding protein 0.0066 0.2022 0.2606
Mycobacterium tuberculosis Probable aldehyde dehydrogenase 0.0062 0.1869 1
Schistosoma mansoni tar DNA-binding protein 0.0066 0.2022 0.2606
Loa Loa (eye worm) hypothetical protein 0.003 0.0563 0.0646
Brugia malayi Nuclear hormone receptor family member nhr-40 0.0033 0.0678 0.0779
Schistosoma mansoni hypothetical protein 0.014 0.501 0.6559
Leishmania major 4-coumarate:coa ligase-like protein 0.0024 0.0334 0.0754
Loa Loa (eye worm) hypothetical protein 0.0018 0.0085 0.0098
Loa Loa (eye worm) steroid hormone receptor 0.0033 0.0678 0.0779
Schistosoma mansoni ap endonuclease 0.0021 0.0209 0.0207
Echinococcus granulosus retinoic acid receptor rxr beta a 0.0033 0.0678 0.0829
Loa Loa (eye worm) exodeoxyribonuclease III family protein 0.0021 0.0209 0.024
Mycobacterium ulcerans long-chain-fatty-acid--CoA ligase 0.0024 0.0334 0.1394
Schistosoma mansoni RAR-like nuclear receptor 0.0033 0.0678 0.0829
Mycobacterium ulcerans long-chain-fatty-acid-CoA ligase 0.0024 0.0334 0.1394
Echinococcus multilocularis ecdysone induced protein 78C 0.0033 0.0678 0.0829
Schistosoma mansoni thyroid hormone receptor 0.0173 0.6338 0.8316
Echinococcus granulosus 5'partial|histone lysine N methyltransferase SETDB2 0.0032 0.0643 0.0782
Plasmodium vivax SET domain protein, putative 0.0033 0.0693 1
Onchocerca volvulus 0.003 0.0563 0.0237
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.0066 0.2022 0.2323
Mycobacterium leprae PROBABLE FATTY-ACID-CoA LIGASE FADD7 (FATTY-ACID-CoA SYNTHETASE) (FATTY-ACID-CoA SYNTHASE) 0.0024 0.0334 0.5
Brugia malayi hypothetical protein 0.0043 0.1105 0.1268
Plasmodium vivax AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.0021 0.0209 0.2033
Echinococcus multilocularis thyroid hormone receptor alpha 0.0173 0.6338 0.8316
Echinococcus multilocularis geminin 0.0205 0.7612 1
Mycobacterium ulcerans aldehyde dehydrogenase 0.0062 0.1869 1
Brugia malayi Nuclear hormone receptor-like 1 0.0017 0.0052 0.006
Echinococcus multilocularis FTZ F1 nuclear receptor protein 0.0033 0.0678 0.0829
Loa Loa (eye worm) hypothetical protein 0.0033 0.0678 0.0779
Echinococcus granulosus FTZ F1 alpha 0.0033 0.0678 0.0829
Echinococcus multilocularis histone lysine methyltransferase setb histone lysine methyltransferase eggless 0.0033 0.0693 0.0847
Loa Loa (eye worm) hypothetical protein 0.0018 0.0085 0.0098
Brugia malayi Latrophilin receptor protein 2 0.0035 0.0756 0.0869
Echinococcus granulosus aldehyde dehydrogenase mitochondrial 0.0062 0.1869 0.2404
Loa Loa (eye worm) hypothetical protein 0.0033 0.0693 0.0795
Schistosoma mansoni aldehyde dehydrogenase 0.0062 0.1869 0.2404
Loa Loa (eye worm) hypothetical protein 0.0017 0.0052 0.006
Echinococcus multilocularis cadherin EGF LAG seven pass G type receptor 0.0035 0.0756 0.0932
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0033 0.0693 0.0847
Echinococcus granulosus FTZ F1 nuclear receptor protein 0.0033 0.0678 0.0829
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0033 0.0678 0.0829
Loa Loa (eye worm) hypothetical protein 0.0024 0.0334 0.0384
Entamoeba histolytica hypothetical protein 0.0043 0.1105 1
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0043 0.1105 0.1392
Trypanosoma cruzi PAB1-binding protein , putative 0.0028 0.0484 1
Leishmania major aldehyde dehydrogenase, mitochondrial precursor 0.0062 0.1869 1
Brugia malayi Steroid receptor seven-up type 2 0.0033 0.0678 0.0779
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0033 0.0693 0.0847
Onchocerca volvulus Steroid hormone receptor family member cnr14 homolog 0.0033 0.0678 0.0356
Echinococcus multilocularis hepatocyte nuclear factor 4 alpha 0.0033 0.0678 0.0829
Schistosoma mansoni tar DNA-binding protein 0.0066 0.2022 0.2606
Loa Loa (eye worm) hypothetical protein 0.0018 0.0085 0.0098
Schistosoma mansoni lamin 0.003 0.0563 0.0676
Brugia malayi Nuclear hormone receptor family member nhr-49 0.0033 0.0678 0.0779
Echinococcus granulosus cadherin EGF LAG seven pass G type receptor 0.0035 0.0756 0.0932
Onchocerca volvulus 0.0033 0.0678 0.0356
Leishmania major hypothetical protein, conserved 0.0028 0.0484 0.1656
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0033 0.0678 0.0779
Plasmodium falciparum ataxin-2 like protein, putative 0.0028 0.0484 1
Mycobacterium ulcerans exodeoxyribonuclease III protein XthA 0.0021 0.0209 0.0692
Loa Loa (eye worm) nuclear Hormone Receptor family member 0.0033 0.0678 0.0779
Schistosoma mansoni retinoic acid receptor RXR 0.0033 0.0678 0.0829
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0033 0.0693 0.0847
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0033 0.0678 0.0829
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0033 0.0678 0.0829
Loa Loa (eye worm) hypothetical protein 0.0018 0.0085 0.0098
Mycobacterium tuberculosis Probable exodeoxyribonuclease III protein XthA (exonuclease III) (EXO III) (AP endonuclease VI) 0.0021 0.0209 0.0897
Schistosoma mansoni lamin 0.003 0.0563 0.0676
Loa Loa (eye worm) hypothetical protein 0.0127 0.4461 0.5123
Loa Loa (eye worm) nuclear hormone receptor family member nhr-1 0.0033 0.0678 0.0779
Onchocerca volvulus 0.0033 0.0693 0.0371
Echinococcus multilocularis aldehyde dehydrogenase, mitochondrial 0.0062 0.1869 0.2404
Brugia malayi Nuclear hormone receptor family member nhr-14 0.0033 0.0678 0.0779
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.0035 0.0756 0.0932
Mycobacterium ulcerans acyl-CoA synthetase 0.0024 0.0334 0.1394
Loa Loa (eye worm) hypothetical protein 0.0024 0.0334 0.0384
Schistosoma mansoni nuclear hormone receptor nor-1/nor-2 0.0033 0.0678 0.0829
Mycobacterium ulcerans long-chain fatty-acid CoA ligase 0.0024 0.0334 0.1394
Onchocerca volvulus Huntingtin homolog 0.0127 0.4461 0.4269
Loa Loa (eye worm) nuclear hormone receptor family member nhr-31 0.0033 0.0678 0.0779
Schistosoma mansoni nuclear receptor 2DBD-gamma 0.0033 0.0678 0.0829
Loa Loa (eye worm) hypothetical protein 0.0018 0.0085 0.0098
Echinococcus multilocularis GPCR, family 2 0.0035 0.0756 0.0932
Brugia malayi Pre-SET motif family protein 0.0232 0.8707 1
Echinococcus multilocularis DNA (apurinic or apyrimidinic site) lyase 0.0021 0.0209 0.0207
Schistosoma mansoni hypothetical protein 0.0043 0.1105 0.1392
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0033 0.0678 0.0829
Echinococcus granulosus DNA apurinic or apyrimidinic site lyase 0.0021 0.0209 0.0207
Schistosoma mansoni FTZ-F1 nuclear receptor-like protein 0.0033 0.0678 0.0829
Loa Loa (eye worm) intermediate filament tail domain-containing protein 0.003 0.0563 0.0646
Entamoeba histolytica hypothetical protein 0.0043 0.1105 1
Brugia malayi Calcitonin receptor-like protein seb-1 0.011 0.3793 0.4357
Schistosoma mansoni hypothetical protein 0.0205 0.7612 1
Brugia malayi RNA binding protein 0.0066 0.2022 0.2323
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.0035 0.0756 0.0932
Schistosoma mansoni hypothetical protein 0.0035 0.0756 0.0932
Giardia lamblia Endonuclease/Exonuclease/phosphatase 0.0021 0.0209 0.5
Entamoeba histolytica acyl-CoA synthetase, putative 0.0024 0.0334 0.1398
Echinococcus multilocularis Nuclear hormone receptor family member nhr 41 0.0033 0.0678 0.0829
Schistosoma mansoni thyroid hormone receptor 0.0173 0.6338 0.8316
Loa Loa (eye worm) pigment dispersing factor receptor c 0.011 0.3793 0.4357
Schistosoma mansoni histone-lysine n-methyltransferase suv9 0.0033 0.0693 0.0847
Onchocerca volvulus Bile acid receptor homolog 0.0033 0.0678 0.0356
Loa Loa (eye worm) hypothetical protein 0.0033 0.0678 0.0779
Echinococcus granulosus Mitotic checkpoint protein PRCC C terminal 0.014 0.501 0.6559
Brugia malayi AMP-binding enzyme family protein 0.0024 0.0334 0.0384
Schistosoma mansoni steroid hormone receptor ad4bp 0.0033 0.0678 0.0829
Onchocerca volvulus 0.003 0.0563 0.0237
Echinococcus granulosus intermediate filament protein 0.003 0.0563 0.0676
Brugia malayi hypothetical protein 0.0017 0.0052 0.006
Chlamydia trachomatis acylglycerophosphoethanolamine acyltransferase 0.0018 0.0085 0.5
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0043 0.1105 0.1392
Brugia malayi exodeoxyribonuclease III family protein 0.0021 0.0209 0.024
Mycobacterium ulcerans aldehyde dehydrogenase 0.0062 0.1869 1
Brugia malayi nuclear hormone receptor 0.0033 0.0678 0.0779
Wolbachia endosymbiont of Brugia malayi exonuclease III 0.0021 0.0209 0.5
Echinococcus granulosus lamin dm0 0.003 0.0563 0.0676
Schistosoma mansoni tar DNA-binding protein 0.0066 0.2022 0.2606
Brugia malayi nuclear receptor RXR 0.0017 0.0052 0.006
Brugia malayi latrophilin 2 splice variant baaae 0.0075 0.2388 0.2742

Activities

Activity type Activity value Assay description Source Reference
Potency (functional) 2.8184 uM PubChem BioAssay. qHTS of GLP-1 Receptor Inverse Agonists (Inhibition Mode). (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 12.5893 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) 18.3564 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) 23.0999 uM PUBCHEM_BIOASSAY: qHTS screen for small molecules that induce genotoxicity in human embryonic kidney (HEK293T) cells expressing luciferase-tagged ELG1. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID493106, AID493143] ChEMBL. No reference
Potency (functional) 37.933 uM PUBCHEM_BIOASSAY: qHTS profiling assay for firefly luciferase inhibitor/activator using purified enzyme and Km concentrations of substrates (counterscreen for miR-21 project). (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID2288, AID2289, AID2598, AID411] ChEMBL. No reference
Potency (functional) 89.1251 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

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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