Detailed information for compound 56016

Basic information

Technical information
  • TDR Targets ID: 56016
  • Name: 2-[2-[4-[3-(2H-tetrazol-5-yl)propoxy]phenyl]e thyl]isoindole-1,3-dione
  • MW: 377.397 | Formula: C20H19N5O3
  • H donors: 1 H acceptors: 5 LogP: 2.73 Rotable bonds: 8
    Rule of 5 violations (Lipinski): 1
  • SMILES: O=C1N(CCc2ccc(cc2)OCCCc2nn[nH]n2)C(=O)c2c1cccc2
  • InChi: 1S/C20H19N5O3/c26-19-16-4-1-2-5-17(16)20(27)25(19)12-11-14-7-9-15(10-8-14)28-13-3-6-18-21-23-24-22-18/h1-2,4-5,7-10H,3,6,11-13H2,(H,21,22,23,24)
  • InChiKey: ANEIGIGOUVTUAA-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • 2-[2-[4-[3-(2H-tetrazol-5-yl)propoxy]phenyl]ethyl]isoindoline-1,3-dione
  • 2-[2-[4-[3-(2H-1,2,3,4-tetrazol-5-yl)propoxy]phenyl]ethyl]isoindole-1,3-dione
  • 2-[2-[4-[3-(2H-tetrazol-5-yl)propoxy]phenyl]ethyl]isoindoline-1,3-quinone

Targets

Known targets for this compound

No curated genes were found associated with this compound

Predicted pathogen targets for this compound

By orthology
No druggable targets predicted by orthology data
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
Brugia malayi photoreceptor-specific nuclear receptor 0.0011 0.0016 0.0082
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.0016 0.0043 0.0301
Echinococcus multilocularis bloom syndrome protein 0.0021 0.007 0.0316
Schistosoma mansoni tar DNA-binding protein 0.0064 0.0293 0.1315
Echinococcus multilocularis ecdysone induced protein 78C 0.0011 0.0016 0.0074
Echinococcus multilocularis dnaJ subfamily B 0.0435 0.2227 1
Leishmania major DNA polymerase kappa, putative,DNA polymerase IV, putative 0.004 0.0167 0.3523
Mycobacterium ulcerans dihydrolipoamide dehydrogenase 0.0033 0.0134 0.0128
Echinococcus granulosus dnaJ subfamily B 0.0435 0.2227 1
Schistosoma mansoni retinoid-x-receptor (RXR) 0.0011 0.0016 0.0074
Echinococcus granulosus geranylgeranyl transferase type 2 subunit alpha 0.004 0.017 0.0762
Mycobacterium tuberculosis Probable dehydrogenase 0.0219 0.1103 0.1531
Brugia malayi Pyridine nucleotide-disulphide oxidoreductase, dimerisation domain containing protein 0.0024 0.0088 0.0668
Echinococcus granulosus GPCR family 2 0.0016 0.0043 0.0194
Loa Loa (eye worm) hypothetical protein 0.0011 0.0016 0.0082
Trypanosoma cruzi trypanothione reductase, putative 0.0033 0.0134 0.2803
Mycobacterium tuberculosis NAD(P)H quinone reductase LpdA 0.0244 0.123 0.1709
Brugia malayi CXXC zinc finger family protein 0.0031 0.012 0.0928
Entamoeba histolytica recQ family DNA helicase 0.0011 0.0016 0.013
Loa Loa (eye worm) Smad1 0.0017 0.0047 0.0329
Toxoplasma gondii Myb family DNA-binding domain-containing protein 0.0028 0.0109 0.0367
Leishmania major trypanothione reductase 0.0096 0.0461 1
Plasmodium vivax prenyltransferase alpha subunit, putative 0.0155 0.0767 1
Brugia malayi Nuclear hormone receptor-like 1 0.0011 0.0016 0.0082
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0011 0.0016 0.0074
Plasmodium falciparum ATP-dependent DNA helicase Q1 0.0021 0.007 0.0838
Toxoplasma gondii ATP-dependent DNA helicase, RecQ family protein 0.0021 0.007 0.0229
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.0033 0.0134 0.2803
Trichomonas vaginalis protein farnesyltransferase alpha subunit, putative 0.0155 0.0767 1
Brugia malayi Nuclear hormone receptor family member nhr-1 0.0011 0.0016 0.0082
Schistosoma mansoni thyroid hormone receptor 0.0011 0.0016 0.0074
Echinococcus multilocularis Nuclear hormone receptor family member nhr 41 0.0011 0.0016 0.0074
Plasmodium vivax DNA repair protein REV1, putative 0.0012 0.0024 0.0236
Brugia malayi RNA binding protein 0.0064 0.0293 0.235
Trypanosoma brucei DNA polymerase kappa, putative 0.004 0.0167 0.3523
Trypanosoma brucei chrX additional, unordered contigs 0.0012 0.0024 0.0395
Leishmania major DNA damage repair protein, putative 0.0012 0.0024 0.0395
Trypanosoma cruzi protein farnesyltransferase alpha subunit, putative 0.004 0.017 0.3587
Entamoeba histolytica hypothetical protein 0.0036 0.0149 0.1876
Plasmodium falciparum dihydrolipoyl dehydrogenase, apicoplast 0.0033 0.0134 0.1676
Trypanosoma brucei Protein prenyltransferase alpha subunit repeat, putative 0.004 0.017 0.3587
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0011 0.0016 0.0082
Echinococcus multilocularis pyridine nucleotide disulfide oxidoreductase 0.0009 0.0007 0.0029
Echinococcus granulosus geminin 0.0344 0.1755 0.7882
Echinococcus multilocularis dihydropyrimidine dehydrogenase (NADP+) 0.0009 0.0007 0.0029
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0011 0.0016 0.0082
Loa Loa (eye worm) nuclear hormone receptor family member nhr-1 0.0011 0.0016 0.0082
Mycobacterium tuberculosis Probable reductase 0.0219 0.1103 0.1531
Leishmania major protein farnesyltransferase alpha subunit, putative 0.004 0.017 0.3587
Echinococcus granulosus ecdysone induced protein 78C 0.0011 0.0016 0.0074
Echinococcus multilocularis COUP TF:Svp nuclear hormone receptor 0.0011 0.0016 0.0074
Schistosoma mansoni nuclear hormone receptor 0.0011 0.0016 0.0074
Brugia malayi MH1 domain containing protein 0.0017 0.0047 0.0329
Loa Loa (eye worm) hypothetical protein 0.0011 0.0016 0.0082
Entamoeba histolytica hypothetical protein 0.0036 0.0149 0.1876
Trypanosoma cruzi DNA damage repair protein, putative 0.0012 0.0024 0.0395
Brugia malayi Steroid receptor seven-up type 2 0.0011 0.0016 0.0082
Plasmodium vivax protein prenyltransferase alpha subunit, putative 0.004 0.017 0.2144
Loa Loa (eye worm) hypothetical protein 0.0011 0.0016 0.0082
Trypanosoma brucei DNA polymerase kappa, putative 0.004 0.0167 0.3523
Trypanosoma brucei DNA polymerase kappa, putative 0.004 0.0167 0.3523
Entamoeba histolytica recQ family helicase, putative 0.0021 0.007 0.0838
Trypanosoma brucei DNA polymerase kappa, putative 0.0027 0.0103 0.2115
Echinococcus multilocularis dna polymerase eta 0.0066 0.0303 0.136
Schistosoma mansoni tar DNA-binding protein 0.0064 0.0293 0.1315
Schistosoma mansoni coup transcription factor 0.0011 0.0016 0.0074
Loa Loa (eye worm) hypothetical protein 0.0034 0.0139 0.1089
Echinococcus granulosus FTZ F1 alpha 0.0011 0.0016 0.0074
Brugia malayi MH1 domain containing protein 0.0009 0.0008 0.0013
Giardia lamblia Rab geranylgeranyltransferase 0.004 0.017 0.2144
Loa Loa (eye worm) CXXC zinc finger family protein 0.0031 0.012 0.0928
Echinococcus granulosus glutamate synthase 0.0009 0.0007 0.0029
Trichomonas vaginalis MYB72, putative 0.0028 0.0108 0.1336
Plasmodium vivax ADP-dependent DNA helicase RecQ, putative 0.0011 0.0016 0.013
Schistosoma mansoni hypothetical protein 0.0016 0.0043 0.0194
Trypanosoma brucei DNA polymerase kappa, putative 0.004 0.0167 0.3523
Trichomonas vaginalis r2r3-MYB transcription factor, putative 0.0028 0.0108 0.1336
Schistosoma mansoni cpg binding protein 0.0032 0.0129 0.0578
Trypanosoma brucei hypothetical protein, conserved 0.004 0.017 0.3587
Schistosoma mansoni transcription factor LCR-F1 0.0036 0.0149 0.067
Schistosoma mansoni sulfide quinone reductase 0.0009 0.0007 0.0029
Brugia malayi Thioredoxin reductase 0.0096 0.0461 0.3732
Loa Loa (eye worm) glutathione reductase 0.0096 0.0461 0.3732
Trypanosoma brucei DNA damage repair protein, putative 0.0012 0.0024 0.0395
Loa Loa (eye worm) hypothetical protein 0.0011 0.0016 0.0082
Trichomonas vaginalis pc-MYB2, putative 0.0028 0.0108 0.1336
Echinococcus granulosus NADPH:adrenodoxin oxidoreductase 0.0009 0.0007 0.0029
Schistosoma mansoni hypothetical protein 0.0016 0.0043 0.0194
Echinococcus granulosus FTZ F1 nuclear receptor protein 0.0011 0.0016 0.0074
Trichomonas vaginalis DNA polymerase eta, putative 0.004 0.0167 0.2106
Trypanosoma cruzi DNA polymerase kappa, putative 0.004 0.0167 0.3523
Schistosoma mansoni nuclear receptor 2DBD-gamma 0.0011 0.0016 0.0074
Mycobacterium tuberculosis Probable UDP-N-acetylglucosamine 1-carboxyvinyltransferase MurA 0.1383 0.717 1
Trypanosoma cruzi ATP-dependent DEAD/H DNA helicase recQ, putative 0.0011 0.0016 0.0218
Mycobacterium tuberculosis Conserved hypothetical protein 0.004 0.0167 0.0224
Echinococcus granulosus ATP dependent DNA helicase Q1 0.0021 0.007 0.0316
Echinococcus multilocularis ATP dependent DNA helicase Q1 0.0021 0.007 0.0316
Trypanosoma brucei trypanothione reductase 0.0096 0.0461 1
Loa Loa (eye worm) TAR-binding protein 0.0064 0.0293 0.235
Schistosoma mansoni glutamate synthase 0.0009 0.0007 0.0029
Treponema pallidum ATP-dependent DNA helicase 0.0011 0.0016 0.001
Schistosoma mansoni cpg binding protein 0.0032 0.0129 0.0578
Echinococcus multilocularis ATP dependent DNA helicase Q5 0.0021 0.007 0.0316
Plasmodium falciparum DNA repair protein REV1, putative 0.0012 0.0024 0.0236
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.0016 0.0043 0.0194
Schistosoma mansoni hypothetical protein 0.0435 0.2227 1
Giardia lamblia DNA damage repair protein 0.0012 0.0024 0.0236
Echinococcus multilocularis tar DNA binding protein 0.0064 0.0293 0.1315
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.0033 0.0134 0.2803
Trypanosoma brucei DNA polymerase IV, putative 0.004 0.0167 0.3523
Brugia malayi alpha keto acid dehydrogenase complex, E3 component, lipoamide dehydrogenase 0.0024 0.0088 0.0668
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0011 0.0016 0.0074
Brugia malayi polk-prov protein 0.0012 0.0024 0.0147
Echinococcus multilocularis GPCR, family 2 0.0016 0.0043 0.0194
Toxoplasma gondii BRCA1 C Terminus (BRCT) domain-containing protein 0.0012 0.0024 0.0065
Trypanosoma brucei dihydrolipoamide dehydrogenase 0.0033 0.0134 0.2803
Echinococcus granulosus thioredoxin glutathione reductase 0.0096 0.0461 0.2072
Entamoeba histolytica deoxycytidyl transferase, putative 0.004 0.0167 0.2106
Brugia malayi Calcitonin receptor-like protein seb-1 0.005 0.0222 0.1769
Toxoplasma gondii hypothetical protein 0.0115 0.0558 0.1982
Brugia malayi MH1 domain containing protein 0.0009 0.0008 0.0013
Treponema pallidum NADH oxidase 0.0033 0.0134 0.0128
Wolbachia endosymbiont of Brugia malayi UDP-N-acetylglucosamine 1-carboxyvinyltransferase 0.1925 1 1
Schistosoma mansoni hypothetical protein 0.0344 0.1755 0.7882
Toxoplasma gondii hypothetical protein 0.004 0.017 0.0586
Loa Loa (eye worm) nuclear hormone receptor family member nhr-40 0.0011 0.0016 0.0082
Schistosoma mansoni smad1 5 8 and 0.0017 0.0047 0.0209
Plasmodium falciparum thioredoxin reductase 0.0096 0.0461 0.5977
Brugia malayi ecdysteroid receptor 0.0011 0.0016 0.0082
Trypanosoma brucei DNA polymerase kappa, putative 0.0012 0.0024 0.0395
Echinococcus granulosus Nuclear hormone receptor family member nhr 41 0.0011 0.0016 0.0074
Brugia malayi MH2 domain containing protein 0.0243 0.1225 1
Toxoplasma gondii ATP-dependent DNA helicase, RecQ family protein 0.0011 0.0016 0.0036
Brugia malayi Nuclear hormone receptor family member nhr-40 0.0011 0.0016 0.0082
Echinococcus granulosus pyridine nucleotide disulfide oxidoreductase 0.0009 0.0007 0.0029
Brugia malayi latrophilin 2 splice variant baaae 0.0034 0.0139 0.1089
Brugia malayi Protein prenyltransferase alpha subunit repeat containing protein 0.0155 0.0767 0.6245
Toxoplasma gondii shikimate dehydrogenase substrate binding domain-containing protein 0.0543 0.2791 1
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.0033 0.0134 0.2803
Trichomonas vaginalis r2r3-MYB transcription factor, putative 0.0028 0.0109 0.1345
Schistosoma mansoni Tr4/Tr2 (homologue) 0.0011 0.0016 0.0074
Plasmodium falciparum protein farnesyltransferase subunit alpha 0.0155 0.0767 1
Mycobacterium tuberculosis Dihydrolipoamide dehydrogenase LpdC (lipoamide reductase (NADH)) (lipoyl dehydrogenase) (dihydrolipoyl dehydrogenase) (diaphoras 0.0244 0.123 0.1709
Leishmania major 2-oxoglutarate dehydrogenase, e3 component, lipoamidedehydrogenase-like protein 0.0033 0.0134 0.2803
Echinococcus multilocularis protein prenyltransferase alpha subunit 0.004 0.017 0.0762
Echinococcus granulosus mothers against decapentaplegic 5 0.0017 0.0047 0.0209
Leishmania major DNA polymerase kappa, putative 0.004 0.0167 0.3523
Plasmodium falciparum glutathione reductase 0.0033 0.0134 0.1676
Trypanosoma brucei Protein prenyltransferase alpha subunit repeat, putative 0.004 0.017 0.3587
Leishmania major ATP-dependent DEAD/H DNA helicase recQ, putative 0.0021 0.007 0.1402
Trypanosoma cruzi DNA polymerase eta, putative 0.0038 0.0161 0.3389
Onchocerca volvulus Protein ultraspiracle homolog 0.0011 0.0016 0.0609
Echinococcus multilocularis protein farnesyltransferase alpha subunit 0.0155 0.0767 0.3446
Echinococcus granulosus dihydrolipoamide dehydrogenase 0.0033 0.0134 0.0602
Loa Loa (eye worm) hypothetical protein 0.0011 0.0016 0.0081
Trypanosoma cruzi dihydrolipoyl dehydrogenase, putative 0.0033 0.0134 0.2803
Onchocerca volvulus Steroid hormone receptor family member cnr14 homolog 0.0011 0.0016 0.0609
Loa Loa (eye worm) nuclear hormone receptor family member nhr-41 0.0011 0.0016 0.0082
Loa Loa (eye worm) RNA binding protein 0.0064 0.0293 0.235
Trypanosoma brucei unspecified product 0.0027 0.0103 0.2115
Mycobacterium tuberculosis Probable membrane NADH dehydrogenase NdhA 0.0219 0.1103 0.1531
Chlamydia trachomatis dihydrolipoyl dehydrogenase 0.0033 0.0134 0.0128
Loa Loa (eye worm) hypothetical protein 0.0011 0.0016 0.0082
Echinococcus granulosus cadherin EGF LAG seven pass G type receptor 0.0016 0.0043 0.0194
Trypanosoma cruzi DNA polymerase kappa, putative 0.004 0.0167 0.3523
Schistosoma mansoni Smad4 0.0017 0.0047 0.0209
Onchocerca volvulus 0.004 0.017 1
Giardia lamblia Myb 1-like protein 0.0028 0.0109 0.1345
Plasmodium vivax glutathione reductase, putative 0.0096 0.0461 0.5977
Trypanosoma brucei dihydrolipoamide dehydrogenase, point mutation 0.0033 0.0134 0.2803
Trypanosoma brucei DNA polymerase kappa, putative 0.004 0.0167 0.3523
Trypanosoma cruzi hypothetical protein, conserved 0.004 0.017 0.3587
Schistosoma mansoni blooms syndrome DNA helicase 0.0011 0.0016 0.0074
Leishmania major dihydrolipoamide dehydrogenase, putative 0.0033 0.0134 0.2803
Echinococcus multilocularis cadherin EGF LAG seven pass G type receptor 0.0016 0.0043 0.0194
Schistosoma mansoni terminal deoxycytidyl transferase 0.004 0.0167 0.0749
Loa Loa (eye worm) nuclear hormone receptor family member nhr-14 0.0011 0.0016 0.0082
Loa Loa (eye worm) thioredoxin reductase 0.0096 0.0461 0.3732
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.005 0.0222 0.1769
Leishmania major DNA polymerase eta, putative 0.0038 0.0161 0.3389
Onchocerca volvulus Bile acid receptor homolog 0.0011 0.0016 0.0609
Trichomonas vaginalis glutathione reductase, putative 0.0033 0.0134 0.1676
Schistosoma mansoni steroid hormone receptor ad4bp 0.0011 0.0016 0.0074
Trypanosoma brucei DNA polymerase kappa, putative 0.0012 0.0024 0.0395
Echinococcus multilocularis dihydrolipoamide dehydrogenase 0.0033 0.0134 0.0602
Plasmodium vivax ATP-dependent DNA helicase Q1, putative 0.001 0.0014 0.0102
Loa Loa (eye worm) MH1 domain-containing protein 0.0017 0.0047 0.0329
Trypanosoma brucei DNA polymerase kappa, putative 0.004 0.0167 0.3523
Trichomonas vaginalis r2r3-MYB transcription factor, putative 0.0028 0.0108 0.1336
Schistosoma mansoni smad1 5 8 and 0.0017 0.0047 0.0209
Loa Loa (eye worm) MH2 domain-containing protein 0.0017 0.0047 0.0329
Schistosoma mansoni glutamate synthase 0.0009 0.0007 0.0029
Loa Loa (eye worm) ATP-dependent DNA helicase 0.0021 0.007 0.0523
Trypanosoma brucei hypothetical protein, conserved 0.0012 0.0024 0.0395
Brugia malayi steroid hormone receptor 0.0011 0.0016 0.0082
Mycobacterium tuberculosis Probable soluble pyridine nucleotide transhydrogenase SthA (STH) (NAD(P)(+) transhydrogenase [B-specific]) (nicotinamide nucleot 0.0033 0.0134 0.0178
Onchocerca volvulus 0.0011 0.0016 0.0609
Loa Loa (eye worm) histone methyltransferase 0.0009 0.001 0.0026
Echinococcus multilocularis mothers against decapentaplegic 5 0.0017 0.0047 0.0209
Echinococcus granulosus bloom syndrome protein 0.0021 0.007 0.0316
Brugia malayi Smad1 0.0017 0.0047 0.0329
Schistosoma mansoni DNA polymerase eta 0.0066 0.0303 0.136
Schistosoma mansoni hypothetical protein 0.0016 0.0043 0.0194
Brugia malayi MH1 domain containing protein 0.0017 0.0047 0.0329
Brugia malayi Nuclear hormone receptor family member nhr-14 0.0011 0.0016 0.0082
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0011 0.0016 0.0082
Loa Loa (eye worm) nuclear factor I 0.0009 0.0008 0.0013
Trichomonas vaginalis MYB3r3, putative 0.0028 0.0108 0.1336
Schistosoma mansoni tar DNA-binding protein 0.0064 0.0293 0.1315
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0011 0.0016 0.0082
Brugia malayi nuclear hormone receptor 0.0011 0.0016 0.0082
Echinococcus multilocularis apoptosis inducing factor 1 mitochondrial 0.0009 0.0007 0.0029
Brugia malayi glutathione reductase 0.0096 0.0461 0.3732
Brugia malayi ImpB/MucB/SamB family protein 0.004 0.0167 0.1315
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.0064 0.0293 0.235
Brugia malayi nuclear receptor NHR-88 0.0011 0.0016 0.0082
Trypanosoma cruzi ATP-dependent DEAD/H DNA helicase recQ, putative 0.0011 0.0016 0.0218
Brugia malayi Latrophilin receptor protein 2 0.0016 0.0043 0.0301
Mycobacterium ulcerans hypothetical protein 0.0012 0.0024 0.0018
Echinococcus multilocularis geminin 0.0344 0.1755 0.7882
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.0016 0.0043 0.0194
Toxoplasma gondii histone lysine methyltransferase SET1 0.0058 0.0262 0.0917
Schistosoma mansoni retinoic acid receptor RXR 0.0011 0.0016 0.0074
Echinococcus multilocularis terminal deoxycytidyl transferase rev1 0.004 0.0167 0.0749
Echinococcus granulosus retinoic acid receptor rxr beta a 0.0011 0.0016 0.0074
Brugia malayi RNA recognition motif domain containing protein 0.0064 0.0293 0.235
Trichomonas vaginalis C-MYB, putative 0.0028 0.0108 0.1336
Mycobacterium leprae probable 3-phosphoshikimate 1-carboxyvinyl transferase AroA (5-ENOLPYRUVYLSHIKIMATE-3-PHOSPHATE SYNTHASE) (EPSP SYNTHASE) (EPSPS 0.0543 0.2791 0.3887
Schistosoma mansoni tar DNA-binding protein 0.0064 0.0293 0.1315
Loa Loa (eye worm) prenyltransferase alpha subunit repeat containing protein 0.004 0.017 0.1339
Mycobacterium tuberculosis NADPH-dependent mycothiol reductase Mtr 0.0096 0.0461 0.0635
Schistosoma mansoni blooms syndrome DNA helicase 0.001 0.0014 0.0064
Echinococcus multilocularis geranylgeranyl transferase type 2 subunit alpha 0.004 0.017 0.0762
Trichomonas vaginalis mercuric reductase, putative 0.0033 0.0134 0.1676
Trypanosoma brucei DNA polymerase IV, putative 0.004 0.0167 0.3523
Plasmodium vivax thioredoxin reductase, putative 0.0096 0.0461 0.5977
Mycobacterium leprae DIHYDROLIPOAMIDE DEHYDROGENASE LPD (LIPOAMIDE REDUCTASE (NADH)) (LIPOYL DEHYDROGENASE) (DIHYDROLIPOYL DEHYDROGENASE) (DIAPHORASE 0.0244 0.123 0.1709
Trypanosoma cruzi DNA damage repair protein, putative 0.0012 0.0024 0.0395
Trichomonas vaginalis C-MYB, putative 0.0028 0.0108 0.1336
Echinococcus multilocularis thioredoxin glutathione reductase 0.0096 0.0461 0.2072
Mycobacterium tuberculosis Probable nitrite reductase [NAD(P)H] large subunit [FAD flavoprotein] NirB 0.0219 0.1103 0.1531
Echinococcus granulosus Smad4 0.0017 0.0047 0.0209
Trypanosoma brucei hypothetical protein, conserved 0.0012 0.0024 0.0395
Schistosoma mansoni protein farnesyltransferase alpha subunit 0.0155 0.0767 0.3446
Leishmania major dihydrolipoamide dehydrogenase, putative 0.0033 0.0134 0.2803
Mycobacterium ulcerans 3-phosphoshikimate 1-carboxyvinyltransferase 0.0543 0.2791 0.2786
Entamoeba histolytica protein farnesyltransferase alpha subunit, putative 0.0155 0.0767 1
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.0033 0.0134 0.2803
Wolbachia endosymbiont of Brugia malayi dihydrolipoamide dehydrogenase E3 component 0.0033 0.0134 0.0128
Schistosoma mansoni smad1 5 8 and 0.0017 0.0047 0.0209
Echinococcus granulosus tar DNA binding protein 0.0064 0.0293 0.1315
Echinococcus multilocularis hepatocyte nuclear factor 4 alpha 0.0011 0.0016 0.0074
Brugia malayi Bloom's syndrome protein homolog 0.0021 0.007 0.0523
Schistosoma mansoni FTZ-F1 nuclear receptor-like protein 0.0011 0.0016 0.0074
Schistosoma mansoni nuclear hormone receptor nor-1/nor-2 0.0011 0.0016 0.0074
Trypanosoma brucei unspecified product 0.004 0.0167 0.3523
Echinococcus multilocularis dna polymerase kappa 0.004 0.0167 0.0749
Schistosoma mansoni smad 0.0017 0.0047 0.0209
Trypanosoma brucei DNA polymerase kappa, putative 0.004 0.0167 0.3523
Leishmania major acetoin dehydrogenase e3 component-like protein 0.0033 0.0134 0.2803
Schistosoma mansoni thyroid hormone receptor 0.0011 0.0016 0.0074
Echinococcus granulosus TGF beta signal transducer SmadC 0.0017 0.0047 0.0209
Echinococcus multilocularis TGF beta signal transducer SmadC 0.0017 0.0047 0.0209
Mycobacterium leprae PROBABLE UDP-N-ACETYLGLUCOSAMINE 1-CARBOXYVINYLTRANSFERASE MURA 0.1383 0.717 1
Onchocerca volvulus 0.0031 0.012 0.693
Schistosoma mansoni hypothetical protein 0.0016 0.0043 0.0194
Brugia malayi dihydrolipoyl dehydrogenase, mitochondrial precursor, putative 0.0033 0.0134 0.1046
Trichomonas vaginalis r2r3-MYB transcription factor, putative 0.0028 0.0108 0.1336
Plasmodium falciparum glutathione reductase 0.0096 0.0461 0.5977
Trypanosoma cruzi DNA polymerase eta, putative 0.0066 0.0303 0.6517
Entamoeba histolytica myb-like DNA-binding domain containing protein 0.0028 0.0108 0.1336
Trypanosoma brucei DNA polymerase IV, putative 0.004 0.0167 0.3523
Toxoplasma gondii ATP-dependent DNA helicase, RecQ family protein 0.001 0.0014 0.0028
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0065 0.0298 0.1338
Loa Loa (eye worm) nuclear hormone receptor family member nhr-49 0.0011 0.0016 0.0082
Brugia malayi TAR-binding protein 0.0064 0.0293 0.235
Brugia malayi Nuclear hormone receptor family member nhr-31 0.0011 0.0016 0.0082
Chlamydia trachomatis phosphoshikimate 1-carboxyl vinyltransferase 0.0543 0.2791 0.2786
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.0033 0.0134 0.2803
Plasmodium vivax dihydrolipoyl dehydrogenase, mitochondrial, putative 0.0033 0.0134 0.1676
Mycobacterium ulcerans UDP-N-acetylglucosamine 1-carboxyvinyltransferase 0.1925 1 1
Echinococcus multilocularis histone lysine N methyltransferase MLL3 0.0009 0.001 0.0044
Plasmodium falciparum geranylgeranyl transferase type-2 subunit alpha, putative 0.004 0.017 0.2144
Echinococcus granulosus dna polymerase kappa 0.004 0.0167 0.0749
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0036 0.0149 0.067
Trypanosoma brucei unspecified product 0.0027 0.0103 0.2115
Trypanosoma brucei ATP-dependent DEAD/H DNA helicase recQ, putative 0.0021 0.007 0.1402
Loa Loa (eye worm) steroid hormone receptor 0.0011 0.0016 0.0082
Echinococcus granulosus protein prenyltransferase alpha subunit 0.004 0.017 0.0762
Schistosoma mansoni sulfide quinone reductase 0.0009 0.0007 0.0029
Loa Loa (eye worm) hypothetical protein 0.0011 0.0016 0.0082
Trypanosoma brucei DNA polymerase kappa, putative 0.0027 0.0103 0.2115
Brugia malayi F/Y-rich N-terminus family protein 0.0009 0.0009 0.0021
Toxoplasma gondii pyruvate dehydrogenase complex subunit PDH-E3II 0.0033 0.0134 0.0458
Brugia malayi ATP-dependent DNA helicase, RecQ family protein 0.0021 0.007 0.0523
Loa Loa (eye worm) hypothetical protein 0.0009 0.0008 0.0013
Treponema pallidum UDP-N-acetylglucosamine 1-carboxyvinyltransferase 0.1925 1 1
Plasmodium falciparum ADP-dependent DNA helicase RecQ 0.0021 0.007 0.0838
Brugia malayi Protein prenyltransferase alpha subunit repeat containing protein 0.004 0.017 0.1339
Schistosoma mansoni photoreceptor-specific nuclear receptor related 0.0011 0.0016 0.0074
Trypanosoma cruzi hypothetical protein, conserved 0.004 0.017 0.3587
Mycobacterium tuberculosis Putative ferredoxin reductase 0.0219 0.1103 0.1531
Trichomonas vaginalis DNA helicase recq, putative 0.0021 0.007 0.0838
Trichomonas vaginalis DNA helicase recq1, putative 0.0021 0.007 0.0838
Echinococcus granulosus smad 0.0017 0.0047 0.0209
Echinococcus multilocularis FTZ F1 nuclear receptor protein 0.0011 0.0016 0.0074
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0011 0.0016 0.0082
Echinococcus granulosus dihydropyrimidine dehydrogenase NADP 0.0009 0.0007 0.0029
Entamoeba histolytica myb-like DNA-binding domain containing protein 0.0028 0.0108 0.1336
Trypanosoma cruzi protein farnesyltransferase alpha subunit, putative 0.004 0.017 0.3587
Brugia malayi Nuclear hormone receptor family member nhr-3 0.0011 0.0016 0.0082
Plasmodium falciparum dihydrolipoyl dehydrogenase, mitochondrial 0.0033 0.0134 0.1676
Schistosoma mansoni cpg binding protein 0.0031 0.012 0.0537
Loa Loa (eye worm) hypothetical protein 0.0021 0.007 0.0523
Trypanosoma cruzi ATP-dependent DEAD/H DNA helicase recQ, putative 0.0021 0.007 0.1402
Loa Loa (eye worm) prenyltransferase alpha subunit repeat containing protein 0.0155 0.0767 0.6245
Wolbachia endosymbiont of Brugia malayi dihydrolipoamide dehydrogenase E3 component 0.0033 0.0134 0.0128
Echinococcus granulosus histone lysine N methyltransferase MLL3 0.0009 0.001 0.0044
Schistosoma mansoni disulfide oxidoreductase 0.0009 0.0007 0.0029
Leishmania major DNA polymerase eta, putative 0.0066 0.0303 0.6517
Entamoeba histolytica myb-like DNA-binding domain containing protein 0.0028 0.0108 0.1336
Toxoplasma gondii ImpB/MucB/SamB family protein 0.0038 0.0161 0.0554
Entamoeba histolytica recQ family helicase, putative 0.001 0.0014 0.0102
Mycobacterium ulcerans flavoprotein disulfide reductase 0.0033 0.0134 0.0128
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0011 0.0016 0.0074
Mycobacterium ulcerans DNA polymerase IV 0.004 0.0167 0.016
Schistosoma mansoni dihydrolipoamide dehydrogenase 0.0033 0.0134 0.0602
Echinococcus multilocularis thyroid hormone receptor alpha 0.0011 0.0016 0.0074
Echinococcus granulosus protein farnesyltransferase alpha subunit 0.0155 0.0767 0.3446
Trichomonas vaginalis protein farnesyltransferase alpha subunit/RAB geranylgeranyl transferase alpha subunit, putative 0.0155 0.0767 1
Trypanosoma brucei DNA polymerase kappa, putative 0.004 0.0167 0.3523
Trypanosoma brucei DNA polymerase eta, putative 0.0066 0.0303 0.6517
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0036 0.0149 0.067
Echinococcus multilocularis NADPH:adrenodoxin oxidoreductase 0.0009 0.0007 0.0029
Echinococcus multilocularis cpg binding protein 0.0032 0.0129 0.0578
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0011 0.0016 0.0074
Loa Loa (eye worm) transcription factor SMAD2 0.0243 0.1225 1
Brugia malayi Nuclear hormone receptor family member nhr-41 0.0011 0.0016 0.0082
Trypanosoma cruzi trypanothione reductase, putative 0.0096 0.0461 1
Trichomonas vaginalis protein farnesyltransferase alpha subunit, putative 0.0155 0.0767 1
Plasmodium falciparum thioredoxin reductase 0.0033 0.0134 0.1676
Entamoeba histolytica myb-like DNA-binding domain containing protein 0.0028 0.0108 0.1336
Loa Loa (eye worm) MH2 domain-containing protein 0.0243 0.1225 1
Echinococcus multilocularis smad 0.0017 0.0047 0.0209
Trypanosoma cruzi hypothetical protein, conserved 0.0012 0.0024 0.0395
Loa Loa (eye worm) nuclear hormone receptor family member nhr-31 0.0011 0.0016 0.0082
Schistosoma mansoni DNA polymerase IV / kappa 0.0012 0.0024 0.011
Giardia lamblia NADH oxidase lateral transfer candidate 0.0033 0.0134 0.1676
Trypanosoma cruzi dihydrolipoyl dehydrogenase, putative 0.0033 0.0134 0.2803
Echinococcus granulosus ATP dependent DNA helicase Q5 0.0021 0.007 0.0316
Giardia lamblia DINP protein human, muc B family 0.004 0.0167 0.2106
Trypanosoma brucei DNA polymerase kappa, putative 0.004 0.0167 0.3523
Entamoeba histolytica hypothetical protein 0.0036 0.0149 0.1876
Trichomonas vaginalis r2r3-MYB transcription factor, putative 0.0028 0.0108 0.1336
Trichomonas vaginalis r2r3-MYB transcription factor, putative 0.0028 0.0108 0.1336
Schistosoma mansoni rab geranylgeranyl transferase alpha subunit 0.008 0.0376 0.1688
Trypanosoma brucei DNA damage repair protein, putative 0.0012 0.0024 0.0395
Mycobacterium ulcerans dihydrolipoamide dehydrogenase, LpdB 0.0033 0.0134 0.0128
Echinococcus granulosus terminal deoxycytidyl transferase rev1 0.004 0.0167 0.0749
Loa Loa (eye worm) ImpB/MucB/SamB family protein 0.004 0.0167 0.1315
Schistosoma mansoni tar DNA-binding protein 0.0064 0.0293 0.1315
Schistosoma mansoni hypothetical protein 0.0344 0.1755 0.7882
Trypanosoma brucei DNA polymerase kappa, putative 0.0027 0.0103 0.2115
Trichomonas vaginalis r2r3-MYB transcription factor, putative 0.0028 0.0109 0.1345
Mycobacterium tuberculosis Possible DNA-damage-inducible protein P DinP (DNA polymerase V) (pol IV 2) (DNA nucleotidyltransferase (DNA-directed)) 0.004 0.0167 0.0224
Echinococcus multilocularis sulfide:quinone oxidoreductase 0.0009 0.0007 0.0029
Trypanosoma cruzi hypothetical protein, conserved 0.0012 0.0024 0.0395
Loa Loa (eye worm) hypothetical protein 0.0011 0.0016 0.0082
Entamoeba histolytica myb-like DNA-binding domain containing protein 0.0028 0.0108 0.1336
Loa Loa (eye worm) nuclear Hormone Receptor family member 0.0011 0.0016 0.0082
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0011 0.0016 0.0082
Loa Loa (eye worm) hypothetical protein 0.0066 0.0303 0.2432
Echinococcus granulosus sulfide:quinone oxidoreductase 0.0009 0.0007 0.0029
Echinococcus multilocularis glutamate synthase 0.0009 0.0007 0.0029
Leishmania major DNA polymerase kappa, putative 0.0012 0.0024 0.0395
Brugia malayi Nuclear hormone receptor family member nhr-49 0.0011 0.0016 0.0082
Schistosoma mansoni TGF-beta signal transducer Smad2 0.0017 0.0047 0.0209
Schistosoma mansoni hypothetical protein 0.0009 0.0007 0.0029
Toxoplasma gondii NADPH-glutathione reductase 0.0033 0.0134 0.0458
Mycobacterium leprae PROBABLE NADH DEHYDROGENASE NDH 0.0219 0.1103 0.1531
Entamoeba histolytica Rab geranylgeranyltransferase alpha subunit, putative 0.004 0.017 0.2144
Echinococcus granulosus cpg binding protein 0.0032 0.0129 0.0578
Echinococcus granulosus dihydropyrimidine dehydrogenase NADP 0.0009 0.0007 0.0029
Echinococcus multilocularis FTZ F1 alpha 0.0011 0.0016 0.0074
Trypanosoma brucei dihydrolipoyl dehydrogenase 0.0033 0.0134 0.2803
Trichomonas vaginalis protein farnesyltransferase alpha subunit/RAB geranylgeranyl transferase alpha subunit, putative 0.0115 0.0558 0.725
Brugia malayi MH2 domain containing protein 0.0017 0.0047 0.0329
Toxoplasma gondii ImpB/MucB/SamB family protein 0.0012 0.0024 0.0065
Toxoplasma gondii ATP-dependent DNA helicase, RecQ family protein 0.0021 0.007 0.0229
Trichomonas vaginalis MYB, putative 0.0028 0.0109 0.1345
Trypanosoma brucei DNA polymerase kappa, putative 0.004 0.0167 0.3523
Loa Loa (eye worm) pigment dispersing factor receptor c 0.005 0.0222 0.1769
Schistosoma mansoni DNA helicase recq1 0.0021 0.007 0.0316
Schistosoma mansoni glutamate synthase 0.0009 0.0007 0.0029
Loa Loa (eye worm) hypothetical protein 0.0012 0.0024 0.0147
Loa Loa (eye worm) hypothetical protein 0.0011 0.0016 0.0082
Giardia lamblia Sgs1 DNA helicase, putative 0.0021 0.007 0.0838
Brugia malayi ATP-dependent DNA helicase, RecQ family protein 0.0021 0.007 0.0523
Echinococcus granulosus dna polymerase eta 0.0066 0.0303 0.136
Trypanosoma brucei protein farnesyltransferase alpha subunit, putative 0.004 0.017 0.3587
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.0033 0.0134 0.2803
Loa Loa (eye worm) hypothetical protein 0.005 0.0222 0.1769
Brugia malayi MH2 domain containing protein 0.0017 0.0047 0.0329
Trichomonas vaginalis pc-MYB2, putative 0.0028 0.0108 0.1336
Trypanosoma cruzi DNA polymerase kappa, putative 0.004 0.0167 0.3523
Brugia malayi hypothetical protein 0.0036 0.0149 0.1171
Echinococcus granulosus hepatocyte nuclear factor 4 alpha 0.0011 0.0016 0.0074
Mycobacterium tuberculosis Probable oxidoreductase 0.0244 0.123 0.1709
Trypanosoma cruzi Protein prenyltransferase alpha subunit repeat, putative 0.004 0.017 0.3587
Loa Loa (eye worm) RecQ helicase 0.0021 0.007 0.0523
Entamoeba histolytica hypothetical protein 0.0036 0.0149 0.1876
Loa Loa (eye worm) hypothetical protein 0.0155 0.0767 0.6245
Schistosoma mansoni DNA helicase recq5 0.0021 0.007 0.0316
Brugia malayi ImpB/MucB/SamB family protein 0.0066 0.0303 0.2432
Trypanosoma brucei dihydrolipoamide dehydrogenase 0.0033 0.0134 0.2803
Schistosoma mansoni hypothetical protein 0.0034 0.0139 0.0625
Plasmodium vivax dihydrolipoyl dehydrogenase, apicoplast, putative 0.0033 0.0134 0.1676
Mycobacterium ulcerans DNA polymerase IV 0.004 0.0167 0.016
Trichomonas vaginalis DNA helicase recq, putative 0.0021 0.007 0.0838
Trypanosoma cruzi DNA polymerase kappa, putative 0.004 0.0167 0.3523
Echinococcus multilocularis Smad4 0.0017 0.0047 0.0209
Echinococcus granulosus COUP TF:Svp nuclear hormone receptor 0.0011 0.0016 0.0074
Echinococcus granulosus apoptosis inducing factor 1 mitochondrial 0.0009 0.0007 0.0029
Trichomonas vaginalis r2r3-MYB transcription factor, putative 0.0028 0.0108 0.1336
Schistosoma mansoni RAR-like nuclear receptor 0.0011 0.0016 0.0074
Loa Loa (eye worm) hypothetical protein 0.0016 0.0043 0.0301
Loa Loa (eye worm) hypothetical protein 0.0011 0.0016 0.0081
Trichomonas vaginalis protein farnesyltransferase alpha subunit, putative 0.004 0.017 0.2144
Trichomonas vaginalis DNA polymerase IV / kappa, putative 0.004 0.0167 0.2106
Toxoplasma gondii thioredoxin reductase 0.0096 0.0461 0.1633
Mycobacterium tuberculosis Probable NADH dehydrogenase Ndh 0.0219 0.1103 0.1531
Giardia lamblia Rab geranylgeranyltransferase 0.0155 0.0767 1
Echinococcus multilocularis dihydropyrimidine dehydrogenase (NADP+) 0.0009 0.0007 0.0029
Loa Loa (eye worm) latrophilin receptor protein 2 0.0016 0.0043 0.0301
Schistosoma mansoni hypothetical protein 0.0036 0.0149 0.067

Activities

Activity type Activity value Assay description Source Reference
Contraction (functional) = 52.4 % Inhibitory contractile effect of compound in guinea-pig tracheal strips induced by LTD4 (100 nM) (% contraction, obtained in the vehicle presence 100.0%) ChEMBL. 12031336
Emax (functional) = 100 % Maximum effect of the compound on the LTD4 (100 nM) induced contraction of guinea-pig tracheal strips bioassay ChEMBL. 12031336
IC50 (functional) = 0.0000312 M 50% inhibitory concentration on the LTD4 (100 nM) induced contraction of guinea-pig tracheal strip bioassay ChEMBL. 12031336
Inhibition (functional) = 47.6 % Inhibitory contractile effect of compound in guinea-pig tracheal strips induced by LTD4 (100 nM) (% inhibition obtained by comparison with control group) ChEMBL. 12031336

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

1 literature reference was collected for this gene.

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