Detailed information for compound 1454543

Basic information

Technical information
  • TDR Targets ID: 1454543
  • Name: N-[[3-(1,3-benzodioxole-5-carbonyl)-1,3-oxazo lidin-2-yl]methyl]-N'-[(4-methylphenyl)methyl ]oxamide
  • MW: 425.435 | Formula: C22H23N3O6
  • H donors: 2 H acceptors: 3 LogP: 1.87 Rotable bonds: 9
    Rule of 5 violations (Lipinski): 1
  • SMILES: Cc1ccc(cc1)CNC(=O)C(=O)NCC1OCCN1C(=O)c1ccc2c(c1)OCO2
  • InChi: 1S/C22H23N3O6/c1-14-2-4-15(5-3-14)11-23-20(26)21(27)24-12-19-25(8-9-29-19)22(28)16-6-7-17-18(10-16)31-13-30-17/h2-7,10,19H,8-9,11-13H2,1H3,(H,23,26)(H,24,27)
  • InChiKey: ATRAEZCJBLTZAL-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • N-[[3-(1,3-benzodioxole-5-carbonyl)oxazolidin-2-yl]methyl]-N'-[(4-methylphenyl)methyl]oxamide
  • N-[[3-(1,3-benzodioxol-5-yl-oxomethyl)-2-oxazolidinyl]methyl]-N'-[(4-methylphenyl)methyl]oxamide
  • N-[[3-(1,3-benzodioxole-5-carbonyl)oxazolidin-2-yl]methyl]-N'-(4-methylbenzyl)oxamide
  • N-[[3-(1,3-benzodioxol-5-ylcarbonyl)-1,3-oxazolidin-2-yl]methyl]-N'-[(4-methylphenyl)methyl]ethanediamide
  • MLS000624335
  • SMR000323646

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens survival of motor neuron 2, centromeric 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) hypothetical protein Get druggable targets OG5_132873 All targets in OG5_132873
Echinococcus granulosus survival motor neuron protein 1 Get druggable targets OG5_132873 All targets in OG5_132873
Echinococcus multilocularis survival motor neuron protein 1 Get druggable targets OG5_132873 All targets in OG5_132873
Brugia malayi hypothetical protein Get druggable targets OG5_132873 All targets in OG5_132873
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 multilocularis diuretic hormone 44 receptor GPRdih2 0.04 0.3099 0.3484
Loa Loa (eye worm) hypothetical protein 0.0552 0.4322 0.4322
Echinococcus granulosus rap guanine nucleotide exchange factor 6 0.0019 0.006 0.0067
Echinococcus multilocularis segment polarity protein dishevelled 0.0027 0.0122 0.0137
Echinococcus granulosus rap guanine nucleotide exchange factor 1 0.0019 0.006 0.0067
Brugia malayi TAR-binding protein 0.1124 0.8893 0.8893
Echinococcus multilocularis survival motor neuron protein 1 0.0286 0.2188 0.246
Brugia malayi MH1 domain containing protein 0.0024 0.0093 0.0093
Brugia malayi RasGEF domain containing protein 0.0019 0.006 0.006
Schistosoma mansoni ras GTP exchange factor 0.0019 0.006 0.0067
Loa Loa (eye worm) MH1 domain-containing protein 0.0019 0.0057 0.0057
Echinococcus granulosus son of sevenless 1 0.0019 0.006 0.0067
Loa Loa (eye worm) hypothetical protein 0.0019 0.006 0.006
Echinococcus multilocularis isocitrate dehydrogenase 2 (NADP+) 0.0086 0.0594 0.0668
Echinococcus multilocularis rap guanine nucleotide exchange factor 1 0.0019 0.006 0.0067
Loa Loa (eye worm) MH2 domain-containing protein 0.0019 0.0057 0.0057
Mycobacterium ulcerans polyketide synthase 0.0025 0.0101 0.5094
Mycobacterium leprae PROBABLE THIOESTERASE TESA 0.002 0.0068 0.344
Mycobacterium tuberculosis Probable polyketide synthase Pks9 0.0014 0.0016 0.027
Loa Loa (eye worm) hypothetical protein 0.0027 0.0122 0.0122
Brugia malayi RasGEF domain containing protein 0.0019 0.006 0.006
Trichomonas vaginalis ras GTP exchange factor, son of sevenless, putative 0.0019 0.006 1
Brugia malayi Beta-ketoacyl synthase, N-terminal domain containing protein 0.0025 0.0101 0.0101
Echinococcus granulosus regulator of G protein signaling 7 0.0027 0.0122 0.0137
Entamoeba histolytica Ras guanine nucleotide exchange factor, putative 0.0019 0.006 0.5
Loa Loa (eye worm) transcription factor SMAD2 0.0626 0.4912 0.4912
Mycobacterium leprae Probable multifunctional mycocerosic acid synthase membrane associated enzyme Mas 0.0026 0.0113 0.571
Schistosoma mansoni Smad4 0.0019 0.0057 0.0064
Brugia malayi MH2 domain containing protein 0.0626 0.4912 0.4912
Brugia malayi mothers against decapentaplegic homolog 3 0.0019 0.0057 0.0057
Echinococcus multilocularis mothers against decapentaplegic 5 0.0043 0.0246 0.0276
Mycobacterium leprae PHENOLPTHIOCEROL SYNTHESIS TYPE-I POLYKETIDE SYNTHASE PPSA 0.0025 0.0101 0.5094
Brugia malayi Calcitonin receptor-like protein seb-1 0.1263 1 1
Mycobacterium tuberculosis Probable isocitrate dehydrogenase [NADP] Icd1 (oxalosuccinate decarboxylase) (IDH) (NADP+-specific ICDH) (IDP) 0.0086 0.0594 1
Echinococcus multilocularis segment polarity protein dishevelled 0.0027 0.0122 0.0137
Entamoeba histolytica Ras guanine nucleotide exchange factor, putative 0.0019 0.006 0.5
Loa Loa (eye worm) MH1 domain-containing protein 0.0043 0.0246 0.0246
Mycobacterium tuberculosis Probable membrane bound polyketide synthase Pks6 0.0037 0.0198 0.3324
Entamoeba histolytica Ras guanine nucleotide exchange factor, putative 0.0019 0.006 0.5
Loa Loa (eye worm) hypothetical protein 0.1263 1 1
Brugia malayi Domain found in Dishevelled, Egl-10, and Pleckstrin family protein 0.0027 0.0122 0.0122
Brugia malayi isocitrate dehydrogenase 0.0086 0.0594 0.0594
Mycobacterium tuberculosis Polyketide synthase Pks12 0.0026 0.0113 0.1898
Schistosoma mansoni dep domain containing protein 0.0027 0.0122 0.0137
Trichomonas vaginalis ras GTP exchange factor, putative 0.0019 0.006 1
Trypanosoma cruzi guanine nucleotide releasing protein, putative 0.0019 0.006 0.1003
Loa Loa (eye worm) pigment dispersing factor receptor c 0.1263 1 1
Schistosoma mansoni dishevelled 0.0027 0.0122 0.0137
Mycobacterium ulcerans polyketide synthase Pks9 0.0016 0.0034 0.1733
Mycobacterium leprae Polyketide synthase Pks13 0.0037 0.0198 1
Loa Loa (eye worm) MH2 domain-containing protein 0.0626 0.4912 0.4912
Loa Loa (eye worm) hypothetical protein 0.0027 0.0122 0.0122
Trypanosoma cruzi isocitrate dehydrogenase, putative 0.0086 0.0594 1
Treponema pallidum catabolite gene activator 0.0012 0 0.5
Mycobacterium ulcerans Type I modular polyketide synthase 0.0025 0.0101 0.5094
Entamoeba histolytica Ras guanine nucleotide exchange factor, putative 0.0019 0.006 0.5
Mycobacterium ulcerans polyketide synthase 0.0026 0.0113 0.571
Schistosoma mansoni Smad4 0.0019 0.0057 0.0064
Plasmodium falciparum isocitrate dehydrogenase [NADP], mitochondrial 0.0086 0.0594 1
Mycobacterium ulcerans thioesterase 0.002 0.0068 0.344
Brugia malayi MH1 domain containing protein 0.0043 0.0246 0.0246
Mycobacterium leprae PHENOLPTHIOCEROL SYNTHESIS TYPE-I POLYKETIDE SYNTHASE PPSC 0.0026 0.0113 0.571
Entamoeba histolytica Ras guanine nucleotide exchange factor, putative 0.0019 0.006 0.5
Loa Loa (eye worm) hypothetical protein 0.0019 0.006 0.006
Schistosoma mansoni tar DNA-binding protein 0.1124 0.8893 1
Brugia malayi RNA binding protein 0.1124 0.8893 0.8893
Echinococcus multilocularis smad 0.0043 0.0246 0.0276
Schistosoma mansoni hypothetical protein 0.04 0.3099 0.3484
Trichomonas vaginalis ras GTP exchange factor, putative 0.0019 0.006 1
Toxoplasma gondii isocitrate dehydrogenase 0.0086 0.0594 1
Schistosoma mansoni dishevelled 0.0027 0.0122 0.0137
Brugia malayi DIX domain containing protein 0.0027 0.0122 0.0122
Mycobacterium tuberculosis Probable polyketide synthase Pks1 0.0018 0.0045 0.0764
Schistosoma mansoni tar DNA-binding protein 0.1124 0.8893 1
Toxoplasma gondii type I fatty acid synthase, putative 0.0017 0.0044 0.0743
Echinococcus multilocularis NADP dependent isocitrate dehydrogenase 0.0086 0.0594 0.0668
Brugia malayi MH2 domain containing protein 0.0043 0.0246 0.0246
Brugia malayi hypothetical protein 0.0027 0.0122 0.0122
Toxoplasma gondii beta-ketoacyl synthase, N-terminal domain-containing protein 0.0016 0.0032 0.0535
Onchocerca volvulus 0.0019 0.006 0.0138
Echinococcus granulosus Protein son of sevenless 0.0019 0.006 0.0067
Treponema pallidum cyclic nucleotide binding protein 0.0012 0 0.5
Loa Loa (eye worm) TAR-binding protein 0.1124 0.8893 0.8893
Brugia malayi MH2 domain containing protein 0.0019 0.0057 0.0057
Entamoeba histolytica hypothetical protein 0.0019 0.006 0.5
Mycobacterium ulcerans phenolpthiocerol synthesis type-I polyketide synthase PpsE 0.0016 0.0034 0.1733
Mycobacterium ulcerans polyketide synthase Pks13 0.0037 0.0198 1
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.04 0.3099 0.3484
Mycobacterium tuberculosis Phenyloxazoline synthase MbtB (phenyloxazoline synthetase) 0.0023 0.0088 0.1476
Echinococcus multilocularis mothers against decapentaplegic 2 0.0019 0.0057 0.0064
Schistosoma mansoni hypothetical protein 0.04 0.3099 0.3484
Echinococcus multilocularis NADP dependent isocitrate dehydrogenase 0.0086 0.0594 0.0668
Treponema pallidum catabolite gene activator (Crp) 0.0012 0 0.5
Mycobacterium tuberculosis Probable multifunctional mycocerosic acid synthase membrane-associated Mas 0.0026 0.0113 0.1898
Mycobacterium ulcerans phenolpthiocerol synthesis type-I polyketide synthase PpsB 0.002 0.0062 0.3155
Echinococcus granulosus smad 0.0043 0.0246 0.0276
Mycobacterium tuberculosis Probable polyketide synthase Pks5 0.0024 0.0095 0.1592
Echinococcus multilocularis Protein son of sevenless 0.0019 0.006 0.0067
Brugia malayi hypothetical protein 0.0027 0.0122 0.0122
Schistosoma mansoni smad 0.0043 0.0246 0.0276
Schistosoma mansoni smad1 5 8 and 0.0043 0.0246 0.0276
Echinococcus multilocularis regulator of G protein signaling 7 0.0027 0.0122 0.0137
Loa Loa (eye worm) hypothetical protein 0.0014 0.0014 0.0014
Entamoeba histolytica Ras guanine nucleotide exchange factor, putative 0.0019 0.006 0.5
Schistosoma mansoni TGF-beta signal transducer Smad2 0.0043 0.0246 0.0276
Trypanosoma cruzi isocitrate dehydrogenase [NADP], mitochondrial precursor, putative 0.0086 0.0594 1
Brugia malayi latrophilin 2 splice variant baaae 0.0863 0.6806 0.6806
Mycobacterium ulcerans thioesterase TesA 0.002 0.0068 0.344
Echinococcus multilocularis mothers against decapentaplegic 6 0.0019 0.0057 0.0064
Brugia malayi MH1 domain containing protein 0.0024 0.0093 0.0093
Mycobacterium ulcerans phenolpthiocerol synthesis type-I polyketide synthase PpsC 0.0026 0.0113 0.571
Trypanosoma cruzi hypothetical protein 0.0019 0.006 0.1003
Echinococcus granulosus mothers against decapentaplegic 6 0.0019 0.0057 0.0064
Echinococcus multilocularis TGF beta signal transducer SmadC 0.0043 0.0246 0.0276
Schistosoma mansoni hypothetical protein 0.0863 0.6806 0.7653
Loa Loa (eye worm) RNA binding protein 0.1124 0.8893 0.8893
Entamoeba histolytica Ras guanine nucleotide exchange factor, putative 0.0019 0.006 0.5
Loa Loa (eye worm) hypothetical protein 0.0019 0.0057 0.0057
Onchocerca volvulus 0.0058 0.037 0.0857
Toxoplasma gondii isocitrate dehydrogenase 0.0086 0.0594 1
Echinococcus granulosus regulator of G protein signaling 7 0.0027 0.0122 0.0137
Entamoeba histolytica Ras guanine nucleotide exchange factor, putative 0.0019 0.006 0.5
Onchocerca volvulus 0.0023 0.0088 0.0203
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.04 0.3099 0.3099
Mycobacterium tuberculosis Polyketide synthase Pks13 0.0037 0.0198 0.3324
Onchocerca volvulus 0.0027 0.0122 0.0282
Onchocerca volvulus Fatty acid synthase homolog 0.0044 0.0258 0.0597
Brugia malayi Domain found in Dishevelled, Egl-10, and Pleckstrin family protein 0.0027 0.0122 0.0122
Echinococcus granulosus tar DNA binding protein 0.1124 0.8893 1
Mycobacterium tuberculosis Probable polyketide synthase Pks8 0.002 0.0065 0.1092
Echinococcus granulosus GPCR family 2 0.04 0.3099 0.3484
Mycobacterium tuberculosis Phenolpthiocerol synthesis type-I polyketide synthase PpsA 0.0025 0.0101 0.1693
Entamoeba histolytica Ras guanine nucleotide exchange factor, putative 0.0019 0.006 0.5
Loa Loa (eye worm) Smad1 0.0043 0.0246 0.0246
Mycobacterium tuberculosis Phenolpthiocerol synthesis type-I polyketide synthase PpsD 0.0025 0.0101 0.1693
Loa Loa (eye worm) RasGEF domain-containing protein 0.0019 0.006 0.006
Trypanosoma cruzi hypothetical protein 0.0019 0.006 0.1003
Trypanosoma brucei isocitrate dehydrogenase [NADP], mitochondrial precursor, putative 0.0086 0.0594 1
Brugia malayi Smad1 0.0043 0.0246 0.0246
Echinococcus multilocularis regulator of G protein signaling 7 0.0027 0.0122 0.0137
Loa Loa (eye worm) hypothetical protein 0.0863 0.6806 0.6806
Mycobacterium leprae PHENOLPTHIOCEROL SYNTHESIS TYPE-I POLYKETIDE SYNTHASE PPSE 0.0016 0.0034 0.1733
Brugia malayi Iron-sulfur cluster assembly accessory protein 0.0058 0.037 0.037
Echinococcus granulosus Pleckstrin G protein interacting region 0.0027 0.0122 0.0137
Brugia malayi Latrophilin receptor protein 2 0.04 0.3099 0.3099
Leishmania major isocitrate dehydrogenase [NADP], mitochondrial precursor, putative 0.0086 0.0594 1
Mycobacterium ulcerans multifunctional mycocerosic acid synthase membrane-associated Mas 0.0026 0.0113 0.571
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.1124 0.8893 0.8893
Schistosoma mansoni Smad4 0.0043 0.0246 0.0276
Echinococcus granulosus survival motor neuron protein 1 0.0286 0.2188 0.246
Toxoplasma gondii AMP-binding enzyme domain-containing protein 0.0012 0.0004 0.0062
Echinococcus multilocularis GPCR, family 2 0.04 0.3099 0.3484
Echinococcus granulosus TGF beta signal transducer SmadC 0.0043 0.0246 0.0276
Onchocerca volvulus Mothers against decapentaplegic homolog 0.0019 0.0057 0.0132
Loa Loa (eye worm) RasGEF domain-containing protein 0.0019 0.006 0.006
Schistosoma mansoni z-protein (S1r protein) 0.0027 0.0122 0.0137
Loa Loa (eye worm) latrophilin receptor protein 2 0.04 0.3099 0.3099
Brugia malayi AMP-binding enzyme family protein 0.0023 0.0088 0.0088
Echinococcus multilocularis Smad4 0.0043 0.0246 0.0276
Treponema pallidum cyclic nucleotide binding protein 0.0012 0 0.5
Mycobacterium ulcerans Type I modular polyketide synthase 0.0025 0.0101 0.5094
Schistosoma mansoni ras GTP exchange factor son of sevenless 0.0019 0.006 0.0067
Schistosoma mansoni ras GTP exchange factor son of sevenless 0.0019 0.006 0.0067
Schistosoma mansoni smad 0.0019 0.0057 0.0064
Echinococcus multilocularis tar DNA binding protein 0.1124 0.8893 1
Loa Loa (eye worm) hypothetical protein 0.0041 0.0234 0.0234
Echinococcus granulosus ras GTP exchange factor 0.0019 0.006 0.0067
Loa Loa (eye worm) RasGEF domain-containing protein 0.0019 0.006 0.006
Schistosoma mansoni guanine-nucleotide-exchange-factor 0.0019 0.006 0.0067
Echinococcus multilocularis ras GTP exchange factor 0.0019 0.006 0.0067
Mycobacterium leprae PHENOLPTHIOCEROL SYNTHESIS TYPE-I POLYKETIDE SYNTHASE PPSB 0.002 0.0062 0.3155
Echinococcus granulosus cadherin EGF LAG seven pass G type receptor 0.04 0.3099 0.3484
Schistosoma mansoni fyve finger-containing phosphoinositide kinase fyv1 0.0027 0.0122 0.0137
Giardia lamblia CAMP-dependent protein kinase regulatory chain 0.0012 0 0.5
Brugia malayi Isocitrate dehydrogenase 0.0086 0.0594 0.0594
Mycobacterium leprae Probable polyketide synthase Pks1 0.0026 0.0113 0.571
Loa Loa (eye worm) hypothetical protein 0.0027 0.0122 0.0122
Mycobacterium ulcerans Type I modular polyketide synthase 0.0025 0.0101 0.5094
Loa Loa (eye worm) MH2 domain-containing protein 0.0043 0.0246 0.0246
Loa Loa (eye worm) G protein signaling regulator EGL-10 0.0027 0.0122 0.0122
Loa Loa (eye worm) hypothetical protein 0.0286 0.2188 0.2188
Echinococcus multilocularis son of sevenless 1 0.0019 0.006 0.0067
Trypanosoma brucei isocitrate dehydrogenase, putative 0.0086 0.0594 1
Echinococcus multilocularis Pleckstrin G protein, interacting region 0.0027 0.0122 0.0137
Echinococcus multilocularis isocitrate dehydrogenase 0.0086 0.0594 0.0668
Onchocerca volvulus Segment polarity protein dishevelled homolog 0.0027 0.0122 0.0282
Onchocerca volvulus Rap guanine nucleotide exchange factor 1 homolog 0.0552 0.4322 1
Brugia malayi N-terminal motif family protein 0.0019 0.006 0.006
Schistosoma mansoni smad1 5 8 and 0.0043 0.0246 0.0276
Toxoplasma gondii hypothetical protein 0.0027 0.0122 0.2053
Loa Loa (eye worm) DIX domain-containing protein 0.0027 0.0122 0.0122
Loa Loa (eye worm) hypothetical protein 0.04 0.3099 0.3099
Brugia malayi MH2 domain containing protein 0.0043 0.0246 0.0246
Schistosoma mansoni survival motor neuron protein 0.0058 0.037 0.0416
Loa Loa (eye worm) fatty acid synthase 0.0024 0.0098 0.0098
Brugia malayi regulator of G-protein signaling egl-10 0.0027 0.0122 0.0122
Brugia malayi MH1 domain containing protein 0.0043 0.0246 0.0246
Brugia malayi hypothetical protein 0.0286 0.2188 0.2188
Brugia malayi RasGEF domain containing protein 0.0019 0.006 0.006
Schistosoma mansoni NADP-specific isocitrate dehydrogenase 0.0086 0.0594 0.0668
Toxoplasma gondii type I fatty acid synthase, putative 0.0026 0.0113 0.1898
Schistosoma mansoni tar DNA-binding protein 0.1124 0.8893 1
Mycobacterium tuberculosis Phenolpthiocerol synthesis type-I polyketide synthase PpsC 0.0025 0.0101 0.1693
Schistosoma mansoni ras GTP exchange factor son of sevenless 0.0019 0.006 0.0067
Entamoeba histolytica Ras guanine nucleotide exchange factor, putative 0.0019 0.006 0.5
Echinococcus granulosus segment polarity protein dishevelled 0.0027 0.0122 0.0137
Echinococcus granulosus NADP dependent isocitrate dehydrogenase 0.0086 0.0594 0.0668
Mycobacterium leprae PHENOLPTHIOCEROL SYNTHESIS TYPE-I POLYKETIDE SYNTHASE PPSD 0.0025 0.0101 0.5094
Onchocerca volvulus 0.0043 0.0246 0.0569
Schistosoma mansoni hypothetical protein 0.04 0.3099 0.3484
Onchocerca volvulus Rap guanine nucleotide exchange factor 1 homolog 0.0019 0.006 0.0138
Brugia malayi N-terminal motif family protein 0.0552 0.4322 0.4322
Schistosoma mansoni regulator of G protein signaling 0.0027 0.0122 0.0137
Schistosoma mansoni hypothetical protein 0.04 0.3099 0.3484
Echinococcus granulosus mothers against decapentaplegic 5 0.0043 0.0246 0.0276
Brugia malayi N-terminal motif family protein 0.0019 0.006 0.006
Echinococcus granulosus mothers against decapentaplegic 2 0.0019 0.0057 0.0064
Echinococcus multilocularis rap guanine nucleotide exchange factor 6 0.0019 0.006 0.0067
Schistosoma mansoni tar DNA-binding protein 0.1124 0.8893 1
Loa Loa (eye worm) nuclear factor I 0.0024 0.0093 0.0093
Schistosoma mansoni camp-dependent rap1 guanine-nucleotide exchange factor 0.0018 0.0052 0.0059
Entamoeba histolytica Ras guanine nucleotide exchange factor, putative 0.0019 0.006 0.5
Loa Loa (eye worm) hypothetical protein 0.0024 0.0093 0.0093
Schistosoma mansoni tar DNA-binding protein 0.1124 0.8893 1
Echinococcus granulosus Smad4 0.0043 0.0246 0.0276
Schistosoma mansoni smad1 5 8 and 0.0043 0.0246 0.0276
Loa Loa (eye worm) AMP-binding enzyme family protein 0.0023 0.0088 0.0088
Entamoeba histolytica Ras guanine nucleotide exchange factor, putative 0.0019 0.006 0.5
Brugia malayi oxidoreductase, zinc-binding dehydrogenase family protein 0.0046 0.0276 0.0276
Mycobacterium ulcerans phenolpthiocerol synthesis type-I polyketide synthase PpsA 0.002 0.0062 0.3155
Loa Loa (eye worm) isocitrate dehydrogenase 0.0086 0.0594 0.0594
Chlamydia trachomatis cAMP-dependent protein kinase regulatory subunit 0.0012 0 0.5
Plasmodium vivax isocitrate dehydrogenase [NADP], mitochondrial, putative 0.0086 0.0594 1
Mycobacterium ulcerans phenolpthiocerol synthesis type-I polyketide synthase PpsD 0.0025 0.0101 0.5094
Echinococcus multilocularis NADP dependent isocitrate dehydrogenase 0.0086 0.0594 0.0668
Schistosoma mansoni hypothetical protein 0.0058 0.037 0.0416
Trichomonas vaginalis guanine nucleotide exchange factor, putative 0.0019 0.006 1
Echinococcus granulosus segment polarity protein dishevelled 0.0027 0.0122 0.0137
Mycobacterium tuberculosis Probable polyketide synthase Pks7 0.0026 0.0113 0.1898
Mycobacterium tuberculosis Probable thioesterase TesA 0.002 0.0068 0.1143
Echinococcus multilocularis cadherin EGF LAG seven pass G type receptor 0.04 0.3099 0.3484
Mycobacterium tuberculosis Polyketide synthase Pks2 0.0024 0.0095 0.1592
Brugia malayi RNA recognition motif domain containing protein 0.1124 0.8893 0.8893
Entamoeba histolytica Ras guanine nucleotide exchange factor, putative 0.0019 0.006 0.5

Activities

Activity type Activity value Assay description Source Reference
Potency (functional) = 0.005 um PUBCHEM_BIOASSAY: qHTS Assay for Enhancers of SMN2 Splice Variant Expression. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 19.9526 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) = 89.1251 um PUBCHEM_BIOASSAY: qHTS Fluorescence Polarization Assay for Inhibitors of MLL CXXC domain - DNA interaction. (Class of assay: confirmatory) [Related pubchem assays: 2698 (Summary assay.)] ChEMBL. No reference
Potency (functional) 89.1251 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) 89.1251 uM PUBCHEM_BIOASSAY: qHTS for Inhibitors of Polymerase Iota. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID588623] ChEMBL. No reference
Potency (functional) 89.1251 uM PUBCHEM_BIOASSAY: qHTS for Inhibitors of Polymerase Eta. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID588636] ChEMBL. No reference

Phenotypes

Whole-cell/tissue/organism interactions

Species name Source Reference Is orphan
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.
 
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External resources for this compound

Bibliographic References

No literature references available for this target.

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