Detailed information for compound 264078

Basic information

Technical information
  • TDR Targets ID: 264078
  • Name: 5-[3-(5-hydroxy-5-oxopentyl)-1,4-dioxonaphtha len-2-yl]pentanoic acid
  • MW: 358.385 | Formula: C20H22O6
  • H donors: 2 H acceptors: 6 LogP: 2.78 Rotable bonds: 10
    Rule of 5 violations (Lipinski): 1
  • SMILES: OC(=O)CCCCC1=C(CCCCC(=O)O)C(=O)c2c(C1=O)cccc2
  • InChi: 1S/C20H22O6/c21-17(22)11-5-3-9-15-16(10-4-6-12-18(23)24)20(26)14-8-2-1-7-13(14)19(15)25/h1-2,7-8H,3-6,9-12H2,(H,21,22)(H,23,24)
  • InChiKey: ZIWFTCLAYMWLOK-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • 5-[3-(5-hydroxy-5-oxo-pentyl)-1,4-dioxo-2-naphthyl]pentanoic acid
  • 5-[3-(5-hydroxy-5-oxopentyl)-1,4-dioxo-2-naphthyl]pentanoic acid
  • 5-[3-(5-hydroxy-5-oxo-pentyl)-1,4-dioxo-naphthalen-2-yl]pentanoic acid
  • 5-[3-(5-hydroxy-5-keto-pentyl)-1,4-diketo-2-naphthyl]valeric acid

Targets

Known targets for this compound

No curated genes were found associated with this compound

Predicted pathogen targets for this compound

By orthology
No druggable targets predicted by orthology data
By sequence similarity to non orthologous known druggable targets
No druggable targets predicted by sequence similarity
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Leishmania major carbonic anhydrase-like protein 0.109 0.4104 0.8598
Loa Loa (eye worm) hypothetical protein 0.0128 0.0236 0.0142
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0128 0.0236 0.0248
Brugia malayi GnHR receptor homolog 0.0128 0.0236 0.0227
Loa Loa (eye worm) hypothetical protein 0.0128 0.0236 0.0142
Echinococcus multilocularis neuropeptides capa receptor 0.0128 0.0236 0.0297
Echinococcus granulosus notch 0.0262 0.0775 0.1586
Loa Loa (eye worm) 5-hydroxytryptamine 2C receptor 0.0128 0.0236 0.0142
Schistosoma mansoni myosin xvIII 0.0128 0.0236 0.0248
Loa Loa (eye worm) hypothetical protein 0.0128 0.0236 0.0142
Brugia malayi hypothetical protein 0.0128 0.0236 0.0227
Brugia malayi Muscle positioning protein 4 0.0262 0.0775 0.1098
Schistosoma mansoni carbonic anhydrase II (carbonate dehydratase II) 0.109 0.4104 0.6477
Loa Loa (eye worm) animal heme peroxidase 0.0811 0.2983 0.2916
Loa Loa (eye worm) G-protein coupled receptor 0.0128 0.0236 0.0142
Schistosoma mansoni carbonic anhydrase 0.0512 0.178 0.2735
Echinococcus granulosus g protein linked acetylcholine receptor gar 2a 0.0128 0.0236 0.0466
Schistosoma mansoni amine GPCR 0.0128 0.0236 0.0248
Mycobacterium ulcerans transmembrane cytochrome C oxidase (subunit II) CtaC 0.009 0.0082 0.0147
Brugia malayi glutathione reductase 0.0116 0.0187 0.0149
Loa Loa (eye worm) hypothetical protein 0.0128 0.0236 0.0142
Trichomonas vaginalis conserved hypothetical protein 0.145 0.5552 1
Brugia malayi EGF-like domain containing protein 0.0262 0.0775 0.1098
Onchocerca volvulus 0.0262 0.0775 0.2599
Onchocerca volvulus Putative sulfate transporter 0.0209 0.0562 0.1885
Brugia malayi hypothetical protein 0.0128 0.0236 0.0227
Echinococcus multilocularis somatostatin receptor 0.0128 0.0236 0.0297
Schistosoma mansoni peroxidasin 0.0811 0.2983 0.4671
Echinococcus granulosus rhodopsin orphan GPCR 0.0128 0.0236 0.0466
Schistosoma mansoni cytochrome c oxidase subunit II 0.0243 0.0697 0.0991
Echinococcus granulosus neurogenic locus notch protein 0.0262 0.0775 0.1586
Loa Loa (eye worm) hypothetical protein 0.0811 0.2983 0.2916
Loa Loa (eye worm) NHE-3 0.0185 0.0467 0.0376
Loa Loa (eye worm) hypothetical protein 0.0262 0.0775 0.0687
Echinococcus multilocularis g-protein coupled receptor 0.0128 0.0236 0.0297
Loa Loa (eye worm) hypothetical protein 0.0811 0.2983 0.2916
Onchocerca volvulus Chorion peroxidase homolog 0.0811 0.2983 1
Schistosoma mansoni carbonic anhydrase II (carbonate dehydratase II) 0.109 0.4104 0.6477
Schistosoma mansoni histamine h1 receptor 0.0128 0.0236 0.0248
Brugia malayi EGF-like domain containing protein 0.0262 0.0775 0.1098
Schistosoma mansoni opsin-like receptor 0.0128 0.0236 0.0248
Echinococcus granulosus neurogenic locus protein delta 0.0262 0.0775 0.1586
Echinococcus multilocularis sodium:hydrogen exchanger 0.0185 0.0467 0.0786
Plasmodium falciparum glutathione reductase 0.0116 0.0187 0.0619
Plasmodium falciparum thioredoxin reductase 0.0116 0.0187 0.0619
Loa Loa (eye worm) hypothetical protein 0.0128 0.0236 0.0142
Echinococcus multilocularis serotonin receptor 0.127 0.4831 1
Trypanosoma brucei carbonic anhydrase-like protein 0.109 0.4104 1
Echinococcus multilocularis G-protein coupled receptor, putative 0.0128 0.0236 0.0297
Echinococcus multilocularis alpha 1A adrenergic receptor 0.0128 0.0236 0.0297
Brugia malayi hypothetical protein 0.0128 0.0236 0.0227
Schistosoma mansoni laminin gamma-3 chain 0.0262 0.0775 0.1116
Brugia malayi Eukaryotic-type carbonic anhydrase family protein 0.0512 0.178 0.272
Echinococcus multilocularis neuropeptides capa receptor 0.0128 0.0236 0.0297
Loa Loa (eye worm) hypothetical protein 0.0262 0.0775 0.0687
Onchocerca volvulus Neuropeptide F receptor homolog 0.0128 0.0236 0.079
Echinococcus granulosus carbonic anhydrase II 0.109 0.4104 0.8493
Schistosoma mansoni carbonic anhydrase-related 0.0512 0.178 0.2735
Loa Loa (eye worm) animal heme peroxidase 0.0811 0.2983 0.2916
Schistosoma mansoni norepinephrine/norepinephrine transporter 0.0093 0.0095 0.0021
Brugia malayi sulfakinin receptor protein 0.0128 0.0236 0.0227
Echinococcus multilocularis peroxidasin 0.0811 0.2983 0.6098
Echinococcus granulosus neuropeptides capa receptor 0.0128 0.0236 0.0466
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0128 0.0236 0.0248
Schistosoma mansoni amine GPCR 0.0128 0.0236 0.0248
Brugia malayi Carbonic anhydrase like protein 2 precursor 0.0512 0.178 0.272
Toxoplasma gondii EGF family domain-containing protein 0.0262 0.0775 0.4082
Brugia malayi Serotonin receptor 0.0128 0.0236 0.0227
Toxoplasma gondii thioredoxin reductase 0.0116 0.0187 0.0619
Brugia malayi Eukaryotic-type carbonic anhydrase family protein 0.109 0.4104 0.647
Brugia malayi hypothetical protein 0.0128 0.0236 0.0227
Loa Loa (eye worm) hypothetical protein 0.127 0.4831 0.4781
Loa Loa (eye worm) eukaryotic-type carbonic anhydrase 0.0512 0.178 0.1702
Brugia malayi larval opioid receptor 0.0128 0.0236 0.0227
Onchocerca volvulus Peroxidasin homolog 0.0811 0.2983 1
Trypanosoma cruzi carbonic anhydrase-like protein, putative 0.109 0.4104 1
Schistosoma mansoni peptide (allatostatin/somatostatin)-like receptor 0.0128 0.0236 0.0248
Echinococcus multilocularis tm gpcr rhodopsin gpcr rhodopsin superfamily 0.0128 0.0236 0.0297
Echinococcus granulosus sodium:hydrogen exchanger 2 nhe2 0.0185 0.0467 0.0946
Onchocerca volvulus 0.0128 0.0236 0.079
Loa Loa (eye worm) hypothetical protein 0.0262 0.0775 0.0687
Echinococcus granulosus sodium:hydrogen exchanger 0.0185 0.0467 0.0946
Echinococcus granulosus g protein coupled receptor 0.0128 0.0236 0.0466
Mycobacterium tuberculosis Beta-carbonic anhydrase 0.0996 0.3726 1
Schistosoma mansoni biogenic amine (octopamine/dopamine) receptor 0.1634 0.6292 1
Schistosoma mansoni alpha-1 adrenergic receptor 0.0128 0.0236 0.0248
Echinococcus multilocularis rhodopsin orphan GPCR 0.0128 0.0236 0.0297
Loa Loa (eye worm) hypothetical protein 0.0128 0.0236 0.0142
Schistosoma mansoni hypothetical protein 0.0128 0.0236 0.0248
Onchocerca volvulus 0.0128 0.0236 0.079
Echinococcus multilocularis 7TM GPCR, rhodopsin 0.0128 0.0236 0.0297
Loa Loa (eye worm) melatonin receptor type 1A 0.0128 0.0236 0.0142
Onchocerca volvulus Dual oxidase homolog 0.0811 0.2983 1
Schistosoma mansoni amine GPCR 0.0128 0.0236 0.0248
Echinococcus multilocularis neuropeptide receptor 0.0128 0.0236 0.0297
Onchocerca volvulus 0.0093 0.0095 0.0318
Echinococcus multilocularis neuropeptide FF receptor 2 0.0128 0.0236 0.0297
Loa Loa (eye worm) hypothetical protein 0.0128 0.0236 0.0142
Plasmodium vivax glutathione reductase, putative 0.0116 0.0187 0.2232
Schistosoma mansoni hypothetical protein 0.0128 0.0236 0.0248
Echinococcus granulosus somatostatin receptor 0.0128 0.0236 0.0466
Echinococcus granulosus allatostatin A receptor 0.0128 0.0236 0.0466
Schistosoma mansoni biogenic amine (dopamine) receptor 0.0128 0.0236 0.0248
Brugia malayi Peroxidasin 0.0811 0.2983 0.466
Brugia malayi Dopamine receptor protein 1 0.0128 0.0236 0.0227
Trichomonas vaginalis conserved hypothetical protein 0.145 0.5552 1
Loa Loa (eye worm) hypothetical protein 0.0128 0.0236 0.0142
Echinococcus granulosus serotonin receptor 0.0128 0.0236 0.0466
Echinococcus multilocularis rhodopsin orphan GPCR 0.0128 0.0236 0.0297
Loa Loa (eye worm) hypothetical protein 0.0128 0.0236 0.0142
Loa Loa (eye worm) hypothetical protein 0.0262 0.0775 0.0687
Schistosoma mansoni peptide (allatostatin)-like receptor 0.0128 0.0236 0.0248
Echinococcus multilocularis neurogenic locus protein delta 0.0262 0.0775 0.1437
Echinococcus granulosus rhodopsin orphan GPCR 0.0128 0.0236 0.0466
Schistosoma mansoni biogenic amine (5HT) receptor 0.127 0.4831 0.7647
Brugia malayi Cadherin domain containing protein 0.0262 0.0775 0.1098
Echinococcus multilocularis peptide (allatostatin:somatostatin) 0.0128 0.0236 0.0297
Echinococcus granulosus slit 2 protein 0.0262 0.0775 0.1586
Echinococcus multilocularis carbonic anhydrase 0.0512 0.178 0.3559
Loa Loa (eye worm) hypothetical protein 0.0128 0.0236 0.0142
Loa Loa (eye worm) hypothetical protein 0.0128 0.0236 0.0142
Brugia malayi Calcium binding EGF domain containing protein 0.0262 0.0775 0.1098
Schistosoma mansoni hypothetical protein 0.0262 0.0775 0.1116
Echinococcus multilocularis g protein linked acetylcholine receptor gar 2a 0.0128 0.0236 0.0297
Echinococcus granulosus rhodopsin orphan GPCR 0.0128 0.0236 0.0466
Brugia malayi hypothetical protein 0.0128 0.0236 0.0227
Schistosoma mansoni notch 0.0262 0.0775 0.1116
Loa Loa (eye worm) hypothetical protein 0.0262 0.0775 0.0687
Brugia malayi RE15519p 0.0128 0.0236 0.0227
Echinococcus granulosus neural cadherin 0.0262 0.0775 0.1586
Echinococcus granulosus growth hormone secretagogue receptor type 1 0.0128 0.0236 0.0466
Schistosoma mansoni peptide (FMRFamide/somatostatin)-like receptor 0.0128 0.0236 0.0248
Loa Loa (eye worm) hypothetical protein 0.0512 0.178 0.1702
Toxoplasma gondii hypothetical protein 0.0512 0.178 1
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0128 0.0236 0.0248
Loa Loa (eye worm) hypothetical protein 0.1634 0.6292 0.6257
Schistosoma mansoni neuropeptide F-like receptor 0.0128 0.0236 0.0248
Echinococcus granulosus tm gpcr rhodopsin 0.0646 0.2321 0.4794
Mycobacterium tuberculosis Beta-carbonic anhydrase CanB 0.0794 0.2917 0.7823
Loa Loa (eye worm) neuropeptide F receptor 0.0128 0.0236 0.0142
Trypanosoma cruzi carbonic anhydrase-like protein, putative 0.109 0.4104 1
Onchocerca volvulus 0.0128 0.0236 0.079
Echinococcus multilocularis orexin receptor type 2 0.0128 0.0236 0.0297
Schistosoma mansoni peroxidasin 0.0811 0.2983 0.4671
Echinococcus granulosus rhodopsin orphan GPCR 0.0128 0.0236 0.0466
Plasmodium falciparum carbonic anhydrase 0.0512 0.178 1
Echinococcus granulosus tachykinin peptides receptor 99D 0.0128 0.0236 0.0466
Loa Loa (eye worm) eukaryotic-type carbonic anhydrase 0.109 0.4104 0.4048
Loa Loa (eye worm) hypothetical protein 0.0128 0.0236 0.0142
Mycobacterium tuberculosis NADPH-dependent mycothiol reductase Mtr 0.0116 0.0187 0.0474
Onchocerca volvulus Cytochrome c oxidase subunit 2 homolog 0.009 0.0082 0.0274
Giardia lamblia High cysteine protein 0.0262 0.0775 1
Entamoeba histolytica carbonic anhydrase, putative 0.1248 0.4743 1
Loa Loa (eye worm) sodium/hydrogen exchanger 0.0185 0.0467 0.0376
Loa Loa (eye worm) hypothetical protein 0.0128 0.0236 0.0142
Schistosoma mansoni sodium/hydrogen exchanger 2 (nhe2) 0.0185 0.0467 0.062
Onchocerca volvulus 0.0128 0.0236 0.079
Echinococcus multilocularis rhodopsin orphan GPCR 0.0128 0.0236 0.0297
Loa Loa (eye worm) glutathione reductase 0.0116 0.0187 0.0093
Schistosoma mansoni sodium/hydrogen exchanger 0.0185 0.0467 0.062
Schistosoma mansoni adenoreceptor 0.0128 0.0236 0.0248
Loa Loa (eye worm) hypothetical protein 0.0128 0.0236 0.0142
Brugia malayi Animal haem peroxidase family protein 0.0811 0.2983 0.466
Loa Loa (eye worm) hypothetical protein 0.0128 0.0236 0.0142
Echinococcus granulosus alpha 1A adrenergic receptor 0.0128 0.0236 0.0466
Echinococcus multilocularis sodium:hydrogen exchanger 2 (nhe2) 0.0185 0.0467 0.0786
Echinococcus multilocularis tachykinin peptides receptor 99D 0.0128 0.0236 0.0297
Brugia malayi hypothetical protein 0.0128 0.0236 0.0227
Echinococcus multilocularis slit 2 protein 0.0262 0.0775 0.1437
Onchocerca volvulus 0.0262 0.0775 0.2599
Echinococcus multilocularis thyrotropin releasing hormone receptor 0.0128 0.0236 0.0297
Echinococcus multilocularis G protein coupled receptor 139 0.0128 0.0236 0.0297
Mycobacterium ulcerans carbonic anhydrase 0.1248 0.4743 0.8543
Echinococcus multilocularis rhodopsin orphan GPCR 0.0128 0.0236 0.0297
Echinococcus granulosus thyrotropin releasing hormone receptor 0.0128 0.0236 0.0466
Loa Loa (eye worm) hypothetical protein 0.0128 0.0236 0.0142
Echinococcus multilocularis neuropeptide s receptor 0.0128 0.0236 0.0297
Onchocerca volvulus Cytochrome c oxidase subunit 2 homolog 0.009 0.0082 0.0274
Echinococcus granulosus carbonic anhydrase 0.0512 0.178 0.3671
Brugia malayi G-protein coupled receptor 0.0128 0.0236 0.0227
Brugia malayi notch-like transmembrane receptor 0.0262 0.0775 0.1098
Loa Loa (eye worm) sodium/hydrogen exchanger 3 family protein 0.0185 0.0467 0.0376
Schistosoma mansoni amine GPCR 0.0128 0.0236 0.0248
Echinococcus granulosus protein jagged 2 0.0262 0.0775 0.1586
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0128 0.0236 0.0248
Onchocerca volvulus Sodium\/hydrogen exchanger homolog 0.0185 0.0467 0.1565
Schistosoma mansoni peptide (FMRFamide/somatostatin)-like receptor 0.0128 0.0236 0.0248
Echinococcus granulosus fibropellin Ia 0.0262 0.0775 0.1586
Onchocerca volvulus 0.0128 0.0236 0.079
Loa Loa (eye worm) hypothetical protein 0.0262 0.0775 0.0687
Loa Loa (eye worm) hypothetical protein 0.0128 0.0236 0.0142
Echinococcus granulosus neuropeptide receptor 0.0128 0.0236 0.0466
Echinococcus granulosus protein jagged 1 0.0262 0.0775 0.1586
Onchocerca volvulus Putative cubilin 0.0262 0.0775 0.2599
Echinococcus multilocularis carbonic anhydrase 0.0512 0.178 0.3559
Echinococcus granulosus rhodopsin orphan GPCR 0.0128 0.0236 0.0466
Loa Loa (eye worm) hypothetical protein 0.127 0.4831 0.4781
Loa Loa (eye worm) hypothetical protein 0.0262 0.0775 0.0687
Plasmodium vivax conserved Plasmodium protein, unknown function 0.0207 0.0553 1
Echinococcus multilocularis sodium:hydrogen exchanger 0.0185 0.0467 0.0786
Schistosoma mansoni hypothetical protein 0.0262 0.0775 0.1116
Schistosoma mansoni neuropeptide receptor 0.0128 0.0236 0.0248
Schistosoma mansoni notch 0.0262 0.0775 0.1116
Echinococcus granulosus neuropeptides capa receptor 0.0128 0.0236 0.0466
Onchocerca volvulus 0.0128 0.0236 0.079
Echinococcus multilocularis carbonic anhydrase 0.0512 0.178 0.3559
Onchocerca volvulus Neurogenic locus notch protein homolog 0.0262 0.0775 0.2599
Mycobacterium tuberculosis Probable transmembrane carbonic anhydrase (carbonate dehydratase) (carbonic dehydratase) 0.0695 0.2519 0.675
Echinococcus multilocularis serotonin receptor 0.127 0.4831 1
Echinococcus multilocularis neuropeptide receptor 0.0128 0.0236 0.0297
Onchocerca volvulus 0.0128 0.0236 0.079
Echinococcus granulosus G protein coupled 5 hydroxytryptamine receptor 0.0128 0.0236 0.0466
Echinococcus granulosus sodium:hydrogen exchanger 2 nhe2 0.0185 0.0467 0.0946
Mycobacterium ulcerans carbonic anhydrase 0.145 0.5552 1
Onchocerca volvulus 0.009 0.0082 0.0274
Onchocerca volvulus 0.0811 0.2983 1
Treponema pallidum sodium- and chloride- dependent transporter 0.0093 0.0095 0.5
Mycobacterium leprae CARBONIC ANHYDRASE (CARBONATE DEHYDRATASE) (CARBONIC DEHYDRATASE) 0.1248 0.4743 1
Loa Loa (eye worm) hypothetical protein 0.0262 0.0775 0.0687
Echinococcus multilocularis neural cadherin 0.0262 0.0775 0.1437
Echinococcus multilocularis biogenic amine (5HT) receptor 0.0128 0.0236 0.0297
Onchocerca volvulus 0.0128 0.0236 0.079
Brugia malayi Putative carbonic anhydrase 5 precursor 0.109 0.4104 0.647
Brugia malayi EGF-like domain containing protein 0.0262 0.0775 0.1098
Echinococcus multilocularis notch 0.0262 0.0775 0.1437
Schistosoma mansoni hypothetical protein 0.0128 0.0236 0.0248
Schistosoma mansoni hypothetical protein 0.0128 0.0236 0.0248
Loa Loa (eye worm) hypothetical protein 0.0811 0.2983 0.2916
Onchocerca volvulus 0.0811 0.2983 1
Echinococcus granulosus orexin receptor type 2 0.0128 0.0236 0.0466
Loa Loa (eye worm) hypothetical protein 0.0185 0.0467 0.0376
Brugia malayi Thioredoxin reductase 0.0116 0.0187 0.0149
Onchocerca volvulus 0.0128 0.0236 0.079
Schistosoma mansoni carbonic anhydrase-related 0.0512 0.178 0.2735
Loa Loa (eye worm) carbonic anhydrase 3 0.109 0.4104 0.4048
Loa Loa (eye worm) hypothetical protein 0.0128 0.0236 0.0142
Echinococcus granulosus sodium:hydrogen exchanger 2 (nhe2) 0.015 0.0325 0.0651
Echinococcus granulosus neuropeptide Y receptor 0.0128 0.0236 0.0466
Echinococcus granulosus sex peptide receptor 0.0128 0.0236 0.0466
Brugia malayi Serotonin receptor 0.0128 0.0236 0.0227
Onchocerca volvulus Cytochrome c oxidase subunit 2 homolog 0.009 0.0082 0.0274
Echinococcus multilocularis g protein coupled receptor 0.0128 0.0236 0.0297
Schistosoma mansoni muscarinic acetylcholine (GAR) receptor 0.0128 0.0236 0.0248
Schistosoma mansoni hypothetical protein 0.0262 0.0775 0.1116
Schistosoma mansoni notch 0.0262 0.0775 0.1116
Brugia malayi hypothetical protein 0.0811 0.2983 0.466
Loa Loa (eye worm) hypothetical protein 0.0262 0.0775 0.0687
Loa Loa (eye worm) hypothetical protein 0.0128 0.0236 0.0142
Brugia malayi neuropeptide F receptor 0.0128 0.0236 0.0227
Echinococcus multilocularis rhodopsin orphan GPCR 0.0128 0.0236 0.0297
Loa Loa (eye worm) hypothetical protein 0.0811 0.2983 0.2916
Echinococcus granulosus dro:myosuppressin receptor 0.0128 0.0236 0.0466
Mycobacterium tuberculosis Probable transmembrane cytochrome C oxidase (subunit II) CtaC 0.009 0.0082 0.0191
Brugia malayi Calcium binding EGF domain containing protein 0.0262 0.0775 0.1098
Echinococcus multilocularis sodium:hydrogen exchanger 2 (nhe2) 0.015 0.0325 0.0486
Echinococcus multilocularis g protein coupled receptor 0.0128 0.0236 0.0297
Echinococcus granulosus hypothetical protein 0.0128 0.0236 0.0466
Onchocerca volvulus Peroxidase homolog 0.0811 0.2983 1
Loa Loa (eye worm) hypothetical protein 0.0128 0.0236 0.0142
Brugia malayi Transmembrane cell adhesion receptor mua-3 precursor, putative 0.0262 0.0775 0.1098
Brugia malayi follicle stimulating hormone receptor 0.0128 0.0236 0.0227
Echinococcus multilocularis g protein linked acetylcholine receptor gar 2a 0.0128 0.0236 0.0297
Loa Loa (eye worm) hypothetical protein 0.0128 0.0236 0.0142
Schistosoma mansoni biogenic amine (5HT) receptor 0.0128 0.0236 0.0248
Brugia malayi Carbonic anhydrase like protein 2 precursor 0.0512 0.178 0.272
Loa Loa (eye worm) hypothetical protein 0.0128 0.0236 0.0142
Schistosoma mansoni biogenic amine receptor 0.0128 0.0236 0.0248
Schistosoma mansoni biogenic amine (dopamine) receptor 0.0128 0.0236 0.0248
Echinococcus granulosus 7TM GPCR rhodopsin 0.0128 0.0236 0.0466
Brugia malayi sodium/hydrogen exchanger 3 family protein 0.0185 0.0467 0.06
Loa Loa (eye worm) hypothetical protein 0.0811 0.2983 0.2916
Echinococcus granulosus g protein linked acetylcholine receptor gar 2a 0.0128 0.0236 0.0466
Onchocerca volvulus 0.0128 0.0236 0.079
Echinococcus multilocularis sex peptide receptor 0.0128 0.0236 0.0297
Loa Loa (eye worm) hypothetical protein 0.0262 0.0775 0.0687
Echinococcus granulosus cytochrome c oxidase subunit II 0.0296 0.0913 0.1872
Loa Loa (eye worm) hypothetical protein 0.0128 0.0236 0.0142
Onchocerca volvulus Peroxidasin homolog 0.0811 0.2983 1
Echinococcus multilocularis growth hormone secretagogue receptor type 1 0.0128 0.0236 0.0297
Loa Loa (eye worm) hypothetical protein 0.1723 0.6649 0.6617
Echinococcus granulosus carbonic anhydrase 0.0512 0.178 0.3671
Echinococcus multilocularis g protein coupled receptor 0.0128 0.0236 0.0297
Schistosoma mansoni growth hormone secretagogue receptor 0.0128 0.0236 0.0248
Loa Loa (eye worm) hypothetical protein 0.0128 0.0236 0.0142
Loa Loa (eye worm) hypothetical protein 0.0128 0.0236 0.0142
Schistosoma mansoni neuropeptide F-like receptor 0.0128 0.0236 0.0248
Schistosoma mansoni peptide (FMRFamide/neurokinin-3)-like receptor 0.0128 0.0236 0.0248
Brugia malayi Cadherin domain containing protein 0.0262 0.0775 0.1098
Brugia malayi G-protein-linked acetylcholine receptor protein 2, putative 0.0128 0.0236 0.0227
Loa Loa (eye worm) hypothetical protein 0.0811 0.2983 0.2916
Echinococcus multilocularis rhodopsin orphan GPCR 0.0128 0.0236 0.0297
Brugia malayi Dopamine receptor protein 2 0.0128 0.0236 0.0227
Echinococcus multilocularis pyroglutamylated rfamide peptide receptor 0.0128 0.0236 0.0297
Schistosoma mansoni biogenic amine (dopamine) receptor 0.0128 0.0236 0.0248
Schistosoma mansoni ancient conserved domain protein 2 (cyclin m2) 0.0128 0.0236 0.0248
Loa Loa (eye worm) hypothetical protein 0.0185 0.0467 0.0376
Loa Loa (eye worm) hypothetical protein 0.0262 0.0775 0.0687
Echinococcus granulosus thioredoxin glutathione reductase 0.0116 0.0187 0.0365
Brugia malayi Melatonin receptor type 1A 0.0128 0.0236 0.0227
Onchocerca volvulus 0.0128 0.0236 0.079
Echinococcus multilocularis neurogenic locus notch protein 0.0262 0.0775 0.1437
Loa Loa (eye worm) hypothetical protein 0.0262 0.0775 0.0687
Echinococcus granulosus neuropeptide FF receptor 2 0.0128 0.0236 0.0466
Echinococcus multilocularis G protein coupled 5 hydroxytryptamine receptor 0.0128 0.0236 0.0297
Echinococcus multilocularis protein jagged 1 0.0262 0.0775 0.1437
Loa Loa (eye worm) hypothetical protein 0.0262 0.0775 0.0687
Onchocerca volvulus 0.0262 0.0775 0.2599
Schistosoma mansoni hypothetical protein 0.0262 0.0775 0.1116
Echinococcus granulosus protein jagged 2 0.0262 0.0775 0.1586
Brugia malayi putative neuropeptide receptor 0.0128 0.0236 0.0227
Onchocerca volvulus 0.0128 0.0236 0.079
Echinococcus granulosus biogenic amine 5HT receptor 0.127 0.4831 1
Loa Loa (eye worm) thioredoxin reductase 0.0116 0.0187 0.0093
Echinococcus multilocularis sodium:hydrogen exchanger 2 (nhe2) 0.0185 0.0467 0.0786
Brugia malayi Calcium binding EGF domain containing protein 0.0262 0.0775 0.1098
Schistosoma mansoni neuropeptide f receptor 76f 0.0128 0.0236 0.0248
Loa Loa (eye worm) hypothetical protein 0.0128 0.0236 0.0142
Mycobacterium tuberculosis Probable conserved transmembrane protein 0.0241 0.0693 0.1835
Loa Loa (eye worm) hypothetical protein 0.0128 0.0236 0.0142
Echinococcus multilocularis neuropeptide receptor A26 0.0128 0.0236 0.0297
Brugia malayi hypothetical protein 0.0128 0.0236 0.0227
Schistosoma mansoni hypothetical protein 0.0262 0.0775 0.1116
Loa Loa (eye worm) hypothetical protein 0.0262 0.0775 0.0687
Loa Loa (eye worm) hypothetical protein 0.0262 0.0775 0.0687
Loa Loa (eye worm) animal heme peroxidase 0.0811 0.2983 0.2916
Onchocerca volvulus Cytochrome c oxidase subunit 2 homolog 0.009 0.0082 0.0274
Brugia malayi G protein-coupled receptor 0.0128 0.0236 0.0227
Loa Loa (eye worm) hypothetical protein 0.0128 0.0236 0.0142
Loa Loa (eye worm) gonadotropin-releasing hormone receptor 2 0.0128 0.0236 0.0142
Loa Loa (eye worm) hypothetical protein 0.0811 0.2983 0.2916
Loa Loa (eye worm) hypothetical protein 0.0128 0.0236 0.0142
Brugia malayi EGF-like domain containing protein 0.0262 0.0775 0.1098
Echinococcus granulosus serotonin transporter 0.0093 0.0095 0.0174
Echinococcus granulosus rhodopsin orphan GPCR 0.0128 0.0236 0.0466
Loa Loa (eye worm) neuropeptide F receptor 0.0128 0.0236 0.0142
Loa Loa (eye worm) hypothetical protein 0.1634 0.6292 0.6257
Schistosoma mansoni histamine-responsive GPCR (AAF21638) 0.0128 0.0236 0.0248
Loa Loa (eye worm) hypothetical protein 0.0128 0.0236 0.0142
Loa Loa (eye worm) G-protein-linked acetylcholine receptor protein 2 0.0128 0.0236 0.0142
Echinococcus granulosus neuropeptide Y receptor 0.0128 0.0236 0.0466
Echinococcus granulosus neuropeptide receptor 0.0128 0.0236 0.0466
Echinococcus granulosus neurogenic locus notch protein 0.0262 0.0775 0.1586
Loa Loa (eye worm) hypothetical protein 0.0811 0.2983 0.2916
Brugia malayi AKH receptor 0.0128 0.0236 0.0227
Echinococcus granulosus neuropeptide receptor A26 0.0128 0.0236 0.0466
Schistosoma mansoni septate junction protein 0.0262 0.0775 0.1116
Brugia malayi Serotonin/octopamine receptor family protein 7 0.1634 0.6292 1
Loa Loa (eye worm) hypothetical protein 0.0128 0.0236 0.0142
Echinococcus granulosus neuropeptide s receptor 0.0128 0.0236 0.0466
Onchocerca volvulus Peroxidase homolog 0.0811 0.2983 1
Loa Loa (eye worm) hypothetical protein 0.0262 0.0775 0.0687
Echinococcus granulosus sodium:hydrogen exchanger 2 nhe2 0.0185 0.0467 0.0946
Loa Loa (eye worm) hypothetical protein 0.0128 0.0236 0.0142
Brugia malayi Delta serrate ligand family protein 0.0262 0.0775 0.1098
Echinococcus granulosus fmrfamide receptor 0.0128 0.0236 0.0466
Onchocerca volvulus 0.0128 0.0236 0.079
Brugia malayi EGF-like domain containing protein 0.0262 0.0775 0.1098
Loa Loa (eye worm) notch protein 0.0262 0.0775 0.0687
Echinococcus granulosus protein jagged 1 0.0262 0.0775 0.1586
Echinococcus granulosus peptide allatostatin:somatostatin 0.0128 0.0236 0.0466
Schistosoma mansoni slit 0.0262 0.0775 0.1116
Schistosoma mansoni thyrotropin-releasing hormone receptor 0.0128 0.0236 0.0248
Schistosoma mansoni sodium/chloride dependent transporter 0.0093 0.0095 0.0021
Onchocerca volvulus Sodium\/hydrogen exchanger homolog 0.0185 0.0467 0.1565
Onchocerca volvulus 0.0811 0.2983 1
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0128 0.0236 0.0248
Echinococcus granulosus peroxidasin 0.0811 0.2983 0.6166
Loa Loa (eye worm) hypothetical protein 0.0128 0.0236 0.0142
Loa Loa (eye worm) hypothetical protein 0.0811 0.2983 0.2916
Schistosoma mansoni Pro-neuregulin-4 membrane-bound isoform (Pro-NRG4) [Contains: Neuregulin-4 (NRG-4)] 0.0262 0.0775 0.1116
Onchocerca volvulus 0.0262 0.0775 0.2599
Echinococcus multilocularis neurogenic locus protein delta 0.0262 0.0775 0.1437
Echinococcus granulosus carbonic anhydrase 0.0512 0.178 0.3671
Schistosoma mansoni neuropeptide receptor 0.0128 0.0236 0.0248
Wolbachia endosymbiont of Brugia malayi cytochrome c oxidase, subunit 2 0.0296 0.0913 1
Loa Loa (eye worm) Notch2 0.0262 0.0775 0.0687
Loa Loa (eye worm) hypothetical protein 0.0128 0.0236 0.0142
Brugia malayi Eukaryotic-type carbonic anhydrase family protein 0.0512 0.178 0.272
Brugia malayi gonadotropin-releasing hormone receptor 2 0.0128 0.0236 0.0227
Schistosoma mansoni hypothetical protein 0.0512 0.178 0.2735
Brugia malayi G-protein coupled receptor 0.0128 0.0236 0.0227
Onchocerca volvulus 0.0209 0.0562 0.1885
Schistosoma mansoni notch 0.0262 0.0775 0.1116
Loa Loa (eye worm) animal heme peroxidase 0.0811 0.2983 0.2916
Schistosoma mansoni carbonic anhydrase-related 0.0512 0.178 0.2735
Loa Loa (eye worm) unidentified vitellogenin-linked transcript protein 6 0.0128 0.0236 0.0142
Loa Loa (eye worm) hypothetical protein 0.0128 0.0236 0.0142
Onchocerca volvulus Sodium\/hydrogen exchanger homolog 0.0185 0.0467 0.1565
Brugia malayi G protein-coupled receptor F59B2.13 0.0128 0.0236 0.0227
Echinococcus multilocularis allatostatin A receptor 0.0128 0.0236 0.0297
Loa Loa (eye worm) hypothetical protein 0.0811 0.2983 0.2916
Loa Loa (eye worm) follicle stimulating hormone receptor 0.0128 0.0236 0.0142
Schistosoma mansoni carbonic anhydrase 0.1248 0.4743 0.7505
Brugia malayi hypothetical protein 0.0128 0.0236 0.0227
Brugia malayi hypothetical protein 0.0128 0.0236 0.0227
Echinococcus multilocularis thioredoxin glutathione reductase 0.0116 0.0187 0.0195
Echinococcus multilocularis neurogenic locus notch protein 0.0262 0.0775 0.1437
Onchocerca volvulus 0.0128 0.0236 0.079
Echinococcus granulosus tm gpcr rhodopsin 0.0128 0.0236 0.0466
Loa Loa (eye worm) hypothetical protein 0.0811 0.2983 0.2916
Brugia malayi Unidentified vitellogenin-linked transcript protein 6, putative 0.0128 0.0236 0.0227
Brugia malayi Animal haem peroxidase family protein 0.0811 0.2983 0.466
Echinococcus multilocularis tm gpcr rhodopsin gpcr rhodopsin superfamily 0.0128 0.0236 0.0297
Echinococcus granulosus rhodopsin orphan GPCR 0.0128 0.0236 0.0466
Loa Loa (eye worm) hypothetical protein 0.0512 0.178 0.1702
Loa Loa (eye worm) hypothetical protein 0.0262 0.0775 0.0687
Echinococcus multilocularis neuropeptide Y receptor 0.0128 0.0236 0.0297
Loa Loa (eye worm) blistered cuticle protein 3 0.0811 0.2983 0.2916
Onchocerca volvulus 0.0128 0.0236 0.079
Brugia malayi Animal haem peroxidase family protein 0.0811 0.2983 0.466
Loa Loa (eye worm) hypothetical protein 0.0128 0.0236 0.0142
Loa Loa (eye worm) hypothetical protein 0.0811 0.2983 0.2916
Brugia malayi EGF-like domain containing protein 0.0262 0.0775 0.1098
Echinococcus granulosus neurogenic locus notch protein 4 0.0262 0.0775 0.1586
Echinococcus multilocularis protein jagged 1 0.0262 0.0775 0.1437
Mycobacterium leprae Probable transmembrane transport protein 0.0241 0.0693 0.146
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0128 0.0236 0.0248
Loa Loa (eye worm) TYRA-2 protein 0.0128 0.0236 0.0142
Echinococcus multilocularis fibropellin Ia 0.0262 0.0775 0.1437
Schistosoma mansoni amine GPCR 0.0128 0.0236 0.0248
Onchocerca volvulus 0.0128 0.0236 0.079
Brugia malayi ORL1-like opioid receptor 0.0128 0.0236 0.0227
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0128 0.0236 0.0248
Brugia malayi Tachykinin-like peptides receptor 99D 0.0128 0.0236 0.0227
Brugia malayi Eukaryotic-type carbonic anhydrase family protein 0.0512 0.178 0.272
Echinococcus multilocularis neuropeptide Y receptor 0.0128 0.0236 0.0297
Brugia malayi putative neuropeptide receptor NPR1 0.0128 0.0236 0.0227
Brugia malayi Dopamine receptor protein 1, putative (partial) 0.0128 0.0236 0.0227
Loa Loa (eye worm) hypothetical protein 0.0128 0.0236 0.0142
Loa Loa (eye worm) hypothetical protein 0.0262 0.0775 0.0687
Schistosoma mansoni biogenic amine receptor 0.0128 0.0236 0.0248
Onchocerca volvulus Neurogenic locus notch homolog 0.0262 0.0775 0.2599
Schistosoma mansoni opsin-like receptor 0.0128 0.0236 0.0248
Schistosoma mansoni notch 0.0262 0.0775 0.1116
Echinococcus granulosus sodium:hydrogen exchanger 0.0185 0.0467 0.0946
Loa Loa (eye worm) hypothetical protein 0.0128 0.0236 0.0142
Echinococcus granulosus 7tm_1 domain containing protein 0.0128 0.0236 0.0466
Schistosoma mansoni cell polarity protein 0.0262 0.0775 0.1116
Schistosoma mansoni hypothetical protein 0.0262 0.0775 0.1116
Onchocerca volvulus Slit protein homolog 0.0262 0.0775 0.2599
Echinococcus granulosus g-protein coupled receptor 0.0128 0.0236 0.0466
Echinococcus multilocularis rhodopsin orphan GPCR 0.0128 0.0236 0.0297
Echinococcus multilocularis fmrfamide receptor 0.0128 0.0236 0.0297
Brugia malayi neuropeptide F receptor 0.0128 0.0236 0.0227
Loa Loa (eye worm) hypothetical protein 0.0262 0.0775 0.0687
Schistosoma mansoni hypothetical protein 0.0262 0.0775 0.1116
Echinococcus granulosus g protein coupled receptor 0.0128 0.0236 0.0466
Loa Loa (eye worm) hypothetical protein 0.0262 0.0775 0.0687
Onchocerca volvulus Dopamine\/Ecdysteroid receptor homolog 0.0128 0.0236 0.079
Plasmodium vivax thioredoxin reductase, putative 0.0116 0.0187 0.2232
Brugia malayi GCC2 and GCC3 family protein 0.0262 0.0775 0.1098
Echinococcus multilocularis fmrfamide receptor 0.0128 0.0236 0.0297
Echinococcus multilocularis dro:myosuppressin receptor 0.0128 0.0236 0.0297
Loa Loa (eye worm) hypothetical protein 0.0811 0.2983 0.2916
Echinococcus multilocularis tm gpcr rhodopsin gpcr rhodopsin superfamily 0.0646 0.2321 0.4702
Loa Loa (eye worm) hypothetical protein 0.0128 0.0236 0.0142
Echinococcus multilocularis sodium:hydrogen exchanger 2 (nhe2) 0.0185 0.0467 0.0786
Schistosoma mansoni neuropeptide receptor 0.0128 0.0236 0.0248
Echinococcus granulosus G protein coupled receptor 139 0.0128 0.0236 0.0466
Schistosoma mansoni biogenic amine receptor 0.0128 0.0236 0.0248
Brugia malayi EGF-like domain containing protein 0.0262 0.0775 0.1098
Loa Loa (eye worm) hypothetical protein 0.0128 0.0236 0.0142
Loa Loa (eye worm) hypothetical protein 0.0262 0.0775 0.0687
Loa Loa (eye worm) hypothetical protein 0.0811 0.2983 0.2916
Echinococcus multilocularis protein jagged 2 0.0262 0.0775 0.1437
Echinococcus multilocularis rhodopsin orphan GPCR 0.0128 0.0236 0.0297
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0128 0.0236 0.0248
Schistosoma mansoni opsin-like receptor 0.0128 0.0236 0.0248
Onchocerca volvulus 0.0262 0.0775 0.2599
Brugia malayi hypothetical protein 0.0128 0.0236 0.0227
Echinococcus multilocularis carbonic anhydrase II 0.109 0.4104 0.8466
Onchocerca volvulus 0.0128 0.0236 0.079
Echinococcus multilocularis fat cadherin tumor suppressor 0.0262 0.0775 0.1437
Echinococcus multilocularis neurogenic locus notch protein 4 0.0262 0.0775 0.1437
Brugia malayi Blistered cuticle protein 3 0.0811 0.2983 0.466
Leishmania major carbonic anhydrase family protein, putative 0.1248 0.4743 1
Schistosoma mansoni neuropeptide receptor 0.0128 0.0236 0.0248
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0128 0.0236 0.0248
Echinococcus granulosus biogenic amine 5HT receptor 0.0128 0.0236 0.0466
Schistosoma mansoni notch 0.0262 0.0775 0.1116
Echinococcus granulosus g protein coupled receptor 0.0128 0.0236 0.0466
Brugia malayi Animal haem peroxidase family protein 0.0811 0.2983 0.466
Echinococcus granulosus delta-like protein 1 0.0262 0.0775 0.1586
Brugia malayi Animal haem peroxidase family protein 0.0811 0.2983 0.466
Loa Loa (eye worm) hypothetical protein 0.0185 0.0467 0.0376
Brugia malayi Dopamine receptor 0.0128 0.0236 0.0227
Loa Loa (eye worm) hypothetical protein 0.0262 0.0775 0.0687
Echinococcus granulosus pyroglutamylated rfamide peptide receptor 0.0128 0.0236 0.0466
Echinococcus granulosus tm gpcr rhodopsin 0.0128 0.0236 0.0466
Loa Loa (eye worm) G-protein coupled receptor 0.0128 0.0236 0.0142

Activities

Activity type Activity value Assay description Source Reference
ED50 (functional) > 80 uM In vitro antiparasitic activity against L. donavani was tested by sigmoidal regression analysis ChEMBL. 11170645
ED50 (functional) = 80 uM In vitro antiparasitic activity against Trypanosoma cruzi was tested by sigmoidal regression analysis ChEMBL. 11170645
ED50 (functional) > 80 uM In vitro antiparasitic activity against Trypanosoma brucei was tested by sigmoidal regression analysis ChEMBL. 11170645
ED50 (functional) = 80 uM In vitro antiparasitic activity against Trypanosoma cruzi was tested by sigmoidal regression analysis ChEMBL. 11170645
ED50 (functional) > 80 uM In vitro antiparasitic activity against Trypanosoma brucei was tested by sigmoidal regression analysis ChEMBL. 11170645
IC50 (binding) > 50 uM Inhibitory activity against Trypanosoma cruzi trypanothione disulfide reductase, assay in presence of 57 microM T(S)2. ChEMBL. 11170645
IC50 (binding) > 50 uM Inhibitory activity against Trypanosoma cruzi trypanothione disulfide reductase, assay in presence of 57 microM T(S)2. ChEMBL. 11170645

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

1 literature reference was collected for this gene.

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