Detailed information for compound 1384138

Basic information

Technical information
  • TDR Targets ID: 1384138
  • Name: N-[4-(4-bromophenyl)sulfanylphenyl]furan-2-ca rboxamide
  • MW: 374.252 | Formula: C17H12BrNO2S
  • H donors: 1 H acceptors: 1 LogP: 4.92 Rotable bonds: 5
    Rule of 5 violations (Lipinski): 1
  • SMILES: Brc1ccc(cc1)Sc1ccc(cc1)NC(=O)c1ccco1
  • InChi: 1S/C17H12BrNO2S/c18-12-3-7-14(8-4-12)22-15-9-5-13(6-10-15)19-17(20)16-2-1-11-21-16/h1-11H,(H,19,20)
  • InChiKey: SLFUAUZZDHRRPN-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • N-[4-[(4-bromophenyl)thio]phenyl]-2-furancarboxamide
  • N-[4-[(4-bromophenyl)thio]phenyl]-2-furamide
  • ZINC02652499
  • MLS000570393
  • SMR000150457
  • T5244358

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens lysine (K)-specific methyltransferase 2A Starlite/ChEMBL No references
Mus musculus RAR-related orphan receptor gamma Starlite/ChEMBL No references
Homo sapiens microtubule-associated protein tau Starlite/ChEMBL No references
Equus caballus Ferritin light chain Starlite/ChEMBL No references
Homo sapiens glucagon-like peptide 1 receptor Starlite/ChEMBL No references
Homo sapiens glycoprotein hormones, alpha polypeptide Starlite/ChEMBL No references
Homo sapiens ATPase family, AAA domain containing 5 Starlite/ChEMBL No references
Homo sapiens ataxin 2 Starlite/ChEMBL No references
Homo sapiens multiple endocrine neoplasia I No references

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Echinococcus granulosus dnaJ subfamily B Get druggable targets OG5_133913 All targets in OG5_133913
Echinococcus multilocularis dnaJ subfamily B Get druggable targets OG5_133913 All targets in OG5_133913
Schistosoma mansoni hypothetical protein Get druggable targets OG5_133913 All targets in OG5_133913
Neospora caninum Multidomain chromatinic protein with the following architecture: 3x PHD-bromo-3xPHD-SET domain and associated cysteine cluster a Get druggable targets OG5_130642 All targets in OG5_130642
Schistosoma japonicum Menin, putative Get druggable targets OG5_133913 All targets in OG5_133913
Echinococcus multilocularis microtubule associated protein 2 Get druggable targets OG5_133504 All targets in OG5_133504
Echinococcus granulosus microtubule associated protein 2 Get druggable targets OG5_133504 All targets in OG5_133504
Schistosoma japonicum ko:K09188 myeloid/lymphoid or mixed-lineage leukemia protein 3, putative Get druggable targets OG5_130642 All targets in OG5_130642
Schistosoma japonicum ko:K04380 microtubule-associated protein tau, putative Get druggable targets OG5_133504 All targets in OG5_133504
Toxoplasma gondii histone lysine methyltransferase SET1 Get druggable targets OG5_130642 All targets in OG5_130642
Schistosoma mansoni microtubule-associated protein tau Get druggable targets OG5_133504 All targets in OG5_133504
Schistosoma mansoni mixed-lineage leukemia protein mll Get druggable targets OG5_130642 All targets in OG5_130642
Echinococcus multilocularis atpase aaa+ type core atpase aaa type core Get druggable targets OG5_139225 All targets in OG5_139225
By sequence similarity to non orthologous known druggable targets
Species Potential target Known druggable target Length Alignment span Identity
Schistosoma mansoni ferritin Ferritin light chain   175 aa 171 aa 44.4 %
Loa Loa (eye worm) pigment dispersing factor receptor c glucagon-like peptide 1 receptor 463 aa 388 aa 25.8 %
Schistosoma mansoni apoferritin-2 Ferritin light chain   175 aa 142 aa 29.6 %
Schistosoma mansoni apoferritin-2 Ferritin light chain   175 aa 146 aa 28.8 %
Toxoplasma gondii intraflagellar transport protein 172, putative glycoprotein hormones, alpha polypeptide 116 aa 94 aa 26.6 %
Echinococcus multilocularis expressed protein Ferritin light chain   175 aa 146 aa 30.1 %
Echinococcus granulosus expressed protein Ferritin light chain   175 aa 146 aa 28.8 %
Schistosoma japonicum Ferritin, putative Ferritin light chain   175 aa 144 aa 24.3 %
Schistosoma mansoni ferritin Ferritin light chain   175 aa 171 aa 43.9 %
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Loa Loa (eye worm) nuclear Hormone Receptor family member 0.0012 0.0037 0.0023
Schistosoma mansoni ferritin light chain 0.001 0.0017 0.002
Loa Loa (eye worm) nuclear hormone receptor family member nhr-40 0.0012 0.0037 0.0023
Schistosoma mansoni aminopeptidase PILS (M01 family) 0.0047 0.0393 0.0462
Echinococcus granulosus purine nucleoside phosphorylase 0.0809 0.8245 0.9703
Schistosoma mansoni Tr4/Tr2 (homologue) 0.0012 0.0037 0.0044
Schistosoma mansoni thyroid hormone receptor 0.0012 0.0037 0.0044
Brugia malayi photoreceptor-specific nuclear receptor 0.0012 0.0037 0.002
Schistosoma mansoni cercarial elastase (S01 family) 0.0047 0.0393 0.0462
Brugia malayi Trypsin family protein 0.0047 0.0393 0.0453
Plasmodium vivax cysteine repeat modular protein 1, putative 0.0335 0.3365 1
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0012 0.0037 0.002
Brugia malayi Protein kinase domain containing protein 0.0335 0.3365 0.4066
Schistosoma mansoni cercarial elastase (S01 family) 0.0047 0.0393 0.0462
Leishmania major nucleoside phosphorylase-like protein 0.0167 0.1637 0.4497
Echinococcus granulosus tissue type plasminogen activator 0.0335 0.3365 0.396
Echinococcus multilocularis purine nucleoside phosphorylase 0.0809 0.8245 0.8245
Loa Loa (eye worm) hypothetical protein 0.0012 0.0037 0.0023
Echinococcus granulosus COUP TF:Svp nuclear hormone receptor 0.0012 0.0037 0.0044
Wolbachia endosymbiont of Brugia malayi bacterioferritin/cytochrome b1 0.001 0.0017 0.5
Trichomonas vaginalis purine nucleoside phosphorylase, putative 0.0167 0.1637 0.1969
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.0019 0.0107 0.0107
Schistosoma mansoni cpg binding protein 0.0035 0.0269 0.0316
Mycobacterium tuberculosis Hypothetical protein 0.0167 0.1637 0.1969
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.006 0.0531 0.0621
Entamoeba histolytica hypothetical protein 0.0167 0.1637 0.5
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0012 0.0037 0.002
Echinococcus multilocularis purine nucleoside phosphorylase 0.0641 0.6519 0.6519
Echinococcus granulosus ecdysone induced protein 78C 0.0012 0.0037 0.0044
Echinococcus granulosus purine nucleoside phosphorylase 0.0809 0.8245 0.9703
Trypanosoma brucei methylthioadenosine phosphorylase, putative 0.0167 0.1637 1
Schistosoma mansoni hypothetical protein 0.0019 0.0107 0.0126
Entamoeba histolytica purine nucleoside phosphorylase, putative 0.0167 0.1637 0.5
Echinococcus granulosus purine nucleoside phosphorylase 0.0809 0.8245 0.9703
Echinococcus multilocularis dnaJ subfamily B 0.0494 0.5 0.5
Loa Loa (eye worm) hypothetical protein 0.003 0.0225 0.0313
Schistosoma mansoni uridine phosphorylase 0.0167 0.1637 0.1926
Entamoeba histolytica purine nucleoside phosphorylase, putative 0.0167 0.1637 0.5
Echinococcus multilocularis enteropeptidase 0.0047 0.0393 0.0393
Mycobacterium tuberculosis Probable purine nucleoside phosphorylase DeoD (inosine phosphorylase) (PNP) 0.0809 0.8245 1
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.0019 0.0107 0.0126
Echinococcus granulosus retinoic acid receptor rxr beta a 0.0012 0.0037 0.0044
Brugia malayi Kringle domain containing protein 0.0335 0.3365 0.4066
Schistosoma mansoni cpg binding protein 0.0037 0.0289 0.034
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0074 0.0669 0.0788
Schistosoma mansoni methylthioadenosine phosphorylase 0.0167 0.1637 0.1926
Brugia malayi ecdysteroid receptor 0.0012 0.0037 0.002
Schistosoma mansoni hypothetical protein 0.0019 0.0107 0.0126
Toxoplasma gondii histone lysine methyltransferase SET1 0.0066 0.0588 0.1157
Echinococcus granulosus histone lysine N methyltransferase MLL3 0.0011 0.0022 0.0026
Loa Loa (eye worm) uridine phosphorylase 0.0167 0.1637 0.2486
Trypanosoma cruzi nucleoside phosphorylase, putative 0.0167 0.1637 0.4497
Echinococcus multilocularis cadherin EGF LAG seven pass G type receptor 0.0019 0.0107 0.0107
Schistosoma mansoni cercarial elastase (S01 family) 0.0047 0.0393 0.0462
Echinococcus multilocularis FTZ F1 alpha 0.0012 0.0037 0.0037
Echinococcus multilocularis ferritin 0.001 0.0017 0.0017
Echinococcus granulosus uridine phosphorylase 1 0.0167 0.1637 0.1926
Brugia malayi hypothetical protein 0.0047 0.0393 0.0453
Toxoplasma gondii phosphorylase family protein 0.0167 0.1637 0.4497
Echinococcus multilocularis purine nucleoside phosphorylase 0.0641 0.6519 0.6519
Plasmodium falciparum purine nucleoside phosphorylase 0.0167 0.1637 0.4497
Schistosoma mansoni purine nucleoside phosphorylase 0.0809 0.8245 0.9703
Schistosoma mansoni subfamily S1A unassigned peptidase (S01 family) 0.0047 0.0393 0.0462
Mycobacterium ulcerans bifunctional Mta/Sah nucleosidase Mtn 0.0167 0.1637 0.1969
Loa Loa (eye worm) hypothetical protein 0.0047 0.0393 0.0571
Schistosoma mansoni apoferritin-2 0.001 0.0017 0.002
Echinococcus granulosus expressed protein 0.001 0.0017 0.002
Brugia malayi Nuclear hormone receptor-like 1 0.0012 0.0037 0.002
Loa Loa (eye worm) nuclear hormone receptor family member nhr-14 0.0012 0.0037 0.0023
Schistosoma mansoni hypothetical protein 0.0047 0.0393 0.0462
Trichomonas vaginalis purine nucleoside phosphorylase, putative 0.0167 0.1637 0.1969
Schistosoma mansoni photoreceptor-specific nuclear receptor related 0.0012 0.0037 0.0044
Loa Loa (eye worm) nuclear hormone receptor family member nhr-1 0.0012 0.0037 0.0023
Onchocerca volvulus 0.0047 0.0393 0.0434
Echinococcus granulosus microtubule associated protein 2 0.0833 0.8497 1
Schistosoma mansoni ferritin light chain 0.001 0.0017 0.002
Echinococcus multilocularis hepatocyte nuclear factor 4 alpha 0.0012 0.0037 0.0037
Schistosoma mansoni nuclear hormone receptor 0.0012 0.0037 0.0044
Brugia malayi Chymotrypsin-like protease CTRL-1 precursor 0.0047 0.0393 0.0453
Echinococcus multilocularis Peptidase S1 S6, chymotrypsin Hap 0.0047 0.0393 0.0393
Echinococcus granulosus Nuclear hormone receptor family member nhr 41 0.0012 0.0037 0.0044
Mycobacterium leprae Probable purine nucleoside phosphorylase DeoD (INOSINE PHOSPHORYLASE) (PNP) 0.0809 0.8245 1
Toxoplasma gondii kringle domain-containing protein 0.0335 0.3365 1
Brugia malayi Nuclear hormone receptor family member nhr-49 0.0012 0.0037 0.002
Schistosoma mansoni RAR-like nuclear receptor 0.0012 0.0037 0.0044
Mycobacterium leprae probable uridine phosphorylase 0.0167 0.1637 0.1969
Schistosoma mansoni hypothetical protein 0.0041 0.0335 0.0395
Echinococcus granulosus cadherin EGF LAG seven pass G type receptor 0.0019 0.0107 0.0126
Schistosoma mansoni hypothetical protein 0.0335 0.3365 0.396
Loa Loa (eye worm) hypothetical protein 0.0047 0.0393 0.0571
Echinococcus granulosus glycoprotein Antigen 5 0.0047 0.0393 0.0462
Schistosoma mansoni retinoid-x-receptor (RXR) 0.0012 0.0037 0.0044
Echinococcus granulosus inosine guanosine and xanthosine phosphorylase 0.0641 0.6519 0.7672
Echinococcus granulosus FTZ F1 alpha 0.0012 0.0037 0.0044
Brugia malayi CXXC zinc finger family protein 0.0035 0.0269 0.0302
Trichomonas vaginalis purine nucleoside phosphorylase, putative 0.0167 0.1637 0.1969
Brugia malayi Nuclear hormone receptor family member nhr-14 0.0012 0.0037 0.002
Echinococcus multilocularis purine nucleoside phosphorylase 0.0809 0.8245 0.8245
Brugia malayi Calcitonin receptor-like protein seb-1 0.006 0.0531 0.0621
Echinococcus multilocularis GPCR, family 2 0.0019 0.0107 0.0107
Loa Loa (eye worm) hypothetical protein 0.0012 0.0037 0.0023
Brugia malayi latrophilin 2 splice variant baaae 0.0041 0.0335 0.0383
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0012 0.0037 0.0037
Loa Loa (eye worm) S-methyl-5'-thioadenosine phosphorylase MTAP 0.0167 0.1637 0.2486
Loa Loa (eye worm) hypothetical protein 0.0012 0.0037 0.0023
Toxoplasma gondii phosphorylase family protein 0.0167 0.1637 0.4497
Schistosoma mansoni subfamily S1A unassigned peptidase (S01 family) 0.0047 0.0393 0.0462
Brugia malayi MTAP 0.0167 0.1637 0.1965
Echinococcus multilocularis expressed protein 0.001 0.0017 0.0017
Toxoplasma gondii Purine nucleoside phosphorylase 0.0167 0.1637 0.4497
Schistosoma mansoni cercarial elastase (S01 family) 0.0047 0.0393 0.0462
Schistosoma mansoni hypothetical protein 0.0019 0.0107 0.0126
Mycobacterium ulcerans purine nucleoside phosphorylase 0.0809 0.8245 1
Echinococcus multilocularis methylthioadenosine phosphorylase 0.0167 0.1637 0.1637
Echinococcus multilocularis FTZ F1 nuclear receptor protein 0.0012 0.0037 0.0037
Loa Loa (eye worm) hypothetical protein 0.0012 0.0037 0.0023
Schistosoma mansoni ferritin 0.001 0.0017 0.002
Entamoeba histolytica purine nucleoside phosphorylase, putative 0.0167 0.1637 0.5
Trypanosoma cruzi methylthioadenosine phosphorylase, putative 0.0167 0.1637 0.4497
Echinococcus granulosus dnaJ subfamily B 0.0494 0.5 0.5885
Trichomonas vaginalis purine nucleoside phosphorylase, putative 0.0167 0.1637 0.1969
Treponema pallidum pfs protein (pfs) 0.0167 0.1637 1
Trichomonas vaginalis conserved hypothetical protein 0.0167 0.1637 0.1969
Echinococcus granulosus purine nucleoside phosphorylase 0.0809 0.8245 0.9703
Brugia malayi Trypsin-like protease protein 5 0.0047 0.0393 0.0453
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0012 0.0037 0.002
Onchocerca volvulus 0.0047 0.0393 0.0434
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0012 0.0037 0.0044
Schistosoma mansoni thyroid hormone receptor 0.0012 0.0037 0.0044
Echinococcus granulosus hepatocyte nuclear factor 4 alpha 0.0012 0.0037 0.0044
Loa Loa (eye worm) hypothetical protein 0.0019 0.0107 0.0132
Loa Loa (eye worm) nuclear hormone receptor family member nhr-31 0.0012 0.0037 0.0023
Trichomonas vaginalis purine nucleoside phosphorylase, putative 0.0167 0.1637 0.1969
Schistosoma mansoni cpg binding protein 0.0037 0.0289 0.034
Schistosoma mansoni subfamily S1A unassigned peptidase (S01 family) 0.0047 0.0393 0.0462
Mycobacterium ulcerans 5'-methylthioadenosine phosphorylase 0.0167 0.1637 0.1969
Loa Loa (eye worm) TK/ROR protein kinase 0.0335 0.3365 0.5145
Brugia malayi uridine phosphorylase family protein 0.0167 0.1637 0.1965
Brugia malayi steroid hormone receptor 0.0012 0.0037 0.002
Echinococcus multilocularis COUP TF:Svp nuclear hormone receptor 0.0012 0.0037 0.0037
Loa Loa (eye worm) hypothetical protein 0.0335 0.3365 0.5145
Echinococcus granulosus cpg binding protein 0.0037 0.0289 0.034
Loa Loa (eye worm) nuclear hormone receptor family member nhr-41 0.0012 0.0037 0.0023
Brugia malayi Latrophilin receptor protein 2 0.0019 0.0107 0.0106
Echinococcus multilocularis thyroid hormone receptor alpha 0.0012 0.0037 0.0037
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0012 0.0037 0.002
Trypanosoma cruzi nucleoside phosphorylase, putative 0.0167 0.1637 0.4497
Echinococcus granulosus Peptidase S1 S6 chymotrypsin Hap 0.0047 0.0393 0.0462
Echinococcus multilocularis subfamily S1A unassigned peptidase (S01 family) 0.0047 0.0393 0.0393
Schistosoma mansoni subfamily S1A unassigned peptidase (S01 family) 0.0047 0.0393 0.0462
Echinococcus granulosus Ataxin 2 N terminaldomain containing protein 0.0014 0.0052 0.0061
Schistosoma mansoni cercarial elastase (S01 family) 0.0047 0.0393 0.0462
Schistosoma mansoni nuclear hormone receptor nor-1/nor-2 0.0012 0.0037 0.0044
Echinococcus multilocularis cpg binding protein 0.0037 0.0289 0.0289
Brugia malayi Trypsin family protein 0.0047 0.0393 0.0453
Schistosoma mansoni purine nucleoside phosphorylase 0.0809 0.8245 0.9703
Loa Loa (eye worm) hypothetical protein 0.006 0.0531 0.0784
Plasmodium vivax purine nucleoside phosphorylase, putative 0.0167 0.1637 0.4497
Schistosoma mansoni subfamily S1A unassigned peptidase (S01 family) 0.0047 0.0393 0.0462
Giardia lamblia Purine nucleoside phosphorylase lateral transfer candidate 0.0809 0.8245 1
Schistosoma mansoni nuclear receptor 2DBD-gamma 0.0012 0.0037 0.0044
Loa Loa (eye worm) hypothetical protein 0.0012 0.0037 0.0023
Loa Loa (eye worm) hypothetical protein 0.0641 0.6519 1
Loa Loa (eye worm) hypothetical protein 0.0047 0.0393 0.0571
Onchocerca volvulus 0.0035 0.0269 0.0282
Treponema pallidum uridine phosphorylase (udp) 0.0167 0.1637 1
Mycobacterium ulcerans hypothetical protein 0.0047 0.0393 0.0457
Leishmania major hypothetical protein, conserved 0.0335 0.3365 1
Chlamydia trachomatis AMP nucleosidase 0.0167 0.1637 0.5
Trypanosoma cruzi hypothetical protein, conserved 0.0335 0.3365 1
Onchocerca volvulus 0.0047 0.0393 0.0434
Schistosoma mansoni hypothetical protein 0.0047 0.0393 0.0462
Entamoeba histolytica purine nucleoside phosphorylase, putative 0.0167 0.1637 0.5
Brugia malayi purine nucleoside phosphorylase I, inosine and guanosine-specific family protein 0.0809 0.8245 1
Schistosoma mansoni cercarial elastase (S01 family) 0.0047 0.0393 0.0462
Echinococcus multilocularis Ataxin 2, N terminal,domain containing protein 0.0014 0.0052 0.0052
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0012 0.0037 0.0044
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.0019 0.0107 0.0106
Schistosoma mansoni methylthioadenosine phosphorylase 0.0167 0.1637 0.1926
Loa Loa (eye worm) hypothetical protein 0.0041 0.0335 0.0482
Trichomonas vaginalis conserved hypothetical protein 0.0167 0.1637 0.1969
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0012 0.0037 0.002
Brugia malayi Steroid receptor seven-up type 2 0.0012 0.0037 0.002
Onchocerca volvulus Purine nucleoside phosphorylase homolog 0.0809 0.8245 1
Loa Loa (eye worm) trypsin family protein 0.0047 0.0393 0.0571
Echinococcus multilocularis tissue type plasminogen activator 0.0335 0.3365 0.3365
Schistosoma mansoni cercarial elastase (S01 family) 0.0047 0.0393 0.0462
Entamoeba histolytica MTA/SAH nucleosidase, putative 0.0167 0.1637 0.5
Schistosoma mansoni cercarial elastase (S01 family) 0.0047 0.0393 0.0462
Echinococcus multilocularis purine nucleoside phosphorylase 0.0809 0.8245 0.8245
Echinococcus granulosus methylthioadenosine phosphorylase 0.0167 0.1637 0.1926
Mycobacterium tuberculosis Conserved hypothetical protein 0.0167 0.1637 0.1969
Onchocerca volvulus 0.0047 0.0393 0.0434
Plasmodium falciparum cysteine repeat modular protein 1 0.0335 0.3365 1
Entamoeba histolytica purine nucleoside phosphorylase, putative 0.0167 0.1637 0.5
Onchocerca volvulus 0.0047 0.0393 0.0434
Loa Loa (eye worm) pigment dispersing factor receptor c 0.006 0.0531 0.0784
Echinococcus multilocularis histone lysine N methyltransferase MLL3 0.0011 0.0022 0.0022
Loa Loa (eye worm) hypothetical protein 0.0012 0.0037 0.0023
Schistosoma mansoni ferritin 0.001 0.0017 0.002
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0012 0.0037 0.0037
Echinococcus multilocularis transmembrane protease serine 3 0.0047 0.0393 0.0393
Echinococcus granulosus enteropeptidase 0.0047 0.0393 0.0462
Schistosoma mansoni microtubule-associated protein tau 0.0833 0.8497 1
Brugia malayi Trypsin family protein 0.0047 0.0393 0.0453
Trypanosoma brucei uridine phosphorylase 0.0167 0.1637 1
Schistosoma mansoni retinoic acid receptor RXR 0.0012 0.0037 0.0044
Mycobacterium tuberculosis Probable bifunctional MTA/SAH nucleosidase Mtn: 5'-methylthioadenosine nucleosidase (methylthioadenosine methylthioribohydrolase 0.0167 0.1637 0.1969
Brugia malayi hypothetical protein 0.003 0.0225 0.0249
Trichomonas vaginalis purine nucleoside phosphorylase, putative 0.0167 0.1637 0.1969
Echinococcus multilocularis glycoprotein Antigen 5 0.0047 0.0393 0.0393
Trypanosoma cruzi nucleoside phosphorylase, putative 0.0167 0.1637 0.4497
Schistosoma mansoni ferritin 0.001 0.0017 0.002
Echinococcus multilocularis purine nucleoside phosphorylase 0.0809 0.8245 0.8245
Trichomonas vaginalis purine nucleoside phosphorylase I, putative 0.0809 0.8245 1
Schistosoma mansoni cercarial elastase (S01 family) 0.0047 0.0393 0.0462
Treponema pallidum purine nucleoside phosphorylase (deoD) 0.0167 0.1637 1
Echinococcus multilocularis ecdysone induced protein 78C 0.0012 0.0037 0.0037
Echinococcus granulosus purine nucleoside phosphorylase 0.0809 0.8245 0.9703
Echinococcus granulosus purine nucleoside phosphorylase 0.0809 0.8245 0.9703
Echinococcus multilocularis Mastin 0.0047 0.0393 0.0393
Schistosoma mansoni FTZ-F1 nuclear receptor-like protein 0.0012 0.0037 0.0044
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0012 0.0037 0.002
Brugia malayi Nuclear hormone receptor family member nhr-31 0.0012 0.0037 0.002
Brugia malayi nuclear hormone receptor 0.0012 0.0037 0.002
Schistosoma mansoni subfamily S1A unassigned peptidase (S01 family) 0.0047 0.0393 0.0462
Echinococcus multilocularis Nuclear hormone receptor family member nhr 41 0.0012 0.0037 0.0037
Brugia malayi Nuclear hormone receptor family member nhr-3 0.0012 0.0037 0.002
Schistosoma mansoni cercarial elastase (S01 family) 0.0047 0.0393 0.0462
Schistosoma mansoni uridine phosphorylase 0.0167 0.1637 0.1926
Trypanosoma cruzi methylthioadenosine phosphorylase, putative 0.0167 0.1637 0.4497
Loa Loa (eye worm) hypothetical protein 0.0047 0.0393 0.0571
Echinococcus multilocularis microtubule associated protein 2 0.0833 0.8497 0.8497
Brugia malayi hypothetical protein 0.002 0.0114 0.0113
Echinococcus multilocularis purine nucleoside phosphorylase 0.0809 0.8245 0.8245
Schistosoma mansoni ferritin 0.001 0.0017 0.002
Loa Loa (eye worm) hypothetical protein 0.0047 0.0393 0.0571
Onchocerca volvulus 0.0047 0.0393 0.0434
Schistosoma mansoni cercarial elastase (S01 family) 0.0047 0.0393 0.0462
Schistosoma mansoni subfamily S1A unassigned peptidase (S01 family) 0.0047 0.0393 0.0462
Trichomonas vaginalis purine nucleoside phosphorylase, putative 0.0167 0.1637 0.1969
Echinococcus granulosus FTZ F1 nuclear receptor protein 0.0012 0.0037 0.0044
Brugia malayi Nuclear hormone receptor family member nhr-1 0.0012 0.0037 0.002
Brugia malayi Nuclear hormone receptor family member nhr-41 0.0012 0.0037 0.002
Loa Loa (eye worm) hypothetical protein 0.0012 0.0037 0.0023
Echinococcus granulosus purine nucleoside phosphorylase 0.0809 0.8245 0.9703
Echinococcus multilocularis purine nucleoside phosphorylase 0.0809 0.8245 0.8245
Brugia malayi nuclear receptor NHR-88 0.0012 0.0037 0.002
Echinococcus granulosus GPCR family 2 0.0019 0.0107 0.0126
Schistosoma mansoni methylthioadenosine phosphorylase 0.0167 0.1637 0.1926
Loa Loa (eye worm) hypothetical protein 0.0047 0.0393 0.0571
Echinococcus granulosus subfamily S1A unassigned peptidase S01 family 0.0047 0.0393 0.0462
Brugia malayi Trypsin family protein 0.0047 0.0393 0.0453
Schistosoma mansoni hypothetical protein 0.0014 0.0052 0.0061
Echinococcus multilocularis uridine phosphorylase 1 0.0167 0.1637 0.1637
Loa Loa (eye worm) nuclear hormone receptor family member nhr-49 0.0012 0.0037 0.0023
Loa Loa (eye worm) steroid hormone receptor 0.0012 0.0037 0.0023
Schistosoma mansoni apoferritin-2 0.001 0.0017 0.002
Onchocerca volvulus 0.0335 0.3365 0.4054
Loa Loa (eye worm) latrophilin receptor protein 2 0.0019 0.0107 0.0132
Echinococcus granulosus purine nucleoside phosphorylase 0.0809 0.8245 0.9703
Brugia malayi Nuclear hormone receptor family member nhr-40 0.0012 0.0037 0.002
Loa Loa (eye worm) CXXC zinc finger family protein 0.0035 0.0269 0.038
Echinococcus granulosus Mastin 0.0047 0.0393 0.0462
Echinococcus granulosus transmembrane protease serine 3 0.0047 0.0393 0.0462
Schistosoma mansoni hypothetical protein 0.0494 0.5 0.5885
Leishmania major methylthioadenosine phosphorylase, putative 0.0167 0.1637 0.4497
Schistosoma mansoni coup transcription factor 0.0012 0.0037 0.0044
Schistosoma mansoni steroid hormone receptor ad4bp 0.0012 0.0037 0.0044
Schistosoma mansoni hypothetical protein 0.0019 0.0107 0.0126
Echinococcus granulosus ferritin 0.001 0.0017 0.002
Loa Loa (eye worm) hypothetical protein 0.0047 0.0393 0.0571
Loa Loa (eye worm) hypothetical protein 0.0012 0.0037 0.0023

Activities

Activity type Activity value Assay description Source Reference
Potency (functional) 0.1853 uM PUBCHEM_BIOASSAY: Primary qHTS for delayed death inhibitors of the malarial parasite plastid, 96 hour incubation. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488745, AID488752, AID488774, AID504848, AID504850] ChEMBL. No reference
Potency (functional) 2.3323 uM PUBCHEM_BIOASSAY: Primary qHTS for delayed death inhibitors of the malarial parasite plastid, 48 hour incubation. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488752, AID488774, AID504848, AID504850] ChEMBL. No reference
Potency (functional) = 2.8184 um PUBCHEM_BIOASSAY: VP16 counterscreen qHTS for inhibitors of ROR gamma transcriptional activity. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 3.1623 uM PubChem BioAssay. qHTS for Inhibitors of ATXN expression. (Class of assay: confirmatory) ChEMBL. No reference
Potency (binding) = 8.9125 um PUBCHEM_BIOASSAY: qHTS Assay for Identification of Novel General Anesthetics. In this assay, a GABAergic mimetic model system, apoferritin and a profluorescent 1-aminoanthracene ligand (1-AMA), was used to construct a competitive binding assay for identification of novel general anesthetics (Class of assay: confirmatory) [Related pubchem assays: 2385 (Probe Development Summary for Identification of Novel General Anesthetics), 2323 (Validation apoferritin assay run on SigmaAldrich LOPAC1280 collection)] ChEMBL. No reference
Potency (functional) = 10 um PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors Targeting the Menin-MLL Interaction in MLL Related Leukemias: Competition With Texas Red Labeled MLL-derived Mutant Peptide. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) = 12.5893 um PUBCHEM_BIOASSAY: Counterscreen qHTS for Inhibitors of Tau Fibril Formation, Fluorescence Polarization. This assay monitors tau fibrillation by fluorescence polarization (FP) of Alexa 594-labeled K18 P301L, which does not fibrillize readily but incorporates into growing filaments of unlabeled tau. (Class of assay: confirmatory) [Related pubchem assays: 596 ] ChEMBL. No reference
Potency (functional) = 12.5893 um PUBCHEM_BIOASSAY: qHTS for Inhibitors of Tau Fibril Formation, Fluorescence Polarization. (Class of assay: confirmatory) [Related pubchem assays: 596 ] ChEMBL. No reference
Potency (functional) 12.5893 uM PubChem BioAssay. qHTS of GLP-1 Receptor Inverse Agonists (Inhibition Mode). (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 12.5893 uM PubChem BioAssay. qHTS for Activators of Integrin-Mediated Alleviation for Muscular Dystrophy. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 18.3564 uM PUBCHEM_BIOASSAY: qHTS screen for small molecules that inhibit ELG1-dependent DNA repair in human embryonic kidney (HEK293T) cells expressing luciferase-tagged ELG1. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID493107, AID493125] ChEMBL. No reference
Potency (functional) = 22.3872 um PUBCHEM_BIOASSAY: qHTS Multiplex Assay to Identify Dual Action Probes in a Cell Model of Huntington: Aggregate Formation (GFP). (Class of assay: confirmatory) [Related pubchem assays: 1482, 1471 ] ChEMBL. No reference
Potency (functional) 25.1189 uM PUBCHEM_BIOASSAY: qHTS for Inhibitors of Polymerase Iota. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID588623] ChEMBL. No reference
Potency (functional) 25.1189 uM PubChem BioAssay. qHTS for Agonist of gsp, the Etiologic Mutation Responsible for Fibrous Dysplasia/McCune-Albright Syndrome: qHTS. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 25.929 uM PUBCHEM_BIOASSAY: Nrf2 qHTS screen for inhibitors. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID493153, AID493163, AID504648] ChEMBL. No reference
Potency (functional) 26.8545 uM PUBCHEM_BIOASSAY: qHTS profiling assay for firefly luciferase inhibitor/activator using purified enzyme and Km concentrations of substrates (counterscreen for miR-21 project). (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID2288, AID2289, AID2598, AID411] ChEMBL. No reference
Potency (functional) = 28.1838 um PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Bloom's syndrome helicase (BLM). (Class of assay: confirmatory) [Related pubchem assays: 593 (Fluorescein region spectral profiling screen), 2386 (Probe Development Summary for Inhibitors of Bloom's syndrome helicase (BLM)), 594 (Rhodamine region spectral profiling screen), 2364 (qHTS Validation Assay for Inhibitors of Bloom's syndrome helicase (BLM))] ChEMBL. No reference
Potency (functional) 29.0929 uM PubChem BioAssay. A quantitative high throughput screen for small molecules that induce DNA re-replication in MCF 10a normal breast cells. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) = 35.4813 um PUBCHEM_BIOASSAY: qHTS for inhibitors of ROR gamma transcriptional activity. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) = 35.4813 um PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Human alpha-Glucosidase as a Potential Chaperone Treatment of Pompe Disease. (Class of assay: confirmatory) [Related pubchem assays: 997 ] ChEMBL. No reference
Potency (functional) = 35.4813 um PUBCHEM_BIOASSAY: qHTS Assay for Activators of Human alpha-Glucosidase as a Potential Chaperone Treatment of Pompe Disease. (Class of assay: confirmatory) [Related pubchem assays: 1467, 2100, 2112, 1473, 1466 ] ChEMBL. No reference
Potency (functional) 44.6684 uM PubChem BioAssay. qHTS for Antagonists of gsp, the Etiologic Mutation Responsible for Fibrous Dysplasia/McCune-Albright Syndrome: qHTS. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 56.2341 uM PUBCHEM_BIOASSAY: qHTS Assay for the Inhibitors of Human Flap endonuclease 1 (FEN1). (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488813] ChEMBL. No reference

Phenotypes

Whole-cell/tissue/organism interactions

Species name Source Reference Is orphan
Plasmodium falciparum 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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