Detailed information for compound 15700

Basic information

Technical information
  • TDR Targets ID: 15700
  • Name: 2-[4-[(2-ethyl-5,7-dimethylimidazo[4,5-b]pyri din-3-yl)methyl]-2-propylphenoxy]-2-phenylace tic acid
  • MW: 457.564 | Formula: C28H31N3O3
  • H donors: 1 H acceptors: 4 LogP: 6.49 Rotable bonds: 9
    Rule of 5 violations (Lipinski): 1
  • SMILES: CCCc1cc(ccc1OC(c1ccccc1)C(=O)O)Cn1c(CC)nc2c1nc(C)cc2C
  • InChi: 1S/C28H31N3O3/c1-5-10-22-16-20(13-14-23(22)34-26(28(32)33)21-11-8-7-9-12-21)17-31-24(6-2)30-25-18(3)15-19(4)29-27(25)31/h7-9,11-16,26H,5-6,10,17H2,1-4H3,(H,32,33)
  • InChiKey: IFUYEJOQMQZCAE-UHFFFAOYSA-N  

Network

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Synonyms

  • 2-[4-[(2-ethyl-5,7-dimethyl-imidazo[4,5-b]pyridin-3-yl)methyl]-2-propyl-phenoxy]-2-phenyl-acetic acid
  • 2-[4-[(2-ethyl-5,7-dimethyl-3-imidazo[4,5-b]pyridinyl)methyl]-2-propylphenoxy]-2-phenylacetic acid
  • 2-[4-[(2-ethyl-5,7-dimethyl-imidazo[4,5-b]pyridin-3-yl)methyl]-2-propyl-phenoxy]-2-phenyl-ethanoic acid
  • 2-[4-[(2-ethyl-5,7-dimethylimidazo[5,4-b]pyridin-3-yl)methyl]-2-propylphenoxy]-2-phenylacetic acid
  • 2-[4-[(2-ethyl-5,7-dimethyl-imidazo[5,4-b]pyridin-3-yl)methyl]-2-propyl-phenoxy]-2-phenyl-acetic acid
  • 2-[4-[(2-ethyl-5,7-dimethyl-3-imidazo[5,4-b]pyridinyl)methyl]-2-propylphenoxy]-2-phenylacetic acid
  • 2-[4-[(2-ethyl-5,7-dimethyl-imidazo[5,4-b]pyridin-3-yl)methyl]-2-propyl-phenoxy]-2-phenyl-ethanoic acid

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Oryctolagus cuniculus Angiotensin II type 1a (AT-1a) receptor Starlite/ChEMBL No references
Rattus norvegicus Angiotensin II type 2 (AT-2) receptor Starlite/ChEMBL No references
Homo sapiens endothelin receptor type B Starlite/ChEMBL No references

Predicted pathogen targets for this compound

By orthology
No druggable targets predicted by orthology data
By sequence similarity to non orthologous known druggable targets
Species Potential target Known druggable target Length Alignment span Identity
Echinococcus multilocularis allatostatin A receptor Angiotensin II type 2 (AT-2) receptor   363 aa 342 aa 24.6 %
Onchocerca volvulus Angiotensin II type 1a (AT-1a) receptor   359 aa 399 aa 25.3 %
Loa Loa (eye worm) hypothetical protein Angiotensin II type 1a (AT-1a) receptor   359 aa 335 aa 23.0 %
Brugia malayi putative neuropeptide receptor NPR1 Angiotensin II type 1a (AT-1a) receptor   359 aa 295 aa 27.1 %
Echinococcus multilocularis tm gpcr rhodopsin gpcr rhodopsin superfamily Angiotensin II type 1a (AT-1a) receptor   359 aa 306 aa 21.9 %
Onchocerca volvulus Angiotensin II type 1a (AT-1a) receptor   359 aa 341 aa 23.2 %
Schistosoma mansoni peptide (allatostatin)-like receptor Angiotensin II type 2 (AT-2) receptor   363 aa 364 aa 20.9 %
Echinococcus granulosus allatostatin A receptor Angiotensin II type 2 (AT-2) receptor   363 aa 340 aa 24.1 %
Echinococcus granulosus thyrotropin releasing hormone receptor Angiotensin II type 2 (AT-2) receptor   363 aa 308 aa 22.1 %
Schistosoma japonicum ko:K04209 neuropeptide Y receptor, invertebrate, putative Angiotensin II type 2 (AT-2) receptor   363 aa 310 aa 23.5 %
Schistosoma mansoni opsin-like receptor Angiotensin II type 1a (AT-1a) receptor   359 aa 299 aa 25.1 %
Brugia malayi ORL1-like opioid receptor Angiotensin II type 1a (AT-1a) receptor   359 aa 333 aa 21.3 %
Echinococcus multilocularis thyrotropin releasing hormone receptor Angiotensin II type 2 (AT-2) receptor   363 aa 308 aa 21.8 %
Schistosoma mansoni peptide (FMRFamide/somatostatin)-like receptor Angiotensin II type 1a (AT-1a) receptor   359 aa 346 aa 18.2 %
Loa Loa (eye worm) neuropeptide F receptor Angiotensin II type 2 (AT-2) receptor   363 aa 356 aa 23.3 %
Echinococcus granulosus tm gpcr rhodopsin Angiotensin II type 1a (AT-1a) receptor   359 aa 306 aa 21.9 %
Onchocerca volvulus Angiotensin II type 2 (AT-2) receptor   363 aa 306 aa 22.5 %
Echinococcus multilocularis G-protein coupled receptor, putative Angiotensin II type 1a (AT-1a) receptor   359 aa 307 aa 22.5 %
Loa Loa (eye worm) hypothetical protein Angiotensin II type 1a (AT-1a) receptor   359 aa 308 aa 27.3 %
Onchocerca volvulus Angiotensin II type 1a (AT-1a) receptor   359 aa 296 aa 23.0 %
Onchocerca volvulus Angiotensin II type 2 (AT-2) receptor   363 aa 311 aa 23.8 %
Schistosoma japonicum Rhodopsin, putative Angiotensin II type 2 (AT-2) receptor   363 aa 341 aa 22.0 %
Echinococcus granulosus growth hormone secretagogue receptor type 1 Angiotensin II type 1a (AT-1a) receptor   359 aa 342 aa 22.2 %
Schistosoma mansoni adenoreceptor Angiotensin II type 2 (AT-2) receptor   363 aa 328 aa 22.0 %
Echinococcus multilocularis neuropeptide receptor Angiotensin II type 2 (AT-2) receptor   363 aa 308 aa 21.4 %
Onchocerca volvulus E3 ubiquitin-protein ligase rpm-1 homolog Angiotensin II type 1a (AT-1a) receptor   359 aa 328 aa 20.7 %
Schistosoma mansoni biogenic amine (octopamine/dopamine) receptor Angiotensin II type 1a (AT-1a) receptor   359 aa 364 aa 23.1 %
Schistosoma japonicum ko:K04134 cholinergic receptor, invertebrate, putative Angiotensin II type 1a (AT-1a) receptor   359 aa 325 aa 20.9 %
Onchocerca volvulus Angiotensin II type 1a (AT-1a) receptor   359 aa 313 aa 25.6 %
Onchocerca volvulus Angiotensin II type 2 (AT-2) receptor   363 aa 305 aa 21.6 %
Echinococcus multilocularis pyroglutamylated rfamide peptide receptor Angiotensin II type 2 (AT-2) receptor   363 aa 398 aa 18.1 %
Brugia malayi GnHR receptor homolog Angiotensin II type 1a (AT-1a) receptor   359 aa 364 aa 20.3 %
Echinococcus granulosus neuropeptide receptor Angiotensin II type 2 (AT-2) receptor   363 aa 306 aa 22.2 %
Echinococcus granulosus pyroglutamylated rfamide peptide receptor Angiotensin II type 2 (AT-2) receptor   363 aa 398 aa 18.3 %

Obtained from network model

Ranking Plot


Putative Targets List


Species Potential target Raw Global Species
Trypanosoma cruzi trypanothione reductase, putative 0.007 0.2897 0.2897
Schistosoma mansoni glutamate synthase 0.0019 0.0131 0.0131
Trypanosoma cruzi hexokinase, putative 0.0081 0.3513 0.3513
Onchocerca volvulus 0.0051 0.188 0.5172
Trypanosoma cruzi NADH dehydrogenase, putative 0.0019 0.0131 0.0131
Trypanosoma brucei hexokinase, putative 0.0081 0.3513 0.3513
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.007 0.2897 0.2897
Toxoplasma gondii pyridine nucleotide-disulfide oxidoreductase domain-containing protein 0.0019 0.0131 0.0131
Trypanosoma cruzi NADH dehydrogenase, putative 0.0019 0.0131 0.0131
Trypanosoma cruzi DNA polymerase kappa, putative 0.0039 0.1254 0.1254
Mycobacterium ulcerans DNA polymerase IV 0.0039 0.1254 0.4061
Echinococcus granulosus pyridine nucleotide disulfide oxidoreductase 0.0019 0.0131 0.0131
Onchocerca volvulus Hexokinase homolog 0.0051 0.188 0.5172
Mycobacterium tuberculosis Probable nitrite reductase [NAD(P)H] large subunit [FAD flavoprotein] NirB 0.0019 0.0131 0.0131
Leishmania major dihydrolipoamide dehydrogenase, putative 0.007 0.2897 0.2897
Trypanosoma cruzi PAB1-binding protein , putative 0.0026 0.0518 0.0518
Brugia malayi Hexokinase family protein 0.0081 0.3513 0.3513
Brugia malayi Hexokinase family protein 0.0025 0.0487 0.0487
Echinococcus multilocularis terminal deoxycytidyl transferase rev1 0.0039 0.1254 0.1254
Leishmania major NADH dehydrogenase, putative 0.0019 0.0131 0.0131
Onchocerca volvulus 0.0026 0.0533 0.119
Mycobacterium tuberculosis Probable soluble pyridine nucleotide transhydrogenase SthA (STH) (NAD(P)(+) transhydrogenase [B-specific]) (nicotinamide nucleot 0.007 0.2897 0.2897
Leishmania major DNA polymerase kappa, putative,DNA polymerase IV, putative 0.0039 0.1254 0.1254
Brugia malayi intermediate filament protein 0.0026 0.0533 0.0533
Plasmodium falciparum thioredoxin reductase 0.0202 1 1
Trypanosoma cruzi 2,4-dienoyl-coa reductase fadh1, putative 0.0019 0.0131 0.0131
Plasmodium falciparum thioredoxin reductase 0.007 0.2897 0.2897
Echinococcus granulosus sulfide:quinone oxidoreductase 0.0019 0.0131 0.0131
Onchocerca volvulus 0.0026 0.0533 0.119
Echinococcus multilocularis hexokinase 0.0081 0.3513 0.3513
Trypanosoma cruzi hexokinase, putative 0.0081 0.3513 0.3513
Leishmania major 2-oxoglutarate dehydrogenase, e3 component, lipoamidedehydrogenase-like protein 0.007 0.2897 0.2897
Mycobacterium tuberculosis Probable NADH-dependent glutamate synthase (small subunit) GltD (L-glutamate synthase) (L-glutamate synthetase) (NADH-glutamate 0.0019 0.0131 0.0131
Plasmodium falciparum type II NADH:ubiquinone oxidoreductase 0.0019 0.0131 0.0131
Echinococcus granulosus dihydrolipoamide dehydrogenase 0.007 0.2897 0.2897
Mycobacterium tuberculosis NAD(P)H quinone reductase LpdA 0.007 0.2897 0.2897
Echinococcus multilocularis pyridine nucleotide disulfide oxidoreductase 0.0019 0.0131 0.0131
Mycobacterium ulcerans dihydrolipoamide dehydrogenase 0.007 0.2897 1
Mycobacterium tuberculosis Probable oxidoreductase 0.007 0.2897 0.2897
Plasmodium vivax ataxin-2 like protein, putative 0.0026 0.0518 0.0518
Plasmodium falciparum NAD(P)H-dependent glutamate synthase, putative 0.0019 0.0131 0.0131
Leishmania major 2,4-dienoyl-coa reductase-like protein 0.0019 0.0131 0.0131
Brugia malayi NADPH:adrenodoxin oxidoreductase, mitochondrial precursor 0.0019 0.0131 0.0131
Brugia malayi hexokinase 0.0081 0.3513 0.3513
Mycobacterium tuberculosis Probable NADPH dependent 2,4-dienoyl-CoA reductase FadH (2,4-dienoyl coenzyme A reductase) (4-enoyl-CoA reductase) 0.0019 0.0131 0.0131
Trypanosoma brucei pyridine nucleotide-disulphide oxidoreductase, putative 0.0019 0.0131 0.0131
Trypanosoma cruzi pyridine nucleotide-disulphide oxidoreductase, putative 0.0019 0.0131 0.0131
Trypanosoma brucei DNA polymerase eta, putative 0.0065 0.2656 0.2656
Leishmania major DNA polymerase eta, putative 0.0038 0.1191 0.1191
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.007 0.2897 0.2897
Schistosoma mansoni sulfide quinone reductase 0.0019 0.0131 0.0131
Echinococcus multilocularis NADPH:adrenodoxin oxidoreductase 0.0019 0.0131 0.0131
Echinococcus multilocularis dihydropyrimidine dehydrogenase (NADP+) 0.0019 0.0131 0.0131
Brugia malayi Pyridine nucleotide-disulphide oxidoreductase, dimerisation domain containing protein 0.0051 0.1898 0.1898
Brugia malayi Pyridine nucleotide-disulphide oxidoreductase family protein 0.0019 0.0131 0.0131
Leishmania major DNA polymerase eta, putative 0.0065 0.2656 0.2656
Wolbachia endosymbiont of Brugia malayi dihydrolipoamide dehydrogenase E3 component 0.007 0.2897 1
Mycobacterium tuberculosis Probable NADPH:adrenodoxin oxidoreductase FprB (adrenodoxin reductase) (AR) (ferredoxin-NADP(+) reductase) 0.0019 0.0131 0.0131
Leishmania major hypothetical protein, conserved 0.0019 0.0131 0.0131
Loa Loa (eye worm) hexokinase 0.0081 0.3513 0.3513
Toxoplasma gondii selenide, water dikinase 0.0019 0.0131 0.0131
Echinococcus granulosus intermediate filament protein 0.0026 0.0533 0.0533
Loa Loa (eye worm) ImpB/MucB/SamB family protein 0.0039 0.1254 0.1254
Brugia malayi glutamate synthase 0.0019 0.0131 0.0131
Leishmania major acetoin dehydrogenase e3 component-like protein 0.007 0.2897 0.2897
Mycobacterium tuberculosis Probable membrane NADH dehydrogenase NdhA 0.0019 0.0131 0.0131
Loa Loa (eye worm) hexokinase type II 0.0081 0.3513 0.3513
Leishmania major hexokinase, putative 0.0081 0.3513 0.3513
Trypanosoma brucei NADPH:adrenodoxin oxidoreductase, mitochondrial, putative 0.0019 0.0131 0.0131
Trypanosoma brucei DNA polymerase kappa, putative 0.0027 0.0595 0.0595
Trypanosoma brucei dihydrolipoamide dehydrogenase, point mutation 0.007 0.2897 0.2897
Brugia malayi ImpB/MucB/SamB family protein 0.0065 0.2656 0.2656
Trypanosoma brucei DNA polymerase kappa, putative 0.0039 0.1254 0.1254
Leishmania major hexokinase, putative 0.0081 0.3513 0.3513
Trypanosoma brucei DNA polymerase kappa, putative 0.0039 0.1254 0.1254
Schistosoma mansoni intermediate filament proteins 0.0026 0.0533 0.0533
Trypanosoma brucei DNA polymerase kappa, putative 0.0039 0.1254 0.1254
Brugia malayi Calcitonin receptor-like protein seb-1 0.0051 0.1873 0.1873
Plasmodium vivax type II NADH:ubiquinone oxidoreductase, putative 0.0019 0.0131 0.0131
Trypanosoma cruzi NADPH:adrenodoxin oxidoreductase, mitochondrial, putative 0.0019 0.0131 0.0131
Toxoplasma gondii non-proton pumping type-II NADH dehydrogenase I 0.0019 0.0131 0.0131
Plasmodium falciparum dihydrolipoyl dehydrogenase, apicoplast 0.007 0.2897 0.2897
Trypanosoma cruzi hypothetical protein, conserved 0.0019 0.0131 0.0131
Mycobacterium ulcerans DNA polymerase IV 0.0039 0.1254 0.4061
Mycobacterium tuberculosis Possible DNA-damage-inducible protein P DinP (DNA polymerase V) (pol IV 2) (DNA nucleotidyltransferase (DNA-directed)) 0.0039 0.1254 0.1254
Trichomonas vaginalis glutathione reductase, putative 0.007 0.2897 1
Schistosoma mansoni dihydrolipoamide dehydrogenase 0.007 0.2897 0.2897
Chlamydia trachomatis dihydrolipoyl dehydrogenase 0.007 0.2897 1
Trypanosoma brucei DNA polymerase kappa, putative 0.0039 0.1254 0.1254
Schistosoma mansoni hypothetical protein 0.0173 0.8453 0.8453
Mycobacterium ulcerans flavoprotein disulfide reductase 0.007 0.2897 1
Echinococcus multilocularis hexokinase 0.0081 0.3513 0.3513
Brugia malayi hypothetical protein 0.0026 0.0518 0.0518
Plasmodium vivax dihydrolipoyl dehydrogenase, apicoplast, putative 0.007 0.2897 0.2897
Trypanosoma cruzi DNA polymerase kappa, putative 0.0039 0.1254 0.1254
Trypanosoma brucei DNA polymerase kappa, putative 0.0039 0.1254 0.1254
Echinococcus multilocularis thioredoxin glutathione reductase 0.0202 1 1
Trypanosoma brucei DNA polymerase IV, putative 0.0039 0.1254 0.1254
Plasmodium vivax hexokinase, putative 0.0081 0.3513 0.3513
Echinococcus granulosus geminin 0.0173 0.8453 0.8453
Trypanosoma cruzi DNA polymerase kappa, putative 0.0039 0.1254 0.1254
Toxoplasma gondii NADH dehydrogenase (NDH2-II) 0.0019 0.0131 0.0131
Schistosoma mansoni rab geranylgeranyl transferase alpha subunit 0.0039 0.1254 0.1254
Trichomonas vaginalis DNA polymerase IV / kappa, putative 0.0039 0.1254 0.4061
Brugia malayi hypothetical protein 0.0017 0.0026 0.0026
Trypanosoma cruzi DNA polymerase kappa, putative 0.0039 0.1254 0.1254
Echinococcus multilocularis lamin dm0 0.0026 0.0533 0.0533
Echinococcus granulosus hexokinase 0.0081 0.3513 0.3513
Trypanosoma brucei dihydrolipoyl dehydrogenase 0.007 0.2897 0.2897
Entamoeba histolytica hexokinase 2 0.0081 0.3513 1
Trypanosoma brucei 2,4-dienoyl-coa reductase-like protein 0.0019 0.0131 0.0131
Trypanosoma brucei unspecified product 0.0027 0.0595 0.0595
Loa Loa (eye worm) pyridine nucleotide-disufhide oxidoreductase 0.0019 0.0131 0.0131
Schistosoma mansoni disulfide oxidoreductase 0.0019 0.0131 0.0131
Plasmodium vivax ferrodoxin reductase, putative 0.0019 0.0131 0.0131
Onchocerca volvulus 0.0081 0.3513 1
Schistosoma mansoni glutamate synthase 0.0019 0.0131 0.0131
Toxoplasma gondii LsmAD domain-containing protein 0.0026 0.0518 0.0518
Leishmania major hypothetical protein, conserved 0.0019 0.0131 0.0131
Brugia malayi dihydrolipoyl dehydrogenase, mitochondrial precursor, putative 0.007 0.2897 0.2897
Schistosoma mansoni lamin 0.0026 0.0533 0.0533
Leishmania major DNA polymerase kappa, putative 0.0039 0.1254 0.1254
Echinococcus granulosus dihydropyrimidine dehydrogenase NADP 0.0019 0.0131 0.0131
Echinococcus multilocularis musashi 0.0026 0.0533 0.0533
Echinococcus granulosus apoptosis inducing factor 1 mitochondrial 0.0019 0.0131 0.0131
Plasmodium falciparum glutathione reductase 0.007 0.2897 0.2897
Loa Loa (eye worm) hexokinase 0.0025 0.0487 0.0487
Schistosoma mansoni hypothetical protein 0.0035 0.1006 0.1006
Echinococcus multilocularis hexokinase type 2 0.0081 0.3513 0.3513
Loa Loa (eye worm) hypothetical protein 0.0051 0.1873 0.1873
Loa Loa (eye worm) hypothetical protein 0.0026 0.0524 0.0524
Toxoplasma gondii thioredoxin reductase 0.0202 1 1
Trypanosoma brucei PAB1-binding protein , putative 0.0026 0.0518 0.0518
Toxoplasma gondii pyridine nucleotide-disulfide oxidoreductase domain-containing protein 0.0019 0.0131 0.0131
Echinococcus multilocularis hexokinase 0.0081 0.3513 0.3513
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.007 0.2897 0.2897
Loa Loa (eye worm) hypothetical protein 0.0026 0.0524 0.0524
Echinococcus granulosus lamin dm0 0.0026 0.0533 0.0533
Plasmodium falciparum glutathione reductase 0.0202 1 1
Mycobacterium tuberculosis Putative ferredoxin reductase 0.0019 0.0131 0.0131
Schistosoma mansoni lamin 0.0026 0.0533 0.0533
Mycobacterium tuberculosis Probable NADH dehydrogenase Ndh 0.0019 0.0131 0.0131
Loa Loa (eye worm) hypothetical protein 0.0056 0.212 0.212
Trichomonas vaginalis mercuric reductase, putative 0.007 0.2897 1
Toxoplasma gondii hexokinase 0.0081 0.3513 0.3513
Onchocerca volvulus 0.0081 0.3513 1
Onchocerca volvulus 0.0081 0.3513 1
Trypanosoma cruzi 2,4-dienoyl-coa reductase-like protein, putative 0.0019 0.0131 0.0131
Echinococcus multilocularis dna polymerase eta 0.0065 0.2656 0.2656
Echinococcus multilocularis glutamate synthase 0.0019 0.0131 0.0131
Trypanosoma cruzi DNA polymerase eta, putative 0.0065 0.2656 0.2656
Echinococcus granulosus glutamate synthase 0.0019 0.0131 0.0131
Trypanosoma cruzi PAB1-binding protein , putative 0.0026 0.0518 0.0518
Mycobacterium tuberculosis Probable reductase 0.0019 0.0131 0.0131
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0051 0.1873 0.1873
Echinococcus granulosus dihydropyrimidine dehydrogenase NADP 0.0019 0.0131 0.0131
Mycobacterium tuberculosis Probable thioredoxin reductase TrxB2 (TRXR) (TR) 0.0019 0.0131 0.0131
Trypanosoma brucei DNA polymerase kappa, putative 0.0039 0.1254 0.1254
Trypanosoma cruzi dihydrolipoyl dehydrogenase, putative 0.007 0.2897 0.2897
Echinococcus granulosus lamin 0.0026 0.0533 0.0533
Echinococcus multilocularis apoptosis inducing factor 1 mitochondrial 0.0019 0.0131 0.0131
Schistosoma mansoni hexokinase 0.0081 0.3513 0.3513
Schistosoma mansoni DNA polymerase eta 0.0065 0.2656 0.2656
Leishmania major hypothetical protein, conserved 0.0026 0.0518 0.0518
Echinococcus multilocularis dihydropyrimidine dehydrogenase (NADP+) 0.0019 0.0131 0.0131
Toxoplasma gondii pyridine nucleotide-disulfide oxidoreductase domain-containing protein 0.0019 0.0131 0.0131
Echinococcus granulosus terminal deoxycytidyl transferase rev1 0.0039 0.1254 0.1254
Mycobacterium tuberculosis Dihydrolipoamide dehydrogenase LpdC (lipoamide reductase (NADH)) (lipoyl dehydrogenase) (dihydrolipoyl dehydrogenase) (diaphoras 0.007 0.2897 0.2897
Giardia lamblia DINP protein human, muc B family 0.0039 0.1254 0.4061
Echinococcus granulosus dna polymerase kappa 0.0039 0.1254 0.1254
Trypanosoma brucei trypanothione reductase 0.0202 1 1
Loa Loa (eye worm) hexokinase 0.0051 0.188 0.188
Trypanosoma brucei DNA polymerase kappa, putative 0.0039 0.1254 0.1254
Loa Loa (eye worm) programmed cell death 8 0.0019 0.0131 0.0131
Trypanosoma brucei DNA polymerase kappa, putative 0.0039 0.1254 0.1254
Loa Loa (eye worm) hypothetical protein 0.0026 0.0507 0.0507
Treponema pallidum NADH oxidase 0.007 0.2897 0.818
Loa Loa (eye worm) thioredoxin reductase 0.0202 1 1
Mycobacterium tuberculosis Possible dehydrogenase/reductase 0.0019 0.0131 0.0131
Loa Loa (eye worm) hypothetical protein 0.0026 0.0518 0.0518
Toxoplasma gondii ImpB/MucB/SamB family protein 0.0038 0.1191 0.1191
Trypanosoma cruzi trypanothione reductase, putative 0.0202 1 1
Loa Loa (eye worm) hexokinase 0.0081 0.3513 0.3513
Loa Loa (eye worm) hypothetical protein 0.0026 0.0533 0.0533
Schistosoma mansoni hypothetical protein 0.0019 0.0131 0.0131
Leishmania major 2,4-dienoyl-coa reductase fadh1, putative 0.0019 0.0131 0.0131
Plasmodium vivax NAD(P)H-dependent glutamate synthase, putative 0.0019 0.0131 0.0131
Mycobacterium leprae DIHYDROLIPOAMIDE DEHYDROGENASE LPD (LIPOAMIDE REDUCTASE (NADH)) (LIPOYL DEHYDROGENASE) (DIHYDROLIPOYL DEHYDROGENASE) (DIAPHORASE 0.007 0.2897 1
Trypanosoma brucei DNA polymerase kappa, putative 0.0039 0.1254 0.1254
Trypanosoma brucei pyridine nucleotide-disulphide oxidoreductase, putative 0.0019 0.0131 0.0131
Trichomonas vaginalis DNA polymerase eta, putative 0.0039 0.1254 0.4061
Trypanosoma brucei DNA polymerase kappa, putative 0.0039 0.1254 0.1254
Mycobacterium tuberculosis Probable dehydrogenase 0.0019 0.0131 0.0131
Brugia malayi latrophilin 2 splice variant baaae 0.0035 0.1006 0.1006
Schistosoma mansoni glutamate synthase 0.0019 0.0131 0.0131
Trypanosoma brucei DNA polymerase kappa, putative 0.0027 0.0595 0.0595
Echinococcus granulosus hexokinase type 2 0.0081 0.3513 0.3513
Loa Loa (eye worm) hypothetical protein 0.0065 0.2656 0.2656
Leishmania major hypothetical protein, conserved 0.0019 0.0131 0.0131
Trypanosoma cruzi pyridine nucleotide-disulphide oxidoreductase, putative 0.0019 0.0131 0.0131
Trypanosoma brucei hypothetical protein, conserved 0.0019 0.0131 0.0131
Trypanosoma brucei DNA polymerase kappa, putative 0.0027 0.0595 0.0595
Brugia malayi Intermediate filament tail domain containing protein 0.0026 0.0533 0.0533
Echinococcus granulosus thioredoxin glutathione reductase 0.0202 1 1
Echinococcus multilocularis dihydrolipoamide dehydrogenase 0.007 0.2897 0.2897
Loa Loa (eye worm) intermediate filament tail domain-containing protein 0.0026 0.0533 0.0533
Trypanosoma cruzi DNA polymerase eta, putative 0.0038 0.1191 0.1191
Echinococcus multilocularis dna polymerase kappa 0.0039 0.1254 0.1254
Trypanosoma brucei NADH dehydrogenase 0.0019 0.0131 0.0131
Plasmodium falciparum ataxin-2 like protein, putative 0.0026 0.0518 0.0518
Entamoeba histolytica deoxycytidyl transferase, putative 0.0039 0.1254 0.3322
Mycobacterium tuberculosis NADPH-dependent mycothiol reductase Mtr 0.0202 1 1
Echinococcus granulosus NADPH:adrenodoxin oxidoreductase 0.0019 0.0131 0.0131
Loa Loa (eye worm) intermediate filament protein 0.0026 0.0533 0.0533
Echinococcus granulosus hexokinase 0.0081 0.3513 0.3513
Loa Loa (eye worm) hypothetical protein 0.0035 0.1006 0.1006
Trypanosoma brucei hexokinase 0.0081 0.3513 0.3513
Schistosoma mansoni hypothetical protein 0.0173 0.8453 0.8453
Trypanosoma brucei hexokinase 0.0081 0.3513 0.3513
Loa Loa (eye worm) glutathione reductase 0.0202 1 1
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0051 0.1873 0.1873
Plasmodium vivax glutathione reductase, putative 0.0202 1 1
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.007 0.2897 0.2897
Brugia malayi Hexokinase family protein 0.0051 0.188 0.188
Echinococcus multilocularis geminin 0.0173 0.8453 0.8453
Mycobacterium tuberculosis Conserved hypothetical protein 0.0039 0.1254 0.1254
Trypanosoma cruzi dihydrolipoyl dehydrogenase, putative 0.007 0.2897 0.2897
Toxoplasma gondii NADPH-glutathione reductase 0.007 0.2897 0.2897
Trypanosoma brucei DNA polymerase IV, putative 0.0039 0.1254 0.1254
Trypanosoma brucei dihydrolipoamide dehydrogenase 0.007 0.2897 0.2897
Entamoeba histolytica hexokinase 1 0.0081 0.3513 1
Brugia malayi Thioredoxin reductase 0.0202 1 1
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.007 0.2897 0.2897
Brugia malayi ImpB/MucB/SamB family protein 0.0039 0.1254 0.1254
Plasmodium vivax thioredoxin reductase, putative 0.0202 1 1
Brugia malayi Pyridine nucleotide-disulphide oxidoreductase family protein 0.0019 0.0131 0.0131
Treponema pallidum hexokinase (hxk) 0.0081 0.3513 1
Plasmodium vivax dihydrolipoyl dehydrogenase, mitochondrial, putative 0.007 0.2897 0.2897
Mycobacterium tuberculosis NADPH:adrenodoxin oxidoreductase FprA (NADPH-ferredoxin reductase) 0.0019 0.0131 0.0131
Echinococcus multilocularis sulfide:quinone oxidoreductase 0.0019 0.0131 0.0131
Trypanosoma brucei unspecified product 0.0027 0.0595 0.0595
Plasmodium falciparum ataxin-2 like protein, putative 0.0026 0.0518 0.0518
Brugia malayi hexokinase type II 0.0026 0.0524 0.0524
Leishmania major dihydrolipoamide dehydrogenase, putative 0.007 0.2897 0.2897
Echinococcus granulosus dna polymerase eta 0.0065 0.2656 0.2656
Loa Loa (eye worm) hypothetical protein 0.0019 0.0131 0.0131
Plasmodium falciparum ferrodoxin reductase-like protein 0.0019 0.0131 0.0131
Echinococcus multilocularis lamin 0.0026 0.0533 0.0533
Schistosoma mansoni sulfide quinone reductase 0.0019 0.0131 0.0131
Plasmodium falciparum dihydrolipoyl dehydrogenase, mitochondrial 0.007 0.2897 0.2897
Mycobacterium ulcerans dihydrolipoamide dehydrogenase, LpdB 0.007 0.2897 1
Echinococcus granulosus hexokinase 0.0081 0.3513 0.3513
Leishmania major trypanothione reductase 0.0202 1 1
Brugia malayi alpha keto acid dehydrogenase complex, E3 component, lipoamide dehydrogenase 0.0051 0.1898 0.1898
Schistosoma mansoni terminal deoxycytidyl transferase 0.0039 0.1254 0.1254
Toxoplasma gondii pyruvate dehydrogenase complex subunit PDH-E3II 0.007 0.2897 0.2897
Giardia lamblia NADH oxidase lateral transfer candidate 0.007 0.2897 1
Trypanosoma brucei DNA polymerase IV, putative 0.0039 0.1254 0.1254
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.007 0.2897 0.2897
Plasmodium falciparum hexokinase 0.0081 0.3513 0.3513
Trypanosoma cruzi hypothetical protein, conserved 0.0019 0.0131 0.0131
Trypanosoma brucei unspecified product 0.0039 0.1254 0.1254
Wolbachia endosymbiont of Brugia malayi dihydrolipoamide dehydrogenase E3 component 0.007 0.2897 1
Trypanosoma brucei dihydrolipoamide dehydrogenase 0.007 0.2897 0.2897

Activities

Activity type Activity value Assay description Source Reference
IC50 (binding) = 11 nM Tested for its ability to displace the specific binding ligand [125I]-Sar 1,lle8-AlI from rabbit aortic membrane (AT1 receptor) ChEMBL. No reference
IC50 (binding) = 11 nM Tested for its ability to displace the specific binding ligand [125I]-Sar 1,lle8-AlI from rabbit aortic membrane (AT1 receptor) ChEMBL. No reference
IC50 (binding) = 47 nM Tested for its ability to displace the specific binding ligand [125I]-Sar 1,lle8-AlI from rat midbrain membrane (AT2 receptor) ChEMBL. No reference
IC50 (binding) = 47 nM Tested for its ability to displace the specific binding ligand [125I]-Sar 1,lle8-AlI from rat midbrain membrane (AT2 receptor) ChEMBL. No reference
IC50 (binding) = 11 uM Inhibition of human endothelin A (ETA) receptor expressed in CHO cells ChEMBL. No reference
IC50 (binding) = 11 uM Inhibition of human endothelin A (ETA) receptor expressed in CHO cells ChEMBL. No reference
IC50 (binding) = 47 uM Inhibition of human endothelin B (ETB) receptor expressed in CHO cells ChEMBL. No reference
IC50 (binding) = 47 uM Inhibition of human endothelin B (ETB) receptor expressed in CHO cells ChEMBL. No reference

Phenotypes

Whole-cell/tissue/organism interactions

We have no records of whole-cell/tissue assays done with this compound What does this mean?

Many chemical entities in TDR Targets come from high-throughput screenings with whole cells or tissue samples, and not all assayed compounds have been tested against a single a single target protein, probably because they get ruled out during screening process. Even if these compounds may have not been of interest in the original screening, they may come as interesting leads for other screening assays. Furthermore, we may be able to propose drug-target associations using chemical similarities and network patterns.

Annotated phenotypes:

We have no manually annotated phenotypes for this drug. What does this mean? / Care to help?
In TDR Targets, information about phenotypes that are caused by drugs, or by genetic manipulation of cells (e.g. gene knockouts or knockdowns) is manually curated from the literature. These descriptions help to describe the potential of the target for drug development. If no information is available for this gene or if the information is incomplete, this may mean that i) the papers containing this information either appeared after the curation effort for this organism was carried out or they were inadvertently missed by curators; or that ii) the curation effort for this organism has not yet started.
 
In any case, if you have information about papers containing relevant validation data for this target, please log in using your TDR Targets username and password and send them to us using the corresponding form in this page (only visible to registered users) or contact us.

External resources for this compound

Bibliographic References

No literature references available for this target.

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