Detailed information for compound 50052

Basic information

Technical information
  • TDR Targets ID: 50052
  • Name: ethyl 2-[4-[(6-chloro-1,3-benzoxazol-2-yl)oxy ]phenoxy]propanoate
  • MW: 361.776 | Formula: C18H16ClNO5
  • H donors: 0 H acceptors: 2 LogP: 4.91 Rotable bonds: 7
    Rule of 5 violations (Lipinski): 1
  • SMILES: CCOC(=O)C(Oc1ccc(cc1)Oc1nc2c(o1)cc(cc2)Cl)C
  • InChi: 1S/C18H16ClNO5/c1-3-22-17(21)11(2)23-13-5-7-14(8-6-13)24-18-20-15-9-4-12(19)10-16(15)25-18/h4-11H,3H2,1-2H3
  • InChiKey: PQKBPHSEKWERTG-UHFFFAOYSA-N  


Substructure search Similarity search

Network

Hover on a compound node to display the structore

Synonyms

  • 2-[4-[(6-chloro-1,3-benzoxazol-2-yl)oxy]phenoxy]propanoic acid ethyl ester
  • 2-[4-[(6-chloro-1,3-benzoxazol-2-yl)oxy]phenoxy]propionic acid ethyl ester
  • fenoxaprop ethyl
  • 87714-45-2
  • 82110-72-3
  • 66441-23-4
  • ethyl 2-{4-[(6-chloro-1,3-benzoxazol-2-yl)oxy]phenoxy}propanoate
  • (+/-)-2-(4-((6-Chloro-2-benzoxazolyl)oxy)phenoxy)propanoic acid ethyl ester
  • 2-(4-((6-Chloro-2-benzoxazolylen)oxy)phenoxy)propanoic acid, ethyl ester
  • Acclaim
  • BRN 1166633
  • Caswell No. 431C
  • Depon
  • EINECS 266-362-9
  • EPA Pesticide Chemical Code 128701
  • Ethyl (+-)-2-(4-(6-chloro-2-benzoxazolyloxy)phenoxy)propanoate
  • Ethyl (D+)-2-(4-(6-chlor-2-benzoxazolyloxy)phenoxy)propanoate [French]
  • Ethyl 2-(4-((6-chlorobenzoxazol-2-yl)oxy)phenoxy)propionate
  • Ethyl-2-((4-(6-chloro-2-benzoxazolyloxy))-phenoxy)propionate
  • Excel
  • FENOXAPROP-ETHYL
  • Fenoxaprop ethyl ester [ANSI]
  • Furore
  • HOE 33171
  • HOE-A 25-01
  • HSDB 6848
  • Option
  • PUMA
  • Propanoic acid, 2-(4-((6-chloro-2-benzoxazolyl)oxy)phenoxy)-, ethyl ester, (+-)-
  • Tiller Herbicide
  • Whip
  • C11024
  • Oprea1_660788
  • Propanoic acid, 2-(4-((6-chloro-2-benzoxazolyl)oxy)phenoxy)-, ethyl ester, (.+/-.)-
  • Ethyl 2-(4-[(6-chloro-1,3-benzoxazol-2-yl)oxy]phenoxy)propanoate
  • Oprea1_475947

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens nuclear factor, erythroid 2-like 2 Starlite/ChEMBL No references
Plasmodium falciparum biotin carboxylase subunit of acetyl CoA carboxylase, putative Curated by TDR Targets References
Homo sapiens retinoid X receptor, alpha Starlite/ChEMBL No references
Homo sapiens estrogen receptor 1 Starlite/ChEMBL No references
Homo sapiens thyroid hormone receptor, beta Starlite/ChEMBL No references

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Schistosoma japonicum hypothetical protein Get druggable targets OG5_127493 All targets in OG5_127493
Neospora caninum hypothetical protein Get druggable targets OG5_127493 All targets in OG5_127493
Schistosoma mansoni acetyl-CoA carboxylase Get druggable targets OG5_127493 All targets in OG5_127493
Leishmania infantum acetyl-CoA carboxylase, putative Get druggable targets OG5_127493 All targets in OG5_127493
Leishmania mexicana acetyl-CoA carboxylase, putative Get druggable targets OG5_127493 All targets in OG5_127493
Plasmodium falciparum biotin carboxylase subunit of acetyl CoA carboxylase, putative Get druggable targets OG5_127493 All targets in OG5_127493
Echinococcus multilocularis acetyl coenzyme A carboxylase 1 Get druggable targets OG5_127493 All targets in OG5_127493
Schistosoma japonicum ko:K01961 acetyl-CoA carboxylase [EC6.4.1.2], putative Get druggable targets OG5_127493 All targets in OG5_127493
Trypanosoma cruzi acetyl-CoA carboxylase Get druggable targets OG5_127493 All targets in OG5_127493
Plasmodium yoelii acetyl-CoA carboxylase 1 precursor-related Get druggable targets OG5_127493 All targets in OG5_127493
Loa Loa (eye worm) carboxyl transferase domain-containing protein Get druggable targets OG5_127493 All targets in OG5_127493
Neospora caninum hypothetical protein Get druggable targets OG5_127493 All targets in OG5_127493
Trypanosoma brucei gambiense acetyl-CoA carboxylase, putative Get druggable targets OG5_127493 All targets in OG5_127493
Leishmania donovani acetyl-CoA carboxylase Get druggable targets OG5_127493 All targets in OG5_127493
Schistosoma mansoni retinoic acid receptor RXR Get druggable targets OG5_130073 All targets in OG5_130073
Schistosoma japonicum ko:K08362 nuclear receptor, subfamily 1, group A, member 2, putative Get druggable targets OG5_134830 All targets in OG5_134830
Trypanosoma brucei acetyl-CoA carboxylase Get druggable targets OG5_127493 All targets in OG5_127493
Schistosoma japonicum expressed protein Get druggable targets OG5_134830 All targets in OG5_134830
Plasmodium vivax biotin carboxylase subunit of acetyl CoA carboxylase, putative Get druggable targets OG5_127493 All targets in OG5_127493
Schistosoma japonicum Acetyl-CoA carboxylase, putative Get druggable targets OG5_127493 All targets in OG5_127493
Schistosoma mansoni thyroid hormone receptor Get druggable targets OG5_134830 All targets in OG5_134830
Echinococcus multilocularis Mitotic checkpoint protein PRCC, C terminal Get druggable targets OG5_134830 All targets in OG5_134830
Brugia malayi Carboxyl transferase domain containing protein Get druggable targets OG5_127493 All targets in OG5_127493
Schistosoma japonicum Thyroid hormone receptor alpha, putative Get druggable targets OG5_134830 All targets in OG5_134830
Schistosoma japonicum Acetyl-CoA carboxylase, putative Get druggable targets OG5_127493 All targets in OG5_127493
Schistosoma japonicum ko:K08524 nuclear receptor, subfamily 2, group B, member 1, putative Get druggable targets OG5_130073 All targets in OG5_130073
Leishmania braziliensis acetyl-CoA carboxylase, putative Get druggable targets OG5_127493 All targets in OG5_127493
Cryptosporidium hominis acetyl-CoA carboxylase 2 Get druggable targets OG5_127493 All targets in OG5_127493
Toxoplasma gondii acetyl-CoA carboxylase ACC1 Get druggable targets OG5_127493 All targets in OG5_127493
Schistosoma japonicum Thyroid hormone receptor alpha, putative Get druggable targets OG5_134830 All targets in OG5_134830
Plasmodium berghei biotin carboxylase subunit of acetyl CoA carboxylase, putative Get druggable targets OG5_127493 All targets in OG5_127493
Cryptosporidium parvum acetyl-CoA carboxylase like biotin dependent carboxylase involved in fatty acid biosynthesis Get druggable targets OG5_127493 All targets in OG5_127493
Plasmodium knowlesi biotin carboxylase subunit of acetyl CoA carboxylase, putative Get druggable targets OG5_127493 All targets in OG5_127493
Echinococcus multilocularis thyroid hormone receptor alpha Get druggable targets OG5_134830 All targets in OG5_134830
Schistosoma japonicum ko:K01946 biotin carboxylase [EC6.3.4.14], putative Get druggable targets OG5_127493 All targets in OG5_127493
Trypanosoma congolense acetyl-CoA carboxylase Get druggable targets OG5_127493 All targets in OG5_127493
Candida albicans acetyl-CoA carboxylase Get druggable targets OG5_127493 All targets in OG5_127493
Echinococcus granulosus Mitotic checkpoint protein PRCC C terminal Get druggable targets OG5_134830 All targets in OG5_134830
Echinococcus multilocularis retinoic acid receptor rxr beta a retinoic acid receptor rxr alpha a retinoic acid receptor rxr alpha Get druggable targets OG5_130073 All targets in OG5_130073
Echinococcus granulosus retinoic acid receptor rxr beta a Get druggable targets OG5_130073 All targets in OG5_130073
Leishmania major acetyl-CoA carboxylase, putative Get druggable targets OG5_127493 All targets in OG5_127493
Toxoplasma gondii acetyl-coA carboxylase ACC2 Get druggable targets OG5_127493 All targets in OG5_127493
Schistosoma mansoni hypothetical protein Get druggable targets OG5_134830 All targets in OG5_134830
Schistosoma mansoni thyroid hormone receptor Get druggable targets OG5_134830 All targets in OG5_134830
Echinococcus granulosus acetyl coenzyme A carboxylase 1 Get druggable targets OG5_127493 All targets in OG5_127493
Trypanosoma congolense acetyl-CoA carboxylase Get druggable targets OG5_127493 All targets in OG5_127493
By sequence similarity to non orthologous known druggable targets
Species Potential target Known druggable target Length Alignment span Identity
Brugia malayi ecdysteroid receptor retinoid X receptor, alpha 435 aa 352 aa 23.9 %
Brugia malayi photoreceptor-specific nuclear receptor thyroid hormone receptor, beta 461 aa 414 aa 24.6 %
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Schistosoma mansoni amine GPCR 0.0046 0.0229 0.0105
Brugia malayi hypothetical protein 0.0046 0.0229 0.0105
Toxoplasma gondii phosphorylase family protein 0.0057 0.069 0.2851
Echinococcus multilocularis basement membrane specific heparan sulfate 0.0077 0.1578 0.1472
Brugia malayi Dopamine receptor protein 2 0.0046 0.0229 0.0105
Echinococcus granulosus peptide allatostatin:somatostatin 0.0046 0.0229 0.0105
Wolbachia endosymbiont of Brugia malayi Acetyl/propionyl-CoA carboxylase, alpha subunit 0.0045 0.0194 0.5
Echinococcus multilocularis g protein linked acetylcholine receptor gar 2a 0.0046 0.0229 0.0105
Brugia malayi Dopamine receptor 0.0046 0.0229 0.0105
Mycobacterium ulcerans 5'-methylthioadenosine phosphorylase 0.0057 0.069 0.0506
Echinococcus granulosus purine nucleoside phosphorylase 0.0273 1 1
Brugia malayi hypothetical protein 0.0163 0.5271 0.5211
Echinococcus granulosus neuropeptide FF receptor 2 0.0046 0.0229 0.0105
Schistosoma mansoni neuropeptide receptor 0.0046 0.0229 0.0105
Echinococcus granulosus Mitotic checkpoint protein PRCC C terminal 0.0152 0.4789 0.4723
Echinococcus multilocularis rhodopsin orphan GPCR 0.0046 0.0229 0.0105
Schistosoma mansoni thyrotropin-releasing hormone receptor 0.0046 0.0229 0.0105
Entamoeba histolytica purine nucleoside phosphorylase, putative 0.0057 0.069 1
Schistosoma mansoni nephrin 0.0077 0.1578 0.1472
Schistosoma mansoni defective proboscis extension response (dpr)-related 0.0077 0.1578 0.1472
Schistosoma mansoni histamine-responsive GPCR (AAF21638) 0.0046 0.0229 0.0105
Brugia malayi hypothetical protein 0.0046 0.0229 0.0105
Echinococcus granulosus neuroglian 0.0077 0.1578 0.1472
Plasmodium vivax biotin carboxylase subunit of acetyl CoA carboxylase, putative 0.0086 0.1935 1
Echinococcus multilocularis neuropeptide s receptor 0.0046 0.0229 0.0105
Schistosoma mansoni low-density lipoprotein receptor (ldl) 0.0073 0.1393 0.1284
Echinococcus multilocularis tm gpcr rhodopsin gpcr rhodopsin superfamily 0.0046 0.0229 0.0105
Entamoeba histolytica hypothetical protein 0.0057 0.069 1
Schistosoma mansoni retinoic acid receptor RXR 0.0148 0.4604 0.4536
Echinococcus multilocularis serotonin receptor 0.0046 0.0229 0.0105
Schistosoma mansoni neuropeptide receptor 0.0046 0.0229 0.0105
Echinococcus multilocularis rhodopsin orphan GPCR 0.0046 0.0229 0.0105
Echinococcus multilocularis biogenic amine (5HT) receptor 0.0046 0.0229 0.0105
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0046 0.0229 0.0105
Brugia malayi hypothetical protein 0.0046 0.0229 0.0105
Trypanosoma cruzi nucleoside phosphorylase, putative 0.0057 0.069 1
Echinococcus multilocularis neuropeptides capa receptor 0.0046 0.0229 0.0105
Brugia malayi Dopamine receptor protein 1 0.0046 0.0229 0.0105
Echinococcus multilocularis purine nucleoside phosphorylase 0.0217 0.7569 0.7538
Brugia malayi hypothetical protein 0.0077 0.1578 0.1472
Mycobacterium tuberculosis Hypothetical protein 0.0057 0.069 0.0506
Echinococcus granulosus g protein coupled receptor 0.0046 0.0229 0.0105
Echinococcus granulosus dro:myosuppressin receptor 0.0046 0.0229 0.0105
Echinococcus granulosus orexin receptor type 2 0.0046 0.0229 0.0105
Echinococcus multilocularis G-protein coupled receptor, putative 0.0046 0.0229 0.0105
Schistosoma mansoni biogenic amine receptor 0.0046 0.0229 0.0105
Schistosoma mansoni hypothetical protein 0.0046 0.0229 0.0105
Echinococcus multilocularis conserved hypothetical protein 0.009 0.2137 0.2037
Brugia malayi MTAP 0.0057 0.069 0.0572
Brugia malayi Immunoglobulin I-set domain containing protein 0.009 0.2137 0.2037
Schistosoma mansoni neuropeptide F-like receptor 0.0046 0.0229 0.0105
Echinococcus granulosus defective proboscis extension response 0.0077 0.1578 0.1472
Schistosoma mansoni methylcrotonyl-CoA carboxylase 0.0045 0.0194 0.007
Brugia malayi G-protein-linked acetylcholine receptor protein 2, putative 0.0046 0.0229 0.0105
Brugia malayi Immunoglobulin I-set domain containing protein 0.0077 0.1578 0.1472
Trypanosoma brucei uridine phosphorylase 0.0057 0.069 0.2851
Echinococcus granulosus rhodopsin orphan GPCR 0.0046 0.0229 0.0105
Schistosoma mansoni hypothetical protein 0.0152 0.4789 0.4723
Schistosoma mansoni uridine phosphorylase 0.0057 0.069 0.0572
Echinococcus multilocularis G protein coupled receptor 139 0.0046 0.0229 0.0105
Brugia malayi putative neuropeptide receptor NPR1 0.0046 0.0229 0.0105
Brugia malayi neuropeptide F receptor 0.0046 0.0229 0.0105
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0046 0.0229 0.0105
Trypanosoma brucei methylthioadenosine phosphorylase, putative 0.0057 0.069 0.2851
Schistosoma mansoni vesicular amine transporter 0.0077 0.1578 0.1472
Loa Loa (eye worm) hypothetical protein 0.0077 0.1578 0.1838
Mycobacterium tuberculosis Probable purine nucleoside phosphorylase DeoD (inosine phosphorylase) (PNP) 0.0273 1 1
Schistosoma mansoni neuropeptide F-like receptor 0.0046 0.0229 0.0105
Echinococcus multilocularis Mitotic checkpoint protein PRCC, C terminal 0.0152 0.4789 0.4723
Echinococcus granulosus neuropeptide s receptor 0.0046 0.0229 0.0105
Brugia malayi sulfakinin receptor protein 0.0046 0.0229 0.0105
Echinococcus granulosus neuropeptide Y receptor 0.0046 0.0229 0.0105
Echinococcus granulosus somatostatin receptor 0.0046 0.0229 0.0105
Schistosoma mansoni peptide (FMRFamide/somatostatin)-like receptor 0.0046 0.0229 0.0105
Echinococcus multilocularis rhodopsin orphan GPCR 0.0046 0.0229 0.0105
Echinococcus granulosus rhodopsin orphan GPCR 0.0046 0.0229 0.0105
Echinococcus granulosus purine nucleoside phosphorylase 0.0273 1 1
Schistosoma mansoni muscarinic acetylcholine (GAR) receptor 0.0046 0.0229 0.0105
Schistosoma mansoni biogenic amine (dopamine) receptor 0.0046 0.0229 0.0105
Brugia malayi Immunoglobulin I-set domain containing protein 0.009 0.2137 0.2037
Trypanosoma cruzi 3-methylcrotonyl-CoA carboxylase, putative 0.0045 0.0194 0.2807
Echinococcus granulosus tm gpcr rhodopsin 0.0046 0.0229 0.0105
Echinococcus granulosus purine nucleoside phosphorylase 0.0273 1 1
Brugia malayi Serotonin receptor 0.0046 0.0229 0.0105
Entamoeba histolytica MTA/SAH nucleosidase, putative 0.0057 0.069 1
Echinococcus multilocularis neuropeptide receptor A26 0.0046 0.0229 0.0105
Brugia malayi hypothetical protein 0.0046 0.0229 0.0105
Onchocerca volvulus Putative titin 0.0073 0.1393 0.1192
Echinococcus granulosus neurotracting:lsamp:neurotrimin:obcam 0.0077 0.1578 0.1472
Echinococcus multilocularis rhodopsin orphan GPCR 0.0046 0.0229 0.0105
Echinococcus granulosus tachykinin peptides receptor 99D 0.0046 0.0229 0.0105
Echinococcus multilocularis purine nucleoside phosphorylase 0.0273 1 1
Echinococcus multilocularis neuropeptide receptor 0.0046 0.0229 0.0105
Echinococcus multilocularis neuropeptides capa receptor 0.0046 0.0229 0.0105
Brugia malayi hypothetical protein 0.0046 0.0229 0.0105
Echinococcus multilocularis allatostatin A receptor 0.0046 0.0229 0.0105
Onchocerca volvulus Tyrosine kinase homolog 0.0073 0.1393 0.1192
Echinococcus granulosus low density lipoprotein receptor ldl 0.0073 0.1393 0.1284
Schistosoma mansoni myosin xvIII 0.0046 0.0229 0.0105
Schistosoma mansoni histamine h1 receptor 0.0046 0.0229 0.0105
Schistosoma mansoni hypothetical protein 0.009 0.2137 0.2037
Echinococcus multilocularis neuropeptide Y receptor 0.0046 0.0229 0.0105
Schistosoma mansoni ancient conserved domain protein 2 (cyclin m2) 0.0046 0.0229 0.0105
Echinococcus multilocularis retinoic acid receptor rxr beta a retinoic acid receptor rxr alpha a retinoic acid receptor rxr alpha 0.0133 0.3953 0.3877
Brugia malayi Unidentified vitellogenin-linked transcript protein 6, putative 0.0046 0.0229 0.0105
Echinococcus granulosus g protein linked acetylcholine receptor gar 2a 0.0046 0.0229 0.0105
Loa Loa (eye worm) hypothetical protein 0.0077 0.1578 0.1838
Echinococcus granulosus neuropeptide receptor A26 0.0046 0.0229 0.0105
Echinococcus granulosus neuropeptide receptor 0.0046 0.0229 0.0105
Brugia malayi hypothetical protein 0.0046 0.0229 0.0105
Echinococcus multilocularis somatostatin receptor 0.0046 0.0229 0.0105
Mycobacterium ulcerans bifunctional Mta/Sah nucleosidase Mtn 0.0057 0.069 0.0506
Echinococcus multilocularis roundabout 2 0.0077 0.1578 0.1472
Echinococcus multilocularis propionyl coenzyme A carboxylase alpha chain 0.0045 0.0194 0.007
Echinococcus granulosus 7tm_1 domain containing protein 0.0046 0.0229 0.0105
Schistosoma mansoni amine GPCR 0.0046 0.0229 0.0105
Echinococcus multilocularis hemicentin 1 0.0073 0.1393 0.1284
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0046 0.0229 0.0105
Echinococcus granulosus roundabout 2 0.0077 0.1578 0.1472
Echinococcus multilocularis thyroid hormone receptor alpha 0.0181 0.602 0.597
Echinococcus granulosus fmrfamide receptor 0.0046 0.0229 0.0105
Brugia malayi G protein-coupled receptor F59B2.13 0.0046 0.0229 0.0105
Echinococcus multilocularis 7TM GPCR, rhodopsin 0.0046 0.0229 0.0105
Echinococcus granulosus purine nucleoside phosphorylase 0.0273 1 1
Echinococcus granulosus Immunoglobulin 0.0077 0.1578 0.1472
Schistosoma mansoni purine nucleoside phosphorylase 0.0273 1 1
Schistosoma mansoni hypothetical protein 0.0073 0.1393 0.1284
Schistosoma mansoni acetyl-CoA carboxylase 0.0086 0.1935 0.1833
Echinococcus multilocularis G protein coupled 5 hydroxytryptamine receptor 0.0046 0.0229 0.0105
Echinococcus granulosus neuropeptides capa receptor 0.0046 0.0229 0.0105
Onchocerca volvulus Netrin receptor homolog 0.0073 0.1393 0.1192
Schistosoma mansoni opsin-like receptor 0.0046 0.0229 0.0105
Schistosoma mansoni hypothetical protein 0.009 0.2137 0.2037
Echinococcus multilocularis purine nucleoside phosphorylase 0.0273 1 1
Echinococcus granulosus purine nucleoside phosphorylase 0.0273 1 1
Schistosoma mansoni peptide (allatostatin/somatostatin)-like receptor 0.0046 0.0229 0.0105
Giardia lamblia Purine nucleoside phosphorylase lateral transfer candidate 0.0273 1 1
Brugia malayi hypothetical protein 0.0046 0.0229 0.0105
Schistosoma mansoni amine GPCR 0.0046 0.0229 0.0105
Trypanosoma cruzi 3-methylcrotonyl-CoA carboxylase, putative 0.0045 0.0194 0.2807
Brugia malayi Serotonin receptor 0.0046 0.0229 0.0105
Onchocerca volvulus 0.0073 0.1393 0.1192
Trypanosoma brucei acetyl-CoA carboxylase 0.0086 0.1935 1
Echinococcus granulosus g protein linked acetylcholine receptor gar 2a 0.0046 0.0229 0.0105
Schistosoma mansoni opsin-like receptor 0.0046 0.0229 0.0105
Trypanosoma cruzi methylthioadenosine phosphorylase, putative 0.0057 0.069 1
Schistosoma mansoni methylthioadenosine phosphorylase 0.0057 0.069 0.0572
Echinococcus multilocularis neuropeptide Y receptor 0.0046 0.0229 0.0105
Brugia malayi hypothetical protein 0.0046 0.0229 0.0105
Echinococcus granulosus methylthioadenosine phosphorylase 0.0057 0.069 0.0572
Schistosoma mansoni hypothetical protein 0.0046 0.0229 0.0105
Schistosoma mansoni biogenic amine (5HT) receptor 0.0046 0.0229 0.0105
Loa Loa (eye worm) hypothetical protein 0.0077 0.1578 0.1838
Schistosoma mansoni biogenic amine (dopamine) receptor 0.0046 0.0229 0.0105
Mycobacterium leprae Probable purine nucleoside phosphorylase DeoD (INOSINE PHOSPHORYLASE) (PNP) 0.0273 1 1
Brugia malayi RE15519p 0.0046 0.0229 0.0105
Loa Loa (eye worm) TK/KIN16 protein kinase 0.0077 0.1578 0.1838
Schistosoma mansoni neuropeptide receptor 0.0046 0.0229 0.0105
Brugia malayi hypothetical protein 0.0046 0.0229 0.0105
Loa Loa (eye worm) hypothetical protein 0.0077 0.1578 0.1838
Brugia malayi G protein-coupled receptor 0.0046 0.0229 0.0105
Schistosoma mansoni biogenic amine (dopamine) receptor 0.0046 0.0229 0.0105
Echinococcus granulosus G protein coupled 5 hydroxytryptamine receptor 0.0046 0.0229 0.0105
Brugia malayi Melatonin receptor type 1A 0.0046 0.0229 0.0105
Echinococcus multilocularis low density lipoprotein receptor (ldl) 0.0073 0.1393 0.1284
Echinococcus multilocularis g protein linked acetylcholine receptor gar 2a 0.0046 0.0229 0.0105
Echinococcus granulosus uridine phosphorylase 1 0.0057 0.069 0.0572
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0046 0.0229 0.0105
Leishmania major nucleoside phosphorylase-like protein 0.0057 0.069 0.2851
Schistosoma mansoni biogenic amine (5HT) receptor 0.0046 0.0229 0.0105
Toxoplasma gondii acetyl-CoA carboxylase ACC1 0.0086 0.1935 1
Brugia malayi Fibronectin type III domain containing protein 0.0077 0.1578 0.1472
Loa Loa (eye worm) hypothetical protein 0.0077 0.1578 0.1838
Echinococcus granulosus biogenic amine 5HT receptor 0.0046 0.0229 0.0105
Onchocerca volvulus 0.0073 0.1393 0.1192
Brugia malayi G-protein coupled receptor 0.0046 0.0229 0.0105
Echinococcus multilocularis tachykinin peptides receptor 99D 0.0046 0.0229 0.0105
Echinococcus multilocularis purine nucleoside phosphorylase 0.0273 1 1
Schistosoma mansoni Neurotrimin precursor (hNT) 0.0077 0.1578 0.1472
Schistosoma mansoni neuropeptide f receptor 76f 0.0046 0.0229 0.0105
Echinococcus granulosus neuropeptides capa receptor 0.0046 0.0229 0.0105
Brugia malayi neuropeptide F receptor 0.0046 0.0229 0.0105
Onchocerca volvulus 0.0073 0.1393 0.1192
Loa Loa (eye worm) S-methyl-5'-thioadenosine phosphorylase MTAP 0.0057 0.069 0.0628
Schistosoma mansoni adenoreceptor 0.0046 0.0229 0.0105
Echinococcus granulosus hemicentin 1 0.0073 0.1393 0.1284
Schistosoma mansoni titin 0.0073 0.1393 0.1284
Trichomonas vaginalis purine nucleoside phosphorylase I, putative 0.0273 1 1
Loa Loa (eye worm) hypothetical protein 0.0077 0.1578 0.1838
Onchocerca volvulus Basement membrane proteoglycan homolog 0.0073 0.1393 0.1192
Echinococcus multilocularis Immunoglobulin 0.0077 0.1578 0.1472
Echinococcus granulosus Immunoglobulin 0.009 0.2137 0.2037
Entamoeba histolytica purine nucleoside phosphorylase, putative 0.0057 0.069 1
Echinococcus granulosus purine nucleoside phosphorylase 0.0273 1 1
Echinococcus granulosus pyroglutamylated rfamide peptide receptor 0.0046 0.0229 0.0105
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0046 0.0229 0.0105
Echinococcus multilocularis neuropeptide FF receptor 2 0.0046 0.0229 0.0105
Chlamydia trachomatis AMP nucleosidase 0.0057 0.069 1
Schistosoma mansoni biogenic amine receptor 0.0046 0.0229 0.0105
Loa Loa (eye worm) hypothetical protein 0.0077 0.1578 0.1838
Brugia malayi GnHR receptor homolog 0.0046 0.0229 0.0105
Echinococcus multilocularis irregular chiasm roughest protein immunoglobulin set domain containing protein 0.009 0.2137 0.2037
Brugia malayi Serotonin/octopamine receptor family protein 7 0.0046 0.0229 0.0105
Echinococcus multilocularis rhodopsin orphan GPCR 0.0046 0.0229 0.0105
Echinococcus multilocularis uridine phosphorylase 1 0.0057 0.069 0.0572
Schistosoma mansoni biogenic amine receptor 0.0046 0.0229 0.0105
Treponema pallidum uridine phosphorylase (udp) 0.0057 0.069 0.5
Echinococcus granulosus alpha 1A adrenergic receptor 0.0046 0.0229 0.0105
Loa Loa (eye worm) carboxyl transferase domain-containing protein 0.0081 0.1757 0.2082
Echinococcus multilocularis g protein coupled receptor 0.0046 0.0229 0.0105
Loa Loa (eye worm) hypothetical protein 0.015 0.4713 0.6109
Echinococcus multilocularis serotonin receptor 0.0046 0.0229 0.0105
Echinococcus granulosus 7TM GPCR rhodopsin 0.0046 0.0229 0.0105
Schistosoma mansoni methylcrotonyl-CoA carboxylase 0.0045 0.0194 0.007
Schistosoma mansoni peptide (FMRFamide/somatostatin)-like receptor 0.0046 0.0229 0.0105
Loa Loa (eye worm) immunoglobulin I-set domain-containing protein 0.009 0.2137 0.2599
Trypanosoma cruzi methylthioadenosine phosphorylase, putative 0.0057 0.069 1
Schistosoma mansoni amine GPCR 0.0046 0.0229 0.0105
Brugia malayi G-protein coupled receptor 0.0046 0.0229 0.0105
Schistosoma mansoni opsin-like receptor 0.0046 0.0229 0.0105
Echinococcus granulosus hypothetical protein 0.0046 0.0229 0.0105
Leishmania major methylthioadenosine phosphorylase, putative 0.0057 0.069 0.2851
Echinococcus granulosus nephrin 0.009 0.2137 0.2037
Mycobacterium tuberculosis Probable bifunctional MTA/SAH nucleosidase Mtn: 5'-methylthioadenosine nucleosidase (methylthioadenosine methylthioribohydrolase 0.0057 0.069 0.0506
Echinococcus granulosus irregular chiasm roughest protein 0.009 0.2137 0.2037
Schistosoma mansoni hypothetical protein 0.0046 0.0229 0.0105
Echinococcus multilocularis fmrfamide receptor 0.0046 0.0229 0.0105
Echinococcus granulosus twitchin 0.0077 0.1578 0.1472
Schistosoma mansoni cell adhesion molecule 0.0077 0.1578 0.1472
Brugia malayi Tachykinin-like peptides receptor 99D 0.0046 0.0229 0.0105
Echinococcus multilocularis orexin receptor type 2 0.0046 0.0229 0.0105
Entamoeba histolytica purine nucleoside phosphorylase, putative 0.0057 0.069 1
Echinococcus granulosus g-protein coupled receptor 0.0046 0.0229 0.0105
Echinococcus granulosus purine nucleoside phosphorylase 0.0273 1 1
Onchocerca volvulus 0.0073 0.1393 0.1192
Schistosoma mansoni growth hormone secretagogue receptor 0.0046 0.0229 0.0105
Schistosoma mansoni amine GPCR 0.0046 0.0229 0.0105
Schistosoma mansoni thyroid hormone receptor 0.0181 0.602 0.597
Schistosoma mansoni pyruvate carboxylase 0.0045 0.0194 0.007
Echinococcus multilocularis neuroglian 0.0077 0.1578 0.1472
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0046 0.0229 0.0105
Brugia malayi Immunoglobulin I-set domain containing protein 0.0077 0.1578 0.1472
Echinococcus multilocularis Immunoglobulin 0.0168 0.5456 0.5399
Onchocerca volvulus Purine nucleoside phosphorylase homolog 0.0273 1 1
Loa Loa (eye worm) hypothetical protein 0.0217 0.7569 1
Echinococcus multilocularis dro:myosuppressin receptor 0.0046 0.0229 0.0105
Entamoeba histolytica purine nucleoside phosphorylase, putative 0.0057 0.069 1
Trypanosoma cruzi nucleoside phosphorylase, putative 0.0057 0.069 1
Echinococcus multilocularis growth hormone secretagogue receptor type 1 0.0046 0.0229 0.0105
Brugia malayi ORL1-like opioid receptor 0.0046 0.0229 0.0105
Echinococcus granulosus inosine guanosine and xanthosine phosphorylase 0.0217 0.7569 0.7538
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0046 0.0229 0.0105
Brugia malayi AKH receptor 0.0046 0.0229 0.0105
Schistosoma mansoni purine nucleoside phosphorylase 0.0273 1 1
Echinococcus granulosus contactin 0.0073 0.1393 0.1284
Echinococcus granulosus tm gpcr rhodopsin 0.0046 0.0229 0.0105
Loa Loa (eye worm) hypothetical protein 0.0077 0.1578 0.1838
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0046 0.0229 0.0105
Plasmodium falciparum biotin carboxylase subunit of acetyl CoA carboxylase, putative 0.0086 0.1935 1
Echinococcus granulosus propionyl coenzyme A carboxylase alpha chain 0.0045 0.0194 0.007
Mycobacterium tuberculosis Conserved hypothetical protein 0.0057 0.069 0.0506
Echinococcus granulosus rhodopsin orphan GPCR 0.0046 0.0229 0.0105
Echinococcus granulosus rhodopsin orphan GPCR 0.0046 0.0229 0.0105
Schistosoma mansoni hypothetical protein 0.0046 0.0229 0.0105
Echinococcus multilocularis acetyl coenzyme A carboxylase 1 0.0086 0.1935 0.1833
Mycobacterium leprae probable uridine phosphorylase 0.0057 0.069 0.0506
Leishmania major acetyl-CoA carboxylase, putative 0.0086 0.1935 1
Echinococcus multilocularis tm gpcr rhodopsin gpcr rhodopsin superfamily 0.0046 0.0229 0.0105
Echinococcus granulosus sex peptide receptor 0.0046 0.0229 0.0105
Toxoplasma gondii phosphorylase family protein 0.0057 0.069 0.2851
Echinococcus granulosus retinoic acid receptor rxr beta a 0.0148 0.4604 0.4536
Brugia malayi gonadotropin-releasing hormone receptor 2 0.0046 0.0229 0.0105
Brugia malayi hypothetical protein 0.0046 0.0229 0.0105
Echinococcus multilocularis g protein coupled receptor 0.0046 0.0229 0.0105
Brugia malayi Dopamine receptor protein 1, putative (partial) 0.0046 0.0229 0.0105
Echinococcus multilocularis peptide (allatostatin:somatostatin) 0.0046 0.0229 0.0105
Echinococcus multilocularis rhodopsin orphan GPCR 0.0046 0.0229 0.0105
Echinococcus multilocularis g-protein coupled receptor 0.0046 0.0229 0.0105
Echinococcus multilocularis tm gpcr rhodopsin gpcr rhodopsin superfamily 0.0046 0.0229 0.0105
Schistosoma mansoni neuropeptide receptor 0.0046 0.0229 0.0105
Echinococcus granulosus biogenic amine 5HT receptor 0.0046 0.0229 0.0105
Schistosoma mansoni peptide (allatostatin)-like receptor 0.0046 0.0229 0.0105
Echinococcus multilocularis purine nucleoside phosphorylase 0.0217 0.7569 0.7538
Schistosoma mansoni alpha-1 adrenergic receptor 0.0046 0.0229 0.0105
Brugia malayi uridine phosphorylase family protein 0.0057 0.069 0.0572
Trypanosoma cruzi nucleoside phosphorylase, putative 0.0057 0.069 1
Echinococcus granulosus allatostatin A receptor 0.0046 0.0229 0.0105
Echinococcus granulosus neuropeptide Y receptor 0.0046 0.0229 0.0105
Schistosoma mansoni peptide (FMRFamide/neurokinin-3)-like receptor 0.0046 0.0229 0.0105
Echinococcus granulosus rhodopsin orphan GPCR 0.0046 0.0229 0.0105
Mycobacterium ulcerans purine nucleoside phosphorylase 0.0273 1 1
Echinococcus granulosus neuropeptide receptor 0.0046 0.0229 0.0105
Brugia malayi putative neuropeptide receptor 0.0046 0.0229 0.0105
Brugia malayi follicle stimulating hormone receptor 0.0046 0.0229 0.0105
Echinococcus granulosus g protein coupled receptor 0.0046 0.0229 0.0105
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0046 0.0229 0.0105
Echinococcus multilocularis nephrin 0.009 0.2137 0.2037
Echinococcus multilocularis alpha 1A adrenergic receptor 0.0046 0.0229 0.0105
Schistosoma mansoni methylthioadenosine phosphorylase 0.0057 0.069 0.0572
Brugia malayi Carboxyl transferase domain containing protein 0.0081 0.1757 0.1653
Echinococcus multilocularis sex peptide receptor 0.0046 0.0229 0.0105
Treponema pallidum purine nucleoside phosphorylase (deoD) 0.0057 0.069 0.5
Toxoplasma gondii Purine nucleoside phosphorylase 0.0057 0.069 0.2851
Schistosoma mansoni biogenic amine (octopamine/dopamine) receptor 0.0046 0.0229 0.0105
Echinococcus granulosus G protein coupled receptor 139 0.0046 0.0229 0.0105
Brugia malayi larval opioid receptor 0.0046 0.0229 0.0105
Loa Loa (eye worm) uridine phosphorylase 0.0057 0.069 0.0628
Echinococcus multilocularis thyrotropin releasing hormone receptor 0.0046 0.0229 0.0105
Echinococcus multilocularis purine nucleoside phosphorylase 0.0273 1 1
Echinococcus granulosus growth hormone secretagogue receptor type 1 0.0046 0.0229 0.0105
Echinococcus granulosus rhodopsin orphan GPCR 0.0046 0.0229 0.0105
Echinococcus granulosus g protein coupled receptor 0.0046 0.0229 0.0105
Schistosoma mansoni thyroid hormone receptor 0.0181 0.602 0.597
Echinococcus multilocularis neuropeptide receptor 0.0046 0.0229 0.0105
Echinococcus multilocularis purine nucleoside phosphorylase 0.0273 1 1
Echinococcus granulosus serotonin receptor 0.0046 0.0229 0.0105
Schistosoma mansoni methylthioadenosine phosphorylase 0.0057 0.069 0.0572
Echinococcus granulosus nephrin 0.009 0.2137 0.2037
Loa Loa (eye worm) immunoglobulin I-set domain-containing protein 0.009 0.2137 0.2599
Echinococcus granulosus tm gpcr rhodopsin 0.0046 0.0229 0.0105
Entamoeba histolytica purine nucleoside phosphorylase, putative 0.0057 0.069 1
Echinococcus granulosus purine nucleoside phosphorylase 0.0273 1 1
Echinococcus granulosus rhodopsin orphan GPCR 0.0046 0.0229 0.0105
Echinococcus multilocularis purine nucleoside phosphorylase 0.0273 1 1
Echinococcus multilocularis pyroglutamylated rfamide peptide receptor 0.0046 0.0229 0.0105
Echinococcus multilocularis g protein coupled receptor 0.0046 0.0229 0.0105
Toxoplasma gondii acetyl-coA carboxylase ACC2 0.0086 0.1935 1
Echinococcus granulosus acetyl coenzyme A carboxylase 1 0.0086 0.1935 0.1833
Echinococcus multilocularis rhodopsin orphan GPCR 0.0046 0.0229 0.0105
Echinococcus multilocularis methylthioadenosine phosphorylase 0.0057 0.069 0.0572
Echinococcus granulosus thyrotropin releasing hormone receptor 0.0046 0.0229 0.0105
Schistosoma mansoni uridine phosphorylase 0.0057 0.069 0.0572
Echinococcus multilocularis fmrfamide receptor 0.0046 0.0229 0.0105
Echinococcus multilocularis rhodopsin orphan GPCR 0.0046 0.0229 0.0105
Treponema pallidum pfs protein (pfs) 0.0057 0.069 0.5

Activities

Activity type Activity value Assay description Source Reference
Activity (ADMET) Phytotoxicity against Oryza sativa (rice) plant at two to four-leaf growth stage at <2 g/ha measured after 13 days under green house conditions ChEMBL. No reference
Activity (ADMET) = 70 % Phytotoxicity against Oryza sativa (rice) plant at two to four-leaf growth stage at 50 g/ha measured after 13 days under green house conditions ChEMBL. No reference
Activity (binding) = 9.3 nmol/sec Inhibition of desalted triosephosphate isomerase in Lolium multiflorum (Italian ryegrass) shoot assessed as transformation of GAP to DHAP applied at concentration of 1.80 mg/flat measured per mg protein after 48 hr by coupled enzyme assay (Rvb = 9.80 +/-0.43 nmol/sec) ChEMBL. 19658403
Phytotoxicity (functional) = 0 % Tesed for post-emergent herbicidal activity expressed as phytotoxicity(%) on wheat at application rate 50 g/ha Starlite. No reference
Phytotoxicity (functional) = 70 % Tested for post-emergent herbicidal activity expressed as phytotoxicity(%) on rice at application rate 50 g/ha Starlite. No reference
Phytotoxicity (functional) = 85 % Tested for post-emergent herbicidal activity expressed as phytotoxicity(%) on maize at application rate 50 g/ha Starlite. No reference
Phytotoxicity (functional) = 85 % Tested for post-emergent herbicidal activity expressed as phytotoxicity(%) on wild oats(Avena Avena fatua) at application rate 50 g/ha Starlite. No reference
Phytotoxicity (functional) = 100 % Tested for post-emergent herbicidal activity expressed as phytotoxicity(%) on johnson grass(Sorghum halepense) at application rate 50 g/ha Starlite. No reference
Phytotoxicity (functional) = 100 % Tested for post-emergent herbicidal activity expressed as phytotoxicity(%) on green foxtail(Setaria viridis) at application rate 50 g/ha Starlite. No reference
Phytotoxicity (functional) = 100 % Tested for post-emergent herbicidal activity expressed as phytotoxicity(%) on Barnyard grass(Echinochloa crus-galli) at application rate 50 g/ha Starlite. No reference
Potency (functional) 0.0447 uM PUBCHEM_BIOASSAY: qHTS assay for small molecule antagonists of estrogen receptor alpha signaling. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 15.8489 uM PUBCHEM_BIOASSAY: qHTS assay for small molecule agonists of thyroid hormone receptor beta signaling. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 19.3312 uM PubChem BioAssay: Tox21. qHTS assay for small molecule agonists of the antioxidant response element (ARE) signaling pathway. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 19.9526 uM PUBCHEM_BIOASSAY: qHTS assay for small molecule antagonists of retinoid X receptor alpha signaling. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 31.6228 uM PUBCHEM_BIOASSAY: qHTS assay for small molecule agonists of peroxisome proliferator-activated receptor delta signaling. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 36.303 uM PubChem BioAssay. qHTS assay for small molecule agonists of the antioxidant response element (ARE) signaling pathway measured by Nrf2-dependant transcriptional activity. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 44.6684 uM PUBCHEM_BIOASSAY: qHTS assay for small molecule agonists of androgen receptor signaling. (Class of assay: confirmatory) ChEMBL. No reference

Phenotypes

Whole-cell/tissue/organism interactions

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

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

Annotated phenotypes:

Affected Entity Phenotypic quality Occurs in Occurs at Evidence Observed in Targets
growth (GO:0040007) lethal (sensu genetics) (PATO:0000718) multi-cellular organism (CARO:0000012) bloodstream stage (PLO:0040) in vivo inhibition (TDR:00016) Plasmodium falciparum 2994  
Annotator: saralph@unimelb.edu.au Comment: 012/Mar/09 References: 12499205

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

1 literature reference was collected for this gene.

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