Detailed information for compound 1454771

Basic information

Technical information
  • TDR Targets ID: 1454771
  • Name: N-(2-piperidin-1-ylphenyl)-[1,2,4]triazolo[3, 4-c]quinoxalin-4-amine
  • MW: 344.413 | Formula: C20H20N6
  • H donors: 1 H acceptors: 3 LogP: 4.37 Rotable bonds: 3
    Rule of 5 violations (Lipinski): 1
  • SMILES: C1CCN(CC1)c1ccccc1Nc1nc2ccccc2n2c1nnc2
  • InChi: 1S/C20H20N6/c1-6-12-25(13-7-1)17-10-4-2-8-15(17)22-19-20-24-21-14-26(20)18-11-5-3-9-16(18)23-19/h2-5,8-11,14H,1,6-7,12-13H2,(H,22,23)
  • InChiKey: JNTZDXUUXYAWMU-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • N-[2-(1-piperidyl)phenyl]-[1,2,4]triazolo[3,4-c]quinoxalin-4-amine
  • (2-piperidinophenyl)-([1,2,4]triazolo[3,4-c]quinoxalin-4-yl)amine
  • MLS000731580
  • N-(2-piperidin-1-ylphenyl)[1,2,4]triazolo[4,3-a]quinoxalin-4-amine
  • SMR000309855

Targets

Known targets for this compound

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

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Trichomonas vaginalis glucosylceramidase, putative Get druggable targets OG5_129423 All targets in OG5_129423
Trichomonas vaginalis glucosylceramidase, putative Get druggable targets OG5_129423 All targets in OG5_129423
Trichomonas vaginalis glucosylceramidase, putative Get druggable targets OG5_129423 All targets in OG5_129423
Trichomonas vaginalis glucosylceramidase, putative Get druggable targets OG5_129423 All targets in OG5_129423
Trichomonas vaginalis glucosylceramidase, putative Get druggable targets OG5_129423 All targets in OG5_129423
Trichomonas vaginalis glucosylceramidase, putative Get druggable targets OG5_129423 All targets in OG5_129423
Brugia malayi O-Glycosyl hydrolase family 30 protein Get druggable targets OG5_129423 All targets in OG5_129423
Onchocerca volvulus Glucosylceramidase homolog Get druggable targets OG5_129423 All targets in OG5_129423
Trichomonas vaginalis glucosylceramidase, putative Get druggable targets OG5_129423 All targets in OG5_129423
Loa Loa (eye worm) O-glycosyl hydrolase family 30 protein Get druggable targets OG5_129423 All targets in OG5_129423
Trichomonas vaginalis glucosylceramidase, putative Get druggable targets OG5_129423 All targets in OG5_129423
Trichomonas vaginalis glucosylceramidase, putative Get druggable targets OG5_129423 All targets in OG5_129423
Trichomonas vaginalis glucosylceramidase, putative Get druggable targets OG5_129423 All targets in OG5_129423
Trichomonas vaginalis glucosylceramidase, putative Get druggable targets OG5_129423 All targets in OG5_129423
Trichomonas vaginalis glucosylceramidase, putative Get druggable targets OG5_129423 All targets in OG5_129423
Trichomonas vaginalis glucosylceramidase, putative Get druggable targets OG5_129423 All targets in OG5_129423
Trichomonas vaginalis glucosylceramidase, putative Get druggable targets OG5_129423 All targets in OG5_129423
Trichomonas vaginalis glucosylceramidase, putative Get druggable targets OG5_129423 All targets in OG5_129423
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 hypothetical protein 0.0084 0.0277 0.0411
Brugia malayi Nuclear hormone receptor family member nhr-49 0.0063 0.0132 0.0132
Echinococcus multilocularis Ataxin 2, N terminal,domain containing protein 0.0084 0.0277 0.0656
Echinococcus granulosus smad 0.0101 0.0393 0.0931
Schistosoma mansoni NADP-specific isocitrate dehydrogenase 0.0329 0.1957 0.2903
Plasmodium falciparum ataxin-2 like protein, putative 0.0187 0.0983 0.4365
Echinococcus multilocularis GPCR, family 2 0.0476 0.2961 0.7018
Brugia malayi Isocitrate dehydrogenase 0.0329 0.1957 0.1957
Echinococcus granulosus COUP TF:Svp nuclear hormone receptor 0.0531 0.3335 0.7906
Schistosoma mansoni peptidase Clp (S14 family) 0.0077 0.0228 0.0339
Toxoplasma gondii isocitrate dehydrogenase 0.0329 0.1957 1
Wolbachia endosymbiont of Brugia malayi ATP-dependent Clp protease proteolytic subunit 0.0077 0.0228 0.5
Trypanosoma brucei isocitrate dehydrogenase, putative 0.0329 0.1957 1
Echinococcus granulosus tyrosine protein kinase ABL1 0.066 0.4219 1
Brugia malayi TAR-binding protein 0.0517 0.3242 0.3242
Chlamydia trachomatis ATP-dependent Clp protease proteolytic subunit 0.0077 0.0228 0.5
Loa Loa (eye worm) RNA binding protein 0.0517 0.3242 0.3235
Loa Loa (eye worm) steroid hormone receptor 0.0063 0.0132 0.0121
Brugia malayi Calcitonin receptor-like protein seb-1 0.1504 1 1
Echinococcus multilocularis hepatocyte nuclear factor 4 alpha 0.0063 0.0132 0.0313
Schistosoma mansoni tar DNA-binding protein 0.0517 0.3242 0.4809
Echinococcus multilocularis mothers against decapentaplegic 2 0.0045 0.0011 0.0026
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0063 0.0132 0.0313
Brugia malayi Nuclear hormone receptor family member nhr-40 0.0063 0.0132 0.0132
Onchocerca volvulus Bile acid receptor homolog 0.0063 0.0132 0.1106
Echinococcus multilocularis COUP TF:Svp nuclear hormone receptor 0.0531 0.3335 0.7906
Echinococcus granulosus retinoic acid receptor rxr beta a 0.0063 0.0132 0.0313
Loa Loa (eye worm) O-glycosyl hydrolase family 30 protein 0.0312 0.1838 0.1828
Brugia malayi latrophilin 2 splice variant baaae 0.1028 0.6742 0.6742
Brugia malayi ecdysteroid receptor 0.0063 0.0132 0.0132
Trichomonas vaginalis glucosylceramidase, putative 0.0312 0.1838 1
Schistosoma mansoni hypothetical protein 0.0205 0.1103 0.1637
Loa Loa (eye worm) nuclear hormone receptor family member nhr-49 0.0063 0.0132 0.0121
Brugia malayi MH1 domain containing protein 0.0101 0.0393 0.0393
Trichomonas vaginalis glucosylceramidase, putative 0.0312 0.1838 1
Schistosoma mansoni glycosyltransferase-related 0.0073 0.0202 0.03
Echinococcus multilocularis geminin 0.0205 0.1103 0.2616
Loa Loa (eye worm) TAR-binding protein 0.0517 0.3242 0.3235
Echinococcus multilocularis tar DNA binding protein 0.0517 0.3242 0.7686
Echinococcus multilocularis Nuclear hormone receptor family member nhr 41 0.0063 0.0132 0.0313
Brugia malayi hypothetical protein 0.0121 0.0529 0.0529
Onchocerca volvulus Protein ultraspiracle homolog 0.0063 0.0132 0.1106
Loa Loa (eye worm) isocitrate dehydrogenase 0.0329 0.1957 0.1948
Echinococcus granulosus geminin 0.0205 0.1103 0.2616
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0063 0.0132 0.0132
Loa Loa (eye worm) glycosyl transferase family 8 protein 0.0073 0.0202 0.0191
Plasmodium vivax isocitrate dehydrogenase [NADP], mitochondrial, putative 0.0329 0.1957 1
Schistosoma mansoni steroid hormone receptor ad4bp 0.0063 0.0132 0.0196
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.0517 0.3242 0.3235
Brugia malayi Nuclear hormone receptor family member nhr-1 0.0063 0.0132 0.0132
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0063 0.0132 0.0313
Schistosoma mansoni hypothetical protein 0.0476 0.2961 0.4392
Schistosoma mansoni smad1 5 8 and 0.0101 0.0393 0.0583
Loa Loa (eye worm) MH2 domain-containing protein 0.148 0.9835 0.9835
Echinococcus multilocularis NADP dependent isocitrate dehydrogenase 0.0329 0.1957 0.464
Mycobacterium ulcerans ATP-dependent Clp protease proteolytic subunit 0.0077 0.0228 0.5
Loa Loa (eye worm) hypothetical protein 0.0063 0.0132 0.0121
Schistosoma mansoni photoreceptor-specific nuclear receptor related 0.0063 0.0132 0.0196
Echinococcus granulosus ecdysone induced protein 78C 0.0063 0.0132 0.0313
Loa Loa (eye worm) pigment dispersing factor receptor c 0.1504 1 1
Brugia malayi MH2 domain containing protein 0.0045 0.0011 0.0011
Schistosoma mansoni hypothetical protein 0.0476 0.2961 0.4392
Loa Loa (eye worm) hypothetical protein 0.0063 0.0132 0.0121
Echinococcus multilocularis peptidase Clp (S14 family) 0.005 0.0047 0.0112
Toxoplasma gondii isocitrate dehydrogenase 0.0329 0.1957 1
Echinococcus multilocularis Glycosyl transferase, family 8 0.0073 0.0202 0.0479
Mycobacterium tuberculosis Probable isocitrate dehydrogenase [NADP] Icd1 (oxalosuccinate decarboxylase) (IDH) (NADP+-specific ICDH) (IDP) 0.0329 0.1957 1
Echinococcus granulosus TGF beta signal transducer SmadC 0.0101 0.0393 0.0931
Schistosoma mansoni retinoic acid receptor RXR 0.0063 0.0132 0.0196
Schistosoma mansoni smad 0.0101 0.0393 0.0583
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0063 0.0132 0.0313
Schistosoma mansoni thyroid hormone receptor 0.0063 0.0132 0.0196
Schistosoma mansoni tyrosine kinase 0.065 0.4154 0.6161
Brugia malayi Probable ClpP-like protease 0.0077 0.0228 0.0228
Loa Loa (eye worm) nuclear factor I 0.0056 0.0084 0.0073
Brugia malayi Tyrosine-protein kinase abl-1 0.04 0.2441 0.2441
Echinococcus multilocularis ecdysone induced protein 78C 0.0063 0.0132 0.0313
Schistosoma mansoni TGF-beta signal transducer Smad2 0.0101 0.0393 0.0583
Loa Loa (eye worm) hypothetical protein 0.0063 0.0132 0.0121
Plasmodium falciparum ataxin-2 like protein, putative 0.0187 0.0983 0.4365
Schistosoma mansoni hypothetical protein 0.0476 0.2961 0.4392
Loa Loa (eye worm) transcription factor SMAD2 0.148 0.9835 0.9835
Leishmania major isocitrate dehydrogenase [NADP], mitochondrial precursor, putative 0.0329 0.1957 1
Brugia malayi nuclear hormone receptor 0.0063 0.0132 0.0132
Brugia malayi MH1 domain containing protein 0.0056 0.0084 0.0084
Loa Loa (eye worm) nuclear hormone receptor family member nhr-40 0.0063 0.0132 0.0121
Echinococcus granulosus mothers against decapentaplegic 6 0.0045 0.0011 0.0026
Brugia malayi MH2 domain containing protein 0.148 0.9835 0.9835
Loa Loa (eye worm) latrophilin receptor protein 2 0.0476 0.2961 0.2953
Echinococcus granulosus FTZ F1 nuclear receptor protein 0.0063 0.0132 0.0313
Brugia malayi mothers against decapentaplegic homolog 3 0.0045 0.0011 0.0011
Trichomonas vaginalis glucosylceramidase, putative 0.0312 0.1838 1
Schistosoma mansoni tar DNA-binding protein 0.0517 0.3242 0.4809
Echinococcus multilocularis mothers against decapentaplegic 5 0.0101 0.0393 0.0931
Schistosoma mansoni retinoid-x-receptor (RXR) 0.0063 0.0132 0.0196
Brugia malayi Nuclear hormone receptor family member nhr-14 0.0063 0.0132 0.0132
Echinococcus granulosus NADP dependent isocitrate dehydrogenase 0.0329 0.1957 0.464
Echinococcus granulosus tar DNA binding protein 0.0517 0.3242 0.7686
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.0476 0.2961 0.7018
Echinococcus multilocularis tyrosine protein kinase ABL1 0.066 0.4219 1
Brugia malayi Nuclear hormone receptor family member nhr-3 0.0063 0.0132 0.0132
Schistosoma mansoni Smad4 0.0101 0.0393 0.0583
Echinococcus multilocularis isocitrate dehydrogenase 2 (NADP+) 0.0329 0.1957 0.464
Schistosoma mansoni tar DNA-binding protein 0.0517 0.3242 0.4809
Schistosoma mansoni nuclear hormone receptor nor-1/nor-2 0.0063 0.0132 0.0196
Loa Loa (eye worm) hypothetical protein 0.0063 0.0132 0.0121
Schistosoma mansoni nuclear hormone receptor 0.0063 0.0132 0.0196
Mycobacterium leprae PROBABLE ATP-DEPENDENT CLP PROTEASE PROTEOLYTIC SUBUNIT 2 CLPP2 (ENDOPEPTIDASE CLP 2) 0.0077 0.0228 1
Schistosoma mansoni coup transcription factor 0.0063 0.0132 0.0196
Loa Loa (eye worm) hypothetical protein 0.0501 0.3133 0.3125
Echinococcus multilocularis thyroid hormone receptor alpha 0.0063 0.0132 0.0313
Schistosoma mansoni smad1 5 8 and 0.0101 0.0393 0.0583
Echinococcus multilocularis conserved hypothetical protein 0.0054 0.0073 0.0173
Trichomonas vaginalis glucosylceramidase, putative 0.0216 0.1179 0.1027
Loa Loa (eye worm) nuclear hormone receptor family member nhr-41 0.0063 0.0132 0.0121
Plasmodium falciparum isocitrate dehydrogenase [NADP], mitochondrial 0.0329 0.1957 1
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0063 0.0132 0.0132
Brugia malayi O-Glycosyl hydrolase family 30 protein 0.0312 0.1838 0.1838
Echinococcus granulosus Glycosyltransferase protein LARGE1 0.0054 0.0073 0.0173
Brugia malayi Smad1 0.0101 0.0393 0.0393
Echinococcus multilocularis FTZ F1 nuclear receptor protein 0.0063 0.0132 0.0313
Echinococcus granulosus glycosyltransferase protein LARGE2 0.0071 0.0186 0.0441
Loa Loa (eye worm) hypothetical protein 0.0056 0.0084 0.0073
Loa Loa (eye worm) nuclear Hormone Receptor family member 0.0063 0.0132 0.0121
Brugia malayi Latrophilin receptor protein 2 0.0476 0.2961 0.2961
Brugia malayi isocitrate dehydrogenase 0.0329 0.1957 0.1957
Brugia malayi steroid hormone receptor 0.0063 0.0132 0.0132
Echinococcus multilocularis ATP dependent Clp protease proteolytic subunit 0.0077 0.0228 0.0541
Brugia malayi Nuclear hormone receptor-like 1 0.0063 0.0132 0.0132
Brugia malayi nuclear receptor NHR-88 0.0063 0.0132 0.0132
Trichomonas vaginalis glucosylceramidase, putative 0.0312 0.1838 1
Echinococcus granulosus GPCR family 2 0.0476 0.2961 0.7018
Loa Loa (eye worm) hypothetical protein 0.0063 0.0132 0.0121
Entamoeba histolytica hypothetical protein 0.0043 0 0.5
Brugia malayi Nuclear hormone receptor family member nhr-41 0.0063 0.0132 0.0132
Schistosoma mansoni hypothetical protein 0.1028 0.6742 1
Treponema pallidum ATP-dependent Clp protease proteolytic subunit 0.0077 0.0228 0.5
Echinococcus granulosus mothers against decapentaplegic 2 0.0045 0.0011 0.0026
Trypanosoma cruzi isocitrate dehydrogenase [NADP], mitochondrial precursor, putative 0.0329 0.1957 1
Echinococcus granulosus mothers against decapentaplegic 5 0.0101 0.0393 0.0931
Brugia malayi hypothetical protein 0.0187 0.0983 0.0983
Echinococcus granulosus peptidase Clp S14 family 0.005 0.0047 0.0112
Loa Loa (eye worm) hypothetical protein 0.0476 0.2961 0.2953
Echinococcus multilocularis Smad4 0.0101 0.0393 0.0931
Echinococcus granulosus cadherin EGF LAG seven pass G type receptor 0.0476 0.2961 0.7018
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0063 0.0132 0.0132
Echinococcus multilocularis glycosyltransferase protein LARGE2 0.0071 0.0186 0.0441
Loa Loa (eye worm) MH1 domain-containing protein 0.0101 0.0393 0.0382
Brugia malayi RNA recognition motif domain containing protein 0.0517 0.3242 0.3242
Schistosoma mansoni thyroid hormone receptor 0.0063 0.0132 0.0196
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0063 0.0132 0.0313
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0063 0.0132 0.0132
Trypanosoma cruzi isocitrate dehydrogenase, putative 0.0329 0.1957 1
Brugia malayi MH2 domain containing protein 0.0101 0.0393 0.0393
Echinococcus multilocularis smad 0.0101 0.0393 0.0931
Echinococcus multilocularis NADP dependent isocitrate dehydrogenase 0.0329 0.1957 0.464
Echinococcus multilocularis tyrosine protein kinase Abl 0.0269 0.1544 0.3659
Trichomonas vaginalis glucosylceramidase, putative 0.0312 0.1838 1
Brugia malayi Steroid receptor seven-up type 2 0.0531 0.3335 0.3335
Loa Loa (eye worm) hypothetical protein 0.025 0.1416 0.1406
Loa Loa (eye worm) hypothetical protein 0.0063 0.0132 0.0121
Schistosoma mansoni nuclear receptor 2DBD-gamma 0.0063 0.0132 0.0196
Schistosoma mansoni Smad4 0.0045 0.0011 0.0017
Echinococcus multilocularis NADP dependent isocitrate dehydrogenase 0.0329 0.1957 0.464
Schistosoma mansoni hypothetical protein 0.0205 0.1103 0.1637
Loa Loa (eye worm) hypothetical protein 0.0298 0.1746 0.1737
Brugia malayi MH1 domain containing protein 0.0101 0.0393 0.0393
Trypanosoma brucei isocitrate dehydrogenase [NADP], mitochondrial precursor, putative 0.0329 0.1957 1
Mycobacterium ulcerans ATP-dependent Clp protease proteolytic subunit 0.0077 0.0228 0.5
Brugia malayi Glycosyl transferase family 8 protein 0.0073 0.0202 0.0202
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.0476 0.2961 0.7018
Echinococcus multilocularis TGF beta signal transducer SmadC 0.0101 0.0393 0.0931
Loa Loa (eye worm) nuclear hormone receptor family member nhr-14 0.0063 0.0132 0.0121
Onchocerca volvulus 0.0063 0.0132 0.1106
Loa Loa (eye worm) hypothetical protein 0.0077 0.0228 0.0217
Echinococcus multilocularis Glycosyltransferase protein LARGE1 0.0054 0.0073 0.0173
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0063 0.0132 0.0132
Echinococcus multilocularis cadherin EGF LAG seven pass G type receptor 0.0476 0.2961 0.7018
Echinococcus granulosus Glycosyl transferase family 8 0.0073 0.0202 0.0479
Trichomonas vaginalis glucosylceramidase, putative 0.0312 0.1838 1
Schistosoma mansoni tar DNA-binding protein 0.0517 0.3242 0.4809
Echinococcus granulosus hepatocyte nuclear factor 4 alpha 0.0063 0.0132 0.0313
Echinococcus multilocularis glycosyltransferase protein LARGE2 0.0071 0.0186 0.0441
Echinococcus multilocularis mothers against decapentaplegic 6 0.0045 0.0011 0.0026
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.0476 0.2961 0.2961
Echinococcus granulosus Smad4 0.0101 0.0393 0.0931
Schistosoma mansoni smad1 5 8 and 0.0101 0.0393 0.0583
Toxoplasma gondii LsmAD domain-containing protein 0.0187 0.0983 0.4365
Echinococcus granulosus Ataxin 2 N terminaldomain containing protein 0.0084 0.0277 0.0656
Loa Loa (eye worm) MH2 domain-containing protein 0.0101 0.0393 0.0382
Echinococcus multilocularis FTZ F1 alpha 0.0063 0.0132 0.0313
Loa Loa (eye worm) hypothetical protein 0.0187 0.0983 0.0973
Schistosoma mansoni hypothetical protein 0.0476 0.2961 0.4392
Schistosoma mansoni Smad4 0.0045 0.0011 0.0017
Loa Loa (eye worm) hypothetical protein 0.1504 1 1
Loa Loa (eye worm) TK/ABL protein kinase 0.066 0.4219 0.4212
Brugia malayi photoreceptor-specific nuclear receptor 0.0298 0.1746 0.1746
Schistosoma mansoni tar DNA-binding protein 0.0517 0.3242 0.4809
Entamoeba histolytica hypothetical protein 0.0043 0 0.5
Brugia malayi MH2 domain containing protein 0.0101 0.0393 0.0393
Loa Loa (eye worm) Smad1 0.0101 0.0393 0.0382
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0063 0.0132 0.0132
Brugia malayi Nuclear hormone receptor family member nhr-31 0.0063 0.0132 0.0132
Loa Loa (eye worm) nuclear hormone receptor family member nhr-1 0.0063 0.0132 0.0121
Echinococcus multilocularis isocitrate dehydrogenase 0.0329 0.1957 0.464
Echinococcus granulosus ATP dependent Clp protease proteolytic subunit 0.0077 0.0228 0.0541
Loa Loa (eye worm) hypothetical protein 0.0063 0.0132 0.0121
Chlamydia trachomatis ATP-dependent Clp protease proteolytic subunit 0.0077 0.0228 0.5
Onchocerca volvulus Glucosylceramidase homolog 0.0205 0.1103 1
Loa Loa (eye worm) nuclear hormone receptor 0.0498 0.3108 0.3101
Echinococcus multilocularis glycosyltransferase protein LARGE2 0.0071 0.0186 0.0441
Trichomonas vaginalis glucosylceramidase, putative 0.0216 0.1179 0.1027
Entamoeba histolytica hypothetical protein 0.0043 0 0.5
Schistosoma mansoni RAR-like nuclear receptor 0.0063 0.0132 0.0196
Onchocerca volvulus Steroid hormone receptor family member cnr14 homolog 0.0063 0.0132 0.1106
Echinococcus granulosus FTZ F1 alpha 0.0063 0.0132 0.0313
Echinococcus granulosus Nuclear hormone receptor family member nhr 41 0.0063 0.0132 0.0313
Entamoeba histolytica hypothetical protein 0.0043 0 0.5
Loa Loa (eye worm) nuclear hormone receptor family member nhr-31 0.0063 0.0132 0.0121
Schistosoma mansoni FTZ-F1 nuclear receptor-like protein 0.0063 0.0132 0.0196
Brugia malayi MH1 domain containing protein 0.0056 0.0084 0.0084
Loa Loa (eye worm) hypothetical protein 0.1028 0.6742 0.6738
Plasmodium vivax ataxin-2 like protein, putative 0.0187 0.0983 0.4365
Brugia malayi RNA binding protein 0.0517 0.3242 0.3242
Schistosoma mansoni smad 0.0045 0.0011 0.0017
Schistosoma mansoni Tr4/Tr2 (homologue) 0.0063 0.0132 0.0196
Brugia malayi Tyrosine-protein kinase abl-1 0.0269 0.1544 0.1544

Activities

Activity type Activity value Assay description Source Reference
Potency (functional) 1.0323 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) 4.4668 uM PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors and Activators of N370S glucocerebrosidase as a Potential Chaperone Treatment of Gaucher Disease. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID1473, AID2293, AID2577, AID2578, AID2587, AID2588, AID2589, AID2590, AID2592, AID2593, AID2595, AID2596, AID2597, AID2613, AID2671, AID488845] ChEMBL. No reference
Potency (functional) 6.3096 uM PubChem BioAssay. qHTS of GLP-1 Receptor Inverse Agonists (Inhibition Mode). (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 11.5821 uM PubChem BioAssay. A quantitative high throughput screen for small molecules that induce DNA re-replication in MCF 10a normal breast cells. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 12.99 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) 16.3601 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) 18.526 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) 25.9185 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) 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
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.

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