Detailed information for compound 1451041

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 332.334 | Formula: C14H12N4O4S
  • H donors: 2 H acceptors: 6 LogP: 0.78 Rotable bonds: 3
    Rule of 5 violations (Lipinski): 1
  • SMILES: O=C(C1=C(O)c2ccccc2S(=O)(=O)N1C)Nc1ncccn1
  • InChi: 1S/C14H12N4O4S/c1-18-11(13(20)17-14-15-7-4-8-16-14)12(19)9-5-2-3-6-10(9)23(18,21)22/h2-8,19H,1H3,(H,15,16,17,20)
  • InChiKey: HEKWZJTVEQNVIX-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

No synonyms found for this compound

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens glutaminase Starlite/ChEMBL No references
Homo sapiens synuclein, alpha (non A4 component of amyloid precursor) Starlite/ChEMBL No references

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Loa Loa (eye worm) glutaminase 2 Get druggable targets OG5_129245 All targets in OG5_129245
Mycobacterium ulcerans glutaminase Get druggable targets OG5_129245 All targets in OG5_129245
Trichomonas vaginalis glutaminase, putative Get druggable targets OG5_129245 All targets in OG5_129245
Loa Loa (eye worm) glutaminase Get druggable targets OG5_129245 All targets in OG5_129245
Brugia malayi glutaminase DH11.1 Get druggable targets OG5_129245 All targets in OG5_129245
Schistosoma mansoni glutaminase Get druggable targets OG5_129245 All targets in OG5_129245
By sequence similarity to non orthologous known druggable targets
No druggable targets predicted by sequence similarity
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Echinococcus granulosus Glycosyl transferase family 8 0.0073 0.0265 0.0855
Schistosoma mansoni tyrosine kinase 0.0021 0.0013 0.0021
Echinococcus multilocularis mothers against decapentaplegic 2 0.0063 0.0217 0.07
Echinococcus granulosus Smad4 0.0141 0.0597 0.1927
Plasmodium falciparum ATP-dependent Clp protease proteolytic subunit 0.008 0.0303 0.1592
Brugia malayi mothers against decapentaplegic homolog 3 0.0063 0.0217 0.0217
Brugia malayi MH1 domain containing protein 0.0141 0.0597 0.0597
Schistosoma mansoni nuclear hormone receptor 0.0034 0.0075 0.0119
Plasmodium falciparum ataxin-2 like protein, putative 0.0206 0.0917 0.5388
Brugia malayi hypothetical protein 0.0133 0.056 0.056
Loa Loa (eye worm) hypothetical protein 0.0038 0.0094 0.0094
Toxoplasma gondii ATP-dependent Clp endopeptidase, proteolytic subunit ClpP domain-containing protein 0.008 0.0303 0.1592
Brugia malayi Nuclear hormone receptor E75 0.0034 0.0075 0.0075
Brugia malayi Pax transcription factor protein 2 0.025 0.1132 0.1132
Trypanosoma cruzi isocitrate dehydrogenase [NADP], mitochondrial precursor, putative 0.0358 0.1663 1
Echinococcus multilocularis isocitrate dehydrogenase 2 (NADP+) 0.0358 0.1663 0.5367
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0071 0.0259 0.0836
Echinococcus multilocularis isocitrate dehydrogenase (NAD+) 0.0044 0.0123 0.0396
Mycobacterium tuberculosis Probable ATP-dependent CLP protease proteolytic subunit 1 ClpP1 (endopeptidase CLP) 0.0053 0.0167 0.029
Schistosoma mansoni smad1 5 8 and 0.0141 0.0597 0.0956
Echinococcus multilocularis tyrosine protein kinase Abl 0.0266 0.121 0.3904
Echinococcus multilocularis NADP dependent isocitrate dehydrogenase 0.0358 0.1663 0.5367
Brugia malayi Steroid receptor seven-up type 2 0.0527 0.249 0.249
Schistosoma mansoni Smad4 0.0063 0.0217 0.0347
Brugia malayi RNA recognition motif domain containing protein 0.0652 0.3099 0.3099
Echinococcus multilocularis COUP TF:Svp nuclear hormone receptor 0.0527 0.249 0.8033
Schistosoma mansoni hypothetical protein 0.0037 0.0091 0.0146
Echinococcus multilocularis Nuclear hormone receptor HR96 0.0034 0.0075 0.024
Onchocerca volvulus Bile acid receptor homolog 0.0071 0.0259 0.1745
Loa Loa (eye worm) hypothetical protein 0.0034 0.0075 0.0075
Echinococcus granulosus TGF beta signal transducer SmadC 0.0141 0.0597 0.1927
Schistosoma mansoni proto-oncogene tyrosine-protein kinase src 0.0021 0.0013 0.0021
Brugia malayi latrophilin 2 splice variant baaae 0.1295 0.6246 0.6246
Echinococcus multilocularis FTZ F1 nuclear receptor protein 0.0071 0.0259 0.0836
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0071 0.0259 0.0836
Loa Loa (eye worm) SRC-1 0.0021 0.0013 0.0013
Echinococcus multilocularis ecdysone induced protein 78C 0.0071 0.0259 0.0836
Schistosoma mansoni nuclear receptor 0.0034 0.0075 0.0119
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0071 0.0259 0.0836
Loa Loa (eye worm) hypothetical protein 0.0071 0.0259 0.0259
Loa Loa (eye worm) hypothetical protein 0.0034 0.0075 0.0075
Brugia malayi tailless protein 0.0034 0.0075 0.0075
Loa Loa (eye worm) hypothetical protein 0.0019 0.0001 0.0001
Echinococcus multilocularis peptidase Clp (S14 family) 0.0053 0.0167 0.054
Loa Loa (eye worm) TK/ABL protein kinase 0.0652 0.3099 0.3099
Echinococcus granulosus proto oncogene tyrosine protein kinase LCK 0.0021 0.0013 0.0041
Echinococcus multilocularis glycosyltransferase protein LARGE2 0.007 0.0254 0.0819
Loa Loa (eye worm) nuclear receptor NHR-67 0.0034 0.0075 0.0075
Onchocerca volvulus Steroid hormone receptor family member cnr14 homolog 0.0071 0.0259 0.1745
Echinococcus multilocularis nuclear receptor nhr 48 0.0034 0.0075 0.024
Brugia malayi Nuclear hormone receptor-like 1 0.0038 0.0094 0.0094
Echinococcus multilocularis conserved hypothetical protein 0.0054 0.0173 0.056
Schistosoma mansoni tyrosine kinase 0.0021 0.0013 0.0021
Schistosoma mansoni retinoid-x-receptor (RXR) 0.0071 0.0259 0.0415
Echinococcus granulosus tyrosine protein kinase ABL1 0.0652 0.3099 1
Loa Loa (eye worm) nuclear factor I 0.0078 0.029 0.029
Schistosoma mansoni tar DNA-binding protein 0.0652 0.3099 0.4961
Mycobacterium ulcerans ATP-dependent Clp protease proteolytic subunit 0.008 0.0303 0.1284
Brugia malayi nuclear hormone receptor family member odr-7 0.0034 0.0075 0.0075
Brugia malayi MH2 domain containing protein 0.0141 0.0597 0.0597
Brugia malayi nuclear hormone receptor family member nhr-6 0.0034 0.0075 0.0075
Brugia malayi nuclear receptor subfamily 1, group D, member 1, putative 0.0034 0.0075 0.0075
Schistosoma mansoni hypothetical protein 0.0599 0.2842 0.4551
Loa Loa (eye worm) glutaminase 2 0.033 0.1525 0.1525
Echinococcus granulosus tyrosine protein kinase Src42A 0.0021 0.0013 0.0041
Echinococcus multilocularis thyroid hormone receptor alpha 0.0071 0.0259 0.0836
Brugia malayi N-terminal motif family protein 0.0184 0.0812 0.0812
Loa Loa (eye worm) MH2 domain-containing protein 0.2062 1 1
Brugia malayi Isocitrate dehydrogenase 0.0358 0.1663 0.1663
Echinococcus multilocularis mothers against decapentaplegic 6 0.0063 0.0217 0.07
Loa Loa (eye worm) nuclear hormone receptor 0.049 0.2305 0.2305
Echinococcus multilocularis isocitrate dehydrogenase 0.0358 0.1663 0.5367
Brugia malayi ecdysteroid receptor 0.0071 0.0259 0.0259
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0071 0.0259 0.0259
Schistosoma mansoni RAR-like nuclear receptor 0.0071 0.0259 0.0415
Echinococcus granulosus nuclear receptor subfamily 4 group A 0.0034 0.0075 0.024
Brugia malayi AT16019p 0.0019 0.0001 0.0001
Loa Loa (eye worm) pax transcription factor protein 2 0.025 0.1132 0.1132
Mycobacterium leprae PROBABLE 3-ISOPROPYLMALATE DEHYDROGENASE LEUB (BETA-IPM DEHYDROGENASE) (IMDH) (3-IPM-DH) 0.0044 0.0123 0.3012
Schistosoma mansoni tar DNA-binding protein 0.0652 0.3099 0.4961
Echinococcus multilocularis Glycosyltransferase protein LARGE1 0.0054 0.0173 0.056
Loa Loa (eye worm) hypothetical protein 0.0034 0.0075 0.0075
Loa Loa (eye worm) nuclear hormone receptor family member nhr-1 0.0071 0.0259 0.0259
Loa Loa (eye worm) hypothetical protein 0.0599 0.2842 0.2842
Loa Loa (eye worm) nuclear hormone receptor family member nhr-40 0.0071 0.0259 0.0259
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0037 0.0091 0.0295
Loa Loa (eye worm) hypothetical protein 0.0034 0.0075 0.0075
Echinococcus multilocularis tyrosine protein kinase Fgr 0.0021 0.0013 0.0041
Echinococcus granulosus smad 0.0141 0.0597 0.1927
Brugia malayi Tyrosine-protein kinase abl-1 0.0395 0.1844 0.1844
Mycobacterium leprae PROBABLE ATP-DEPENDENT CLP PROTEASE PROTEOLYTIC SUBUNIT 1 CLPP1 (ENDOPEPTIDASE CLP) 0.0053 0.0167 0.4744
Loa Loa (eye worm) hypothetical protein 0.008 0.0303 0.0303
Echinococcus granulosus peptidase Clp S14 family 0.0053 0.0167 0.054
Echinococcus multilocularis tyrosine protein kinase Fyn 0.0021 0.0013 0.0041
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.0599 0.2842 0.9171
Chlamydia trachomatis ATP-dependent Clp protease proteolytic subunit 0.008 0.0303 0.5
Loa Loa (eye worm) hypothetical protein 0.0034 0.0075 0.0075
Schistosoma mansoni smad1 5 8 and 0.0141 0.0597 0.0956
Schistosoma mansoni Isocitrate dehydrogenase [NAD] subunit gamma mitochondrial 0.0044 0.0123 0.0196
Brugia malayi hypothetical protein 0.0034 0.0075 0.0075
Echinococcus granulosus tyrosine protein kinase Src64B 0.0021 0.0013 0.0041
Loa Loa (eye worm) glutaminase 0.033 0.1525 0.1525
Loa Loa (eye worm) hypothetical protein 0.0034 0.0075 0.0075
Onchocerca volvulus Rap guanine nucleotide exchange factor 1 homolog 0.0184 0.0812 0.6973
Brugia malayi nuclear hormone receptor 0.0034 0.0075 0.0075
Echinococcus multilocularis proto oncogene tyrosine protein kinase LCK 0.0021 0.0013 0.0041
Echinococcus granulosus FTZ F1 alpha 0.0071 0.0259 0.0836
Echinococcus multilocularis Ataxin 2, N terminal,domain containing protein 0.0092 0.0362 0.1166
Brugia malayi Nuclear hormone receptor family member nhr-14 0.0071 0.0259 0.0259
Loa Loa (eye worm) nuclear receptor nhr-7B 0.0034 0.0075 0.0075
Mycobacterium tuberculosis Probable ATP-dependent CLP protease proteolytic subunit 2 ClpP2 (endopeptidase CLP 2) 0.0053 0.0167 0.029
Echinococcus multilocularis glycosyltransferase protein LARGE2 0.007 0.0254 0.0819
Toxoplasma gondii isocitrate dehydrogenase 0.0358 0.1663 1
Brugia malayi MH1 domain containing protein 0.0078 0.029 0.029
Loa Loa (eye worm) hypothetical protein 0.0078 0.029 0.029
Brugia malayi Probable isocitrate dehydrogenase 0.0044 0.0123 0.0123
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0034 0.0075 0.024
Echinococcus multilocularis tyrosine protein kinase Fyn 0.0021 0.0013 0.0041
Loa Loa (eye worm) MH1 domain-containing protein 0.0063 0.0217 0.0217
Echinococcus granulosus tar DNA binding protein 0.0652 0.3099 0.9997
Loa Loa (eye worm) pigment dispersing factor receptor c 0.1894 0.9179 0.9179
Brugia malayi Nuclear hormone receptor family member nhr-3 0.0071 0.0259 0.0259
Echinococcus multilocularis Nuclear hormone receptor family member nhr 41 0.0071 0.0259 0.0836
Brugia malayi photoreceptor-specific nuclear receptor 0.0542 0.2561 0.2561
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.0652 0.3099 0.3099
Echinococcus granulosus FTZ F1 nuclear receptor protein 0.0071 0.0259 0.0836
Brugia malayi nuclear hormone receptor 0.0071 0.0259 0.0259
Treponema pallidum ATP-dependent Clp protease proteolytic subunit 0.008 0.0303 1
Trypanosoma brucei isocitrate dehydrogenase, putative 0.0358 0.1663 1
Brugia malayi hypothetical protein 0.0037 0.0091 0.0091
Schistosoma mansoni nuclear receptor nhr-48 0.0034 0.0075 0.0119
Echinococcus multilocularis tar DNA binding protein 0.0652 0.3099 0.9997
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0071 0.0259 0.0259
Brugia malayi Nuclear hormone receptor E75 0.0034 0.0075 0.0075
Loa Loa (eye worm) hypothetical protein 0.0542 0.2561 0.2561
Schistosoma mansoni nuclear hormone receptor 0.0071 0.0259 0.0415
Brugia malayi Isocitrate dehydrogenase subunit gamma, mitochondrial precursor 0.0044 0.0123 0.0123
Brugia malayi nuclear receptor RXR 0.0034 0.0075 0.0075
Schistosoma mansoni glutaminase 0.033 0.1525 0.2442
Loa Loa (eye worm) MH1 domain-containing protein 0.0141 0.0597 0.0597
Echinococcus granulosus NADP dependent isocitrate dehydrogenase 0.0358 0.1663 0.5367
Brugia malayi isocitrate dehydrogenase [NAD] subunit beta, mitochondrial 0.0044 0.0123 0.0123
Loa Loa (eye worm) MH2 domain-containing protein 0.0141 0.0597 0.0597
Echinococcus multilocularis c src tyrosine kinase 0.0021 0.0013 0.0041
Schistosoma mansoni steroid hormone receptor ad4bp 0.0071 0.0259 0.0415
Schistosoma mansoni tar DNA-binding protein 0.0652 0.3099 0.4961
Loa Loa (eye worm) hypothetical protein 0.0206 0.0917 0.0917
Echinococcus granulosus isocitrate dehydrogenase NAD 0.0044 0.0123 0.0396
Onchocerca volvulus Mothers against decapentaplegic homolog 0.0063 0.0217 0.1347
Plasmodium vivax isocitrate dehydrogenase [NADP], mitochondrial, putative 0.0358 0.1663 1
Echinococcus granulosus retinoic acid receptor rxr beta a 0.0071 0.0259 0.0836
Echinococcus granulosus tyrosine protein kinase Btk29A 0.0021 0.0013 0.0041
Loa Loa (eye worm) hypothetical protein 0.0034 0.0075 0.0075
Echinococcus multilocularis hepatocyte nuclear factor 4 alpha 0.0071 0.0259 0.0836
Schistosoma mansoni retinoid-x-receptor (RXR) 0.0038 0.0094 0.0151
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0037 0.0091 0.0295
Echinococcus granulosus tyrosine protein kinase Fyn 0.0021 0.0013 0.0041
Echinococcus granulosus nuclear receptor subfamily 1 group D 0.0038 0.0094 0.0304
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.0599 0.2842 0.9171
Schistosoma mansoni retinoic acid receptor RXR 0.0071 0.0259 0.0415
Schistosoma mansoni nuclear receptor 2DBD-gamma 0.0071 0.0259 0.0415
Loa Loa (eye worm) hypothetical protein 0.0071 0.0259 0.0259
Onchocerca volvulus 0.025 0.1132 1
Loa Loa (eye worm) nuclear hormone receptor family member nhr-49 0.0071 0.0259 0.0259
Echinococcus multilocularis tyrosine protein kinase Src64B 0.0021 0.0013 0.0041
Loa Loa (eye worm) isocitrate dehydrogenase 0.0358 0.1663 0.1663
Loa Loa (eye worm) steroid hormone receptor 0.0071 0.0259 0.0259
Brugia malayi Nuclear hormone receptor family member nhr-1 0.0071 0.0259 0.0259
Schistosoma mansoni nuclear receptor 0.0034 0.0075 0.0119
Loa Loa (eye worm) hypothetical protein 0.0038 0.0094 0.0094
Schistosoma mansoni smad 0.0141 0.0597 0.0956
Brugia malayi conserved hypotetical protein 0.0034 0.0075 0.0075
Schistosoma mansoni hypothetical protein 0.0599 0.2842 0.4551
Schistosoma mansoni Smad4 0.0063 0.0217 0.0347
Brugia malayi Glycosyl transferase family 8 protein 0.0073 0.0265 0.0265
Echinococcus multilocularis isocitrate dehydrogenase (NAD) subunit 0.0044 0.0123 0.0396
Echinococcus granulosus GPCR family 2 0.0599 0.2842 0.9171
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0071 0.0259 0.0259
Brugia malayi hypothetical protein 0.0038 0.0094 0.0094
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0071 0.0259 0.0259
Echinococcus multilocularis tyrosine protein kinase Fyn 0.0021 0.0013 0.0041
Brugia malayi MH2 domain containing protein 0.0141 0.0597 0.0597
Leishmania major hypothetical protein, conserved 0.0206 0.0917 0.5156
Echinococcus multilocularis mothers against decapentaplegic 5 0.0141 0.0597 0.1927
Loa Loa (eye worm) hypothetical protein 0.0038 0.0094 0.0094
Echinococcus granulosus COUP TF:Svp nuclear hormone receptor 0.0527 0.249 0.8033
Leishmania major isocitrate dehydrogenase [NADP], mitochondrial precursor, putative 0.0358 0.1663 1
Brugia malayi hypothetical protein 0.0038 0.0094 0.0094
Plasmodium falciparum ataxin-2 like protein, putative 0.0206 0.0917 0.5388
Brugia malayi MH2 domain containing protein 0.0063 0.0217 0.0217
Loa Loa (eye worm) hypothetical protein 0.1894 0.9179 0.9179
Brugia malayi isocitrate dehydrogenase [NAD] subunit alpha, mitochondrial 0.0044 0.0123 0.0123
Echinococcus granulosus Nuclear hormone receptor HR96 0.0034 0.0075 0.024
Loa Loa (eye worm) hypothetical protein 0.0184 0.0812 0.0812
Schistosoma mansoni hepatocyte nuclear factor 4-alpha (hnf-4-alpha) 0.0034 0.0075 0.0119
Loa Loa (eye worm) hypothetical protein 0.0034 0.0075 0.0075
Toxoplasma gondii isocitrate dehydrogenase 0.0358 0.1663 1
Echinococcus multilocularis tyrosine protein kinase lyn lyn a protein tyrosine kinase lymphocyte specific protein tyrosine kinase 0.0021 0.0013 0.0041
Plasmodium vivax ATP-dependent Clp protease proteolytic subunit, putative 0.008 0.0303 0.1592
Echinococcus multilocularis GPCR, family 2 0.0599 0.2842 0.9171
Loa Loa (eye worm) hypothetical protein 0.0038 0.0094 0.0094
Loa Loa (eye worm) hypothetical protein 0.0034 0.0075 0.0075
Schistosoma mansoni tyrosine kinase 0.0643 0.3054 0.4889
Echinococcus granulosus tyrosine protein kinase Fyn 0.0021 0.0013 0.0041
Loa Loa (eye worm) nuclear Hormone Receptor family member 0.0071 0.0259 0.0259
Brugia malayi nuclear receptor RXR 0.0038 0.0094 0.0094
Schistosoma mansoni tyrosine kinase 0.0021 0.0013 0.0021
Loa Loa (eye worm) hypothetical protein 0.0494 0.2325 0.2325
Mycobacterium ulcerans ATP-dependent Clp protease proteolytic subunit 0.008 0.0303 0.1284
Onchocerca volvulus Protein ultraspiracle homolog 0.0071 0.0259 0.1745
Loa Loa (eye worm) hypothetical protein 0.0063 0.0217 0.0217
Mycobacterium tuberculosis Probable isocitrate dehydrogenase [NADP] Icd1 (oxalosuccinate decarboxylase) (IDH) (NADP+-specific ICDH) (IDP) 0.0358 0.1663 1
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0071 0.0259 0.0259
Brugia malayi hypothetical protein 0.0206 0.0917 0.0917
Echinococcus granulosus c src tyrosine kinase 0.0021 0.0013 0.0041
Entamoeba histolytica tartrate dehydrogenase, putative 0.0044 0.0123 1
Schistosoma mansoni thyroid hormone receptor 0.0071 0.0259 0.0415
Brugia malayi glutaminase DH11.1 0.033 0.1525 0.1525
Loa Loa (eye worm) hypothetical protein 0.1295 0.6246 0.6246
Echinococcus multilocularis NADP dependent isocitrate dehydrogenase 0.0358 0.1663 0.5367
Echinococcus multilocularis glycosyltransferase protein LARGE2 0.007 0.0254 0.0819
Echinococcus multilocularis tyrosine protein kinase ABL1 0.0652 0.3099 1
Schistosoma mansoni hypothetical protein 0.1295 0.6246 1
Echinococcus multilocularis retinoic acid receptor rxr beta a retinoic acid receptor rxr alpha a retinoic acid receptor rxr alpha 0.0034 0.0075 0.024
Trypanosoma cruzi isocitrate dehydrogenase, putative 0.0358 0.1663 1
Echinococcus multilocularis NADP dependent isocitrate dehydrogenase 0.0358 0.1663 0.5367
Onchocerca volvulus 0.0071 0.0259 0.1745
Loa Loa (eye worm) hypothetical protein 0.0071 0.0259 0.0259
Echinococcus granulosus Nuclear hormone receptor HR96 0.0034 0.0075 0.024
Echinococcus granulosus tyrosine protein kinase Lyn 0.0021 0.0013 0.0041
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0071 0.0259 0.0259
Echinococcus multilocularis TGF beta signal transducer SmadC 0.0141 0.0597 0.1927
Schistosoma mansoni tar DNA-binding protein 0.0652 0.3099 0.4961
Schistosoma mansoni nuclear hormone receptor nor-1/nor-2 0.0071 0.0259 0.0415
Loa Loa (eye worm) glycosyl transferase family 8 protein 0.0073 0.0265 0.0265
Brugia malayi Nuclear hormone receptor-like 1 0.0071 0.0259 0.0259
Brugia malayi Probable isocitrate dehydrogenase 0.0044 0.0123 0.0123
Echinococcus multilocularis smad 0.0141 0.0597 0.1927
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0034 0.0075 0.024
Loa Loa (eye worm) hypothetical protein 0.0071 0.0259 0.0259
Echinococcus granulosus glycosyltransferase protein LARGE2 0.007 0.0254 0.0819
Brugia malayi ecdysone receptor 0.0034 0.0075 0.0075
Echinococcus granulosus hepatocyte nuclear factor 4 alpha 0.0071 0.0259 0.0836
Brugia malayi TAR-binding protein 0.0652 0.3099 0.3099
Echinococcus multilocularis ATP dependent Clp protease proteolytic subunit 0.008 0.0303 0.0977
Schistosoma mansoni smad1 5 8 and 0.0141 0.0597 0.0956
Loa Loa (eye worm) latrophilin receptor protein 2 0.0599 0.2842 0.2842
Wolbachia endosymbiont of Brugia malayi ATP-dependent Clp protease proteolytic subunit 0.008 0.0303 1
Schistosoma mansoni nuclear hormone receptor 0.0034 0.0075 0.0119
Echinococcus granulosus tyrosine protein kinase Fyn 0.0021 0.0013 0.0041
Schistosoma mansoni unc-13 (munc13) 0.0044 0.0123 0.0196
Loa Loa (eye worm) MH2 domain-containing protein 0.0063 0.0217 0.0217
Schistosoma mansoni glycosyltransferase-related 0.0073 0.0265 0.0424
Brugia malayi nuclear receptor NHR-88 0.0034 0.0075 0.0075
Echinococcus granulosus isocitrate dehydrogenase NAD subunit 0.0044 0.0123 0.0396
Loa Loa (eye worm) hypothetical protein 0.0034 0.0075 0.0075
Brugia malayi Smad1 0.0141 0.0597 0.0597
Schistosoma mansoni photoreceptor-specific nuclear receptor related 0.0071 0.0259 0.0415
Echinococcus granulosus nuclear receptor nhr 48 0.0034 0.0075 0.024
Echinococcus granulosus ATP dependent Clp protease proteolytic subunit 0.008 0.0303 0.0977
Schistosoma mansoni tar DNA-binding protein 0.0652 0.3099 0.4961
Loa Loa (eye worm) isocitrate dehydrogenase gamma subunit 0.0044 0.0123 0.0123
Loa Loa (eye worm) hypothetical protein 0.0034 0.0075 0.0075
Loa Loa (eye worm) hypothetical protein 0.0044 0.0123 0.0123
Echinococcus multilocularis tyrosine protein kinase lyn tyrosine protein kinase blk 0.0021 0.0013 0.0041
Echinococcus granulosus Ataxin 2 N terminaldomain containing protein 0.0092 0.0362 0.1166
Loa Loa (eye worm) transcription factor SMAD2 0.2062 1 1
Echinococcus granulosus ecdysone induced protein 78C 0.0071 0.0259 0.0836
Echinococcus multilocularis nuclear receptor subfamily 1 group D 0.0038 0.0094 0.0304
Brugia malayi Nuclear hormone receptor family member nhr-41 0.0071 0.0259 0.0259
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.0599 0.2842 0.2842
Schistosoma mansoni coup transcription factor 0.0071 0.0259 0.0415
Loa Loa (eye worm) nuclear hormone receptor-like 1 0.0038 0.0094 0.0094
Loa Loa (eye worm) hypothetical protein 0.0034 0.0075 0.0075
Echinococcus granulosus mothers against decapentaplegic 6 0.0063 0.0217 0.07
Schistosoma mansoni transcription factor LCR-F1 0.0037 0.0091 0.0146
Brugia malayi Latrophilin receptor protein 2 0.0599 0.2842 0.2842
Loa Loa (eye worm) nuclear hormone receptor family member nhr-14 0.0071 0.0259 0.0259
Schistosoma mansoni hypothetical protein 0.0092 0.0362 0.0579
Loa Loa (eye worm) hypothetical protein 0.0071 0.0259 0.0259
Brugia malayi hypothetical protein 0.0034 0.0075 0.0075
Brugia malayi MH1 domain containing protein 0.0141 0.0597 0.0597
Schistosoma mansoni ecdysone-induced protein 78c (dr-78) 0.0038 0.0094 0.0151
Brugia malayi nuclear receptor NHR-67 0.0034 0.0075 0.0075
Plasmodium falciparum isocitrate dehydrogenase [NADP], mitochondrial 0.0358 0.1663 1
Mycobacterium ulcerans glutaminase 0.033 0.1525 1
Brugia malayi MH1 domain containing protein 0.0078 0.029 0.029
Loa Loa (eye worm) hypothetical protein 0.0247 0.112 0.112
Echinococcus granulosus 3'partial|tyrosine protein kinase Fgr 0.0021 0.0013 0.0041
Echinococcus multilocularis Nuclear hormone receptor HR96 0.0034 0.0075 0.024
Echinococcus multilocularis tyrosine protein kinase Btk29A 0.0021 0.0013 0.0041
Schistosoma mansoni hypothetical protein 0.0599 0.2842 0.4551
Toxoplasma gondii ATP-dependent Clp endopeptidase, proteolytic subunit ClpP domain-containing protein 0.008 0.0303 0.1592
Schistosoma mansoni hypothetical protein 0.0599 0.2842 0.4551
Echinococcus multilocularis Smad4 0.0141 0.0597 0.1927
Schistosoma mansoni smad 0.0063 0.0217 0.0347
Schistosoma mansoni isocitrate dehydrogenase 0.0044 0.0123 0.0196
Schistosoma mansoni tyrosine kinase 0.0021 0.0013 0.0021
Echinococcus multilocularis cadherin EGF LAG seven pass G type receptor 0.0599 0.2842 0.9171
Brugia malayi orphan nuclear receptor NR2E1 0.0034 0.0075 0.0075
Chlamydia trachomatis ATP-dependent Clp protease proteolytic subunit 0.008 0.0303 0.5
Schistosoma mansoni peptidase Clp (S14 family) 0.008 0.0303 0.0485
Mycobacterium leprae PROBABLE ATP-DEPENDENT CLP PROTEASE PROTEOLYTIC SUBUNIT 2 CLPP2 (ENDOPEPTIDASE CLP 2) 0.008 0.0303 1
Loa Loa (eye worm) DR-78 0.0034 0.0075 0.0075
Plasmodium vivax ataxin-2 like protein, putative 0.0206 0.0917 0.5388
Echinococcus multilocularis nuclear receptor subfamily 4 group A 0.0034 0.0075 0.024
Brugia malayi isocitrate dehydrogenase 0.0358 0.1663 0.1663
Toxoplasma gondii LsmAD domain-containing protein 0.0206 0.0917 0.5388
Echinococcus granulosus Nuclear hormone receptor family member nhr 41 0.0071 0.0259 0.0836
Schistosoma mansoni nuclear hormone receptor superfamily protein-related 0.0034 0.0075 0.0119
Loa Loa (eye worm) hypothetical protein 0.0071 0.0259 0.0259
Brugia malayi nuclear receptor NHR-88 0.0071 0.0259 0.0259
Loa Loa (eye worm) hypothetical protein 0.0071 0.0259 0.0259
Brugia malayi Nuclear hormone receptor family member nhr-31 0.0071 0.0259 0.0259
Trypanosoma brucei isocitrate dehydrogenase [NADP], mitochondrial precursor, putative 0.0358 0.1663 1
Brugia malayi Nuclear hormone receptor family member nhr-40 0.0071 0.0259 0.0259
Brugia malayi SRC-1 0.0021 0.0013 0.0013
Brugia malayi Nuclear hormone receptor family member nhr-49 0.0071 0.0259 0.0259
Brugia malayi Probable ClpP-like protease 0.008 0.0303 0.0303
Brugia malayi Calcitonin receptor-like protein seb-1 0.1894 0.9179 0.9179
Echinococcus granulosus mothers against decapentaplegic 5 0.0141 0.0597 0.1927
Loa Loa (eye worm) nuclear hormone receptor family member nhr-41 0.0071 0.0259 0.0259
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0071 0.0259 0.0836
Brugia malayi Tyrosine-protein kinase abl-1 0.0266 0.121 0.121
Echinococcus granulosus cadherin EGF LAG seven pass G type receptor 0.0599 0.2842 0.9171
Loa Loa (eye worm) RNA binding protein 0.0652 0.3099 0.3099
Echinococcus granulosus Glycosyltransferase protein LARGE1 0.0054 0.0173 0.056
Loa Loa (eye worm) nuclear hormone receptor family member nhr-31 0.0071 0.0259 0.0259
Brugia malayi RNA binding protein 0.0652 0.3099 0.3099
Echinococcus granulosus mothers against decapentaplegic 2 0.0063 0.0217 0.07
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.1894 0.9179 0.9179
Trichomonas vaginalis glutaminase, putative 0.033 0.1525 1
Schistosoma mansoni Tr4/Tr2 (homologue) 0.0071 0.0259 0.0415
Echinococcus multilocularis Glycosyl transferase, family 8 0.0073 0.0265 0.0855
Schistosoma mansoni NADP-specific isocitrate dehydrogenase 0.0358 0.1663 0.2663
Schistosoma mansoni FTZ-F1 nuclear receptor-like protein 0.0071 0.0259 0.0415
Loa Loa (eye worm) TAR-binding protein 0.0652 0.3099 0.3099
Echinococcus granulosus thyroid hormone receptor alpha 0.0034 0.0075 0.024
Schistosoma mansoni thyroid hormone receptor 0.0071 0.0259 0.0415
Loa Loa (eye worm) hypothetical protein 0.0034 0.0075 0.0075
Schistosoma mansoni zinc finger protein 0.0034 0.0075 0.0119
Schistosoma mansoni Smad4 0.0141 0.0597 0.0956
Loa Loa (eye worm) Smad1 0.0141 0.0597 0.0597
Schistosoma mansoni TGF-beta signal transducer Smad2 0.0141 0.0597 0.0956
Echinococcus multilocularis tyrosine protein kinase Src42A 0.0021 0.0013 0.0041
Echinococcus multilocularis FTZ F1 alpha 0.0071 0.0259 0.0836
Brugia malayi steroid hormone receptor 0.0071 0.0259 0.0259
Brugia malayi Nuclear hormone receptor-like 1 0.0038 0.0094 0.0094

Activities

Activity type Activity value Assay description Source Reference
Potency (functional) 14.1254 uM PubChem BioAssay. qHTS for Inhibitors of Glutaminase (GLS). (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 17.7828 uM PubChem BioAssay. qHTS of alpha-syn Inhibitors. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 28.1838 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) 28.1838 uM PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of BAZ2B. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID504391] ChEMBL. No reference
Potency (functional) 63.0957 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) = 89.1251 um PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Bacillus subtilis Sfp phosphopantetheinyl transferase (PPTase). (Class of assay: confirmatory) 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.
 
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External resources for this compound

Bibliographic References

No literature references available for this target.

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