Detailed information for compound 347075

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 386.789 | Formula: C18H15ClN4O4
  • H donors: 5 H acceptors: 5 LogP: 1.81 Rotable bonds: 6
    Rule of 5 violations (Lipinski): 1
  • SMILES: CC(=O)Nc1ccc(cc1)NC(=O)c1c[nH]nc1c1cc(Cl)c(cc1O)O
  • InChi: 1S/C18H15ClN4O4/c1-9(24)21-10-2-4-11(5-3-10)22-18(27)13-8-20-23-17(13)12-6-14(19)16(26)7-15(12)25/h2-8,25-26H,1H3,(H,20,23)(H,21,24)(H,22,27)
  • InChiKey: ILQMLJRCOQFSII-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

No synonyms found for this compound

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
Echinococcus multilocularis g protein linked acetylcholine receptor gar 2a 0.0173 0.4296 0.4253
Schistosoma mansoni opsin-like receptor 0.0173 0.4296 0.4296
Loa Loa (eye worm) hypothetical protein 0.0017 0.0335 0.0234
Mycobacterium tuberculosis Probable aldehyde dehydrogenase 0.0059 0.1395 0.1404
Echinococcus multilocularis nuclear receptor nhr 48 0.0008 0.0104 0.003
Schistosoma mansoni nuclear receptor 2DBD-gamma 0.0017 0.0335 0.0335
Echinococcus multilocularis rhodopsin orphan GPCR 0.0173 0.4296 0.4253
Schistosoma mansoni amine GPCR 0.0173 0.4296 0.4296
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0017 0.0335 0.0234
Onchocerca volvulus Steroid hormone receptor family member cnr14 homolog 0.0017 0.0335 0.055
Loa Loa (eye worm) hypothetical protein 0.0173 0.4296 0.4246
Loa Loa (eye worm) G-protein-linked acetylcholine receptor protein 2 0.0173 0.4296 0.4246
Brugia malayi G protein-coupled receptor 0.0173 0.4296 0.4246
Loa Loa (eye worm) gonadotropin-releasing hormone receptor 2 0.0173 0.4296 0.4246
Echinococcus multilocularis G protein coupled receptor 139 0.0173 0.4296 0.4253
Brugia malayi Serotonin receptor 0.0173 0.4296 0.4246
Schistosoma mansoni cpg binding protein 0.003 0.0648 0.0648
Schistosoma mansoni inositol monophosphatase 0.0036 0.0808 0.0808
Echinococcus multilocularis tm gpcr rhodopsin gpcr rhodopsin superfamily 0.0173 0.4296 0.4253
Loa Loa (eye worm) hypothetical protein 0.0173 0.4296 0.4246
Echinococcus granulosus g protein coupled receptor 0.0173 0.4296 0.4253
Echinococcus granulosus rhodopsin orphan GPCR 0.0173 0.4296 0.4253
Toxoplasma gondii aldehyde dehydrogenase 0.0059 0.1395 1
Loa Loa (eye worm) hypothetical protein 0.0017 0.0335 0.0234
Echinococcus multilocularis Nuclear hormone receptor HR96 0.0008 0.0104 0.003
Loa Loa (eye worm) hypothetical protein 0.0173 0.4296 0.4246
Loa Loa (eye worm) hypothetical protein 0.0173 0.4296 0.4246
Schistosoma mansoni retinoid-x-receptor (RXR) 0.0009 0.0129 0.0129
Schistosoma mansoni neuropeptide F-like receptor 0.0173 0.4296 0.4296
Echinococcus granulosus g-protein coupled receptor 0.0173 0.4296 0.4253
Schistosoma mansoni RAR-like nuclear receptor 0.0017 0.0335 0.0335
Echinococcus granulosus G protein coupled receptor 139 0.0173 0.4296 0.4253
Echinococcus granulosus thyrotropin releasing hormone receptor 0.0173 0.4296 0.4253
Schistosoma mansoni neuropeptide receptor 0.0173 0.4296 0.4296
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0173 0.4296 0.4296
Echinococcus granulosus cpg binding protein 0.003 0.0648 0.0578
Echinococcus granulosus dro:myosuppressin receptor 0.0173 0.4296 0.4253
Echinococcus multilocularis neuropeptides capa receptor 0.0173 0.4296 0.4253
Echinococcus multilocularis ecdysone induced protein 78C 0.0017 0.0335 0.0263
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0017 0.0335 0.0234
Echinococcus granulosus tachykinin peptides receptor 99D 0.0173 0.4296 0.4253
Brugia malayi hypothetical protein 0.0173 0.4296 0.4246
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0173 0.4296 0.4296
Schistosoma mansoni hypothetical protein 0.0173 0.4296 0.4296
Onchocerca volvulus 0.0173 0.4296 1
Echinococcus granulosus FTZ F1 nuclear receptor protein 0.0017 0.0335 0.0263
Echinococcus multilocularis thyroid hormone receptor alpha 0.014 0.3444 0.3395
Echinococcus multilocularis serotonin receptor 0.0173 0.4296 0.4253
Brugia malayi CXXC zinc finger family protein 0.0028 0.0608 0.051
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0017 0.0335 0.0263
Schistosoma mansoni aldehyde dehydrogenase 0.0059 0.1395 0.1395
Loa Loa (eye worm) G-protein coupled receptor 0.0173 0.4296 0.4246
Schistosoma mansoni peptide (allatostatin/somatostatin)-like receptor 0.0173 0.4296 0.4296
Schistosoma mansoni nuclear receptor nhr-48 0.0008 0.0104 0.0104
Loa Loa (eye worm) hypothetical protein 0.0173 0.4296 0.4246
Loa Loa (eye worm) nuclear hormone receptor family member nhr-1 0.0017 0.0335 0.0234
Onchocerca volvulus 0.0173 0.4296 1
Schistosoma mansoni coup transcription factor 0.0017 0.0335 0.0335
Loa Loa (eye worm) hypothetical protein 0.0035 0.0786 0.069
Echinococcus granulosus fmrfamide receptor 0.0173 0.4296 0.4253
Mycobacterium tuberculosis Probable conserved lipoprotein 0.0035 0.0786 0.0149
Brugia malayi Inositol-1 0.0036 0.0808 0.0713
Brugia malayi Steroid receptor seven-up type 2 0.0017 0.0335 0.0234
Loa Loa (eye worm) hypothetical protein 0.0009 0.0129 0.0025
Echinococcus multilocularis histone lysine N methyltransferase MLL3 0.0009 0.0118 0.0044
Echinococcus granulosus Nuclear hormone receptor family member nhr 41 0.0017 0.0335 0.0263
Loa Loa (eye worm) hypothetical protein 0.0035 0.0786 0.069
Echinococcus multilocularis 7TM GPCR, rhodopsin 0.0173 0.4296 0.4253
Schistosoma mansoni amine GPCR 0.0173 0.4296 0.4296
Brugia malayi follicle stimulating hormone receptor 0.0397 0.9977 1
Schistosoma mansoni biogenic amine receptor 0.0173 0.4296 0.4296
Echinococcus granulosus neuropeptide Y receptor 0.0173 0.4296 0.4253
Schistosoma mansoni thyroid hormone receptor 0.014 0.3444 0.3444
Echinococcus granulosus neuropeptide s receptor 0.0173 0.4296 0.4253
Loa Loa (eye worm) hypothetical protein 0.0173 0.4296 0.4246
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0017 0.0335 0.0263
Echinococcus granulosus Mitotic checkpoint protein PRCC C terminal 0.0123 0.3007 0.2955
Echinococcus multilocularis orexin receptor type 2 0.0173 0.4296 0.4253
Echinococcus multilocularis growth hormone secretagogue receptor type 1 0.0173 0.4296 0.4253
Echinococcus granulosus biogenic amine 5HT receptor 0.0173 0.4296 0.4253
Mycobacterium tuberculosis Probable esterase LipL 0.0035 0.0786 0.0149
Loa Loa (eye worm) nuclear hormone receptor-like 1 0.0009 0.0129 0.0025
Echinococcus multilocularis rhodopsin orphan GPCR 0.0173 0.4296 0.4253
Brugia malayi RE15519p 0.0173 0.4296 0.4246
Schistosoma mansoni hypothetical protein 0.0173 0.4296 0.4296
Brugia malayi nuclear receptor RXR 0.0009 0.0129 0.0025
Echinococcus granulosus FTZ F1 alpha 0.0017 0.0335 0.0263
Schistosoma mansoni hypothetical protein 0.0173 0.4296 0.4296
Loa Loa (eye worm) hypothetical protein 0.0173 0.4296 0.4246
Loa Loa (eye worm) hypothetical protein 0.0173 0.4296 0.4246
Loa Loa (eye worm) hypothetical protein 0.0017 0.0335 0.0234
Schistosoma mansoni adenoreceptor 0.0173 0.4296 0.4296
Loa Loa (eye worm) hypothetical protein 0.0173 0.4296 0.4246
Echinococcus multilocularis G protein coupled 5 hydroxytryptamine receptor 0.0173 0.4296 0.4253
Loa Loa (eye worm) hypothetical protein 0.0035 0.0786 0.069
Brugia malayi G protein-coupled receptor F59B2.13 0.0173 0.4296 0.4246
Trypanosoma cruzi myo-inositol-1(or 4)-monophosphatase 1, putative 0.0036 0.0808 1
Schistosoma mansoni nuclear hormone receptor nor-1/nor-2 0.0017 0.0335 0.0335
Echinococcus multilocularis allatostatin A receptor 0.0173 0.4296 0.4253
Schistosoma mansoni histamine h1 receptor 0.0173 0.4296 0.4296
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0007 0.0074 0.0074
Echinococcus granulosus 7tm_1 domain containing protein 0.0173 0.4296 0.4253
Loa Loa (eye worm) beta-lactamase 0.0035 0.0786 0.069
Schistosoma mansoni histamine-responsive GPCR (AAF21638) 0.0173 0.4296 0.4296
Echinococcus granulosus neuropeptide FF receptor 2 0.0173 0.4296 0.4253
Loa Loa (eye worm) hypothetical protein 0.0017 0.0335 0.0234
Loa Loa (eye worm) hypothetical protein 0.0173 0.4296 0.4246
Schistosoma mansoni thyroid hormone receptor 0.014 0.3444 0.3444
Loa Loa (eye worm) neuropeptide F receptor 0.0173 0.4296 0.4246
Echinococcus multilocularis Nuclear hormone receptor HR96 0.0008 0.0104 0.003
Echinococcus multilocularis alpha 1A adrenergic receptor 0.0173 0.4296 0.4253
Loa Loa (eye worm) hypothetical protein 0.0035 0.0786 0.069
Onchocerca volvulus 0.0173 0.4296 1
Echinococcus multilocularis rhodopsin orphan GPCR 0.0173 0.4296 0.4253
Echinococcus multilocularis neuropeptides capa receptor 0.0173 0.4296 0.4253
Loa Loa (eye worm) inositol-1 0.0036 0.0808 0.0713
Schistosoma mansoni nuclear hormone receptor superfamily protein-related 0.0008 0.0104 0.0104
Brugia malayi F/Y-rich N-terminus family protein 0.0009 0.0115 0.0011
Trichomonas vaginalis D-aminoacylase, putative 0.0035 0.0786 0.9694
Loa Loa (eye worm) nuclear hormone receptor family member nhr-49 0.0017 0.0335 0.0234
Brugia malayi Dopamine receptor 0.0173 0.4296 0.4246
Trichomonas vaginalis esterase, putative 0.0035 0.0786 0.9694
Echinococcus granulosus neuropeptide Y receptor 0.0173 0.4296 0.4253
Schistosoma mansoni neuropeptide f receptor 76f 0.0173 0.4296 0.4296
Echinococcus granulosus pyroglutamylated rfamide peptide receptor 0.0173 0.4296 0.4253
Brugia malayi Serotonin receptor 0.0173 0.4296 0.4246
Loa Loa (eye worm) hypothetical protein 0.0173 0.4296 0.4246
Brugia malayi hypothetical protein 0.0173 0.4296 0.4246
Loa Loa (eye worm) hypothetical protein 0.0173 0.4296 0.4246
Echinococcus granulosus hypothetical protein 0.0173 0.4296 0.4253
Loa Loa (eye worm) hypothetical protein 0.0017 0.0335 0.0234
Loa Loa (eye worm) hypothetical protein 0.0009 0.0129 0.0025
Echinococcus multilocularis peptide (allatostatin:somatostatin) 0.0173 0.4296 0.4253
Echinococcus granulosus rhodopsin orphan GPCR 0.0173 0.4296 0.4253
Brugia malayi Unidentified vitellogenin-linked transcript protein 6, putative 0.0173 0.4296 0.4246
Loa Loa (eye worm) melatonin receptor type 1A 0.0173 0.4296 0.4246
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0008 0.0104 0.003
Loa Loa (eye worm) hypothetical protein 0.0173 0.4296 0.4246
Echinococcus granulosus somatostatin receptor 0.0173 0.4296 0.4253
Schistosoma mansoni neuropeptide F-like receptor 0.0173 0.4296 0.4296
Echinococcus multilocularis somatostatin receptor 0.0173 0.4296 0.4253
Echinococcus multilocularis tachykinin peptides receptor 99D 0.0173 0.4296 0.4253
Echinococcus granulosus thyroid hormone receptor alpha 0.0008 0.0104 0.003
Loa Loa (eye worm) nuclear hormone receptor family member nhr-41 0.0017 0.0335 0.0234
Loa Loa (eye worm) follicle stimulating hormone receptor 0.0397 0.9977 1
Schistosoma mansoni biogenic amine (5HT) receptor 0.0173 0.4296 0.4296
Loa Loa (eye worm) hypothetical protein 0.0173 0.4296 0.4246
Mycobacterium tuberculosis Probable hydrolase 0.0035 0.0786 0.0149
Schistosoma mansoni Tr4/Tr2 (homologue) 0.0017 0.0335 0.0335
Echinococcus multilocularis tm gpcr rhodopsin gpcr rhodopsin superfamily 0.0173 0.4296 0.4253
Brugia malayi Melatonin receptor type 1A 0.0173 0.4296 0.4246
Echinococcus granulosus neuropeptides capa receptor 0.0173 0.4296 0.4253
Brugia malayi Tachykinin-like peptides receptor 99D 0.0173 0.4296 0.4246
Brugia malayi hypothetical protein 0.0173 0.4296 0.4246
Echinococcus multilocularis hepatocyte nuclear factor 4 alpha 0.0017 0.0335 0.0263
Entamoeba histolytica myo-inositol monophosphatase, putative 0.0036 0.0808 0.5
Echinococcus multilocularis thyrotropin releasing hormone receptor 0.0173 0.4296 0.4253
Schistosoma mansoni thyrotropin-releasing hormone receptor 0.0173 0.4296 0.4296
Echinococcus granulosus biogenic amine 5HT receptor 0.0173 0.4296 0.4253
Mycobacterium ulcerans aldehyde dehydrogenase 0.0059 0.1395 1
Echinococcus granulosus orexin receptor type 2 0.0173 0.4296 0.4253
Echinococcus granulosus sex peptide receptor 0.0173 0.4296 0.4253
Onchocerca volvulus 0.0173 0.4296 1
Toxoplasma gondii histone lysine methyltransferase SET1 0.0053 0.1242 0.7495
Echinococcus multilocularis neuropeptide receptor 0.0173 0.4296 0.4253
Echinococcus multilocularis rhodopsin orphan GPCR 0.0173 0.4296 0.4253
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0035 0.0786 0.0786
Loa Loa (eye worm) hypothetical protein 0.0173 0.4296 0.4246
Brugia malayi Cytochrome P450 family protein 0.0022 0.0457 0.0357
Loa Loa (eye worm) hypothetical protein 0.0009 0.0129 0.0025
Schistosoma mansoni amine GPCR 0.0173 0.4296 0.4296
Echinococcus multilocularis neuropeptide FF receptor 2 0.0173 0.4296 0.4253
Brugia malayi Dopamine receptor protein 1, putative (partial) 0.0173 0.4296 0.4246
Loa Loa (eye worm) hypothetical protein 0.0173 0.4296 0.4246
Onchocerca volvulus 0.0173 0.4296 1
Loa Loa (eye worm) hypothetical protein 0.0173 0.4296 0.4246
Echinococcus granulosus ecdysone induced protein 78C 0.0017 0.0335 0.0263
Mycobacterium ulcerans aldehyde dehydrogenase 0.0059 0.1395 1
Echinococcus granulosus tm gpcr rhodopsin 0.0173 0.4296 0.4253
Echinococcus multilocularis cpg binding protein 0.003 0.0648 0.0578
Loa Loa (eye worm) hypothetical protein 0.0173 0.4296 0.4246
Echinococcus granulosus rhodopsin orphan GPCR 0.0173 0.4296 0.4253
Loa Loa (eye worm) nuclear hormone receptor family member nhr-40 0.0017 0.0335 0.0234
Echinococcus granulosus g protein coupled receptor 0.0173 0.4296 0.4253
Brugia malayi ecdysteroid receptor 0.0017 0.0335 0.0234
Toxoplasma gondii inositol(myo)-1(or 4)-monophosphatase 2, putative 0.0036 0.0808 0.0377
Schistosoma mansoni nuclear receptor 0.0008 0.0104 0.0104
Schistosoma mansoni peptide (FMRFamide/somatostatin)-like receptor 0.0173 0.4296 0.4296
Onchocerca volvulus Dopamine\/Ecdysteroid receptor homolog 0.0173 0.4296 1
Echinococcus granulosus beta LACTamase domain containing family member 0.0035 0.0786 0.0716
Echinococcus multilocularis g protein coupled receptor 0.0173 0.4296 0.4253
Echinococcus granulosus Nuclear hormone receptor HR96 0.0008 0.0104 0.003
Schistosoma mansoni hepatocyte nuclear factor 4-alpha (hnf-4-alpha) 0.0008 0.0104 0.0104
Onchocerca volvulus 0.0173 0.4296 1
Brugia malayi AKH receptor 0.0173 0.4296 0.4246
Loa Loa (eye worm) unidentified vitellogenin-linked transcript protein 6 0.0173 0.4296 0.4246
Echinococcus granulosus aldehyde dehydrogenase mitochondrial 0.0059 0.1395 0.133
Schistosoma mansoni biogenic amine (5HT) receptor 0.0173 0.4296 0.4296
Mycobacterium tuberculosis Probable lipase LipE 0.0035 0.0786 0.0149
Echinococcus granulosus retinoic acid receptor rxr beta a 0.0017 0.0335 0.0263
Loa Loa (eye worm) hypothetical protein 0.0173 0.4296 0.4246
Schistosoma mansoni peptide (allatostatin)-like receptor 0.0173 0.4296 0.4296
Brugia malayi Serotonin/octopamine receptor family protein 7 0.0173 0.4296 0.4246
Brugia malayi putative neuropeptide receptor NPR1 0.0173 0.4296 0.4246
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0017 0.0335 0.0234
Brugia malayi Nuclear hormone receptor family member nhr-3 0.0017 0.0335 0.0234
Onchocerca volvulus 0.0173 0.4296 1
Echinococcus multilocularis dnaJ subfamily B 0.0398 1 1
Brugia malayi putative neuropeptide receptor 0.0173 0.4296 0.4246
Schistosoma mansoni myosin xvIII 0.0173 0.4296 0.4296
Brugia malayi gonadotropin-releasing hormone receptor 2 0.0173 0.4296 0.4246
Mycobacterium tuberculosis Conserved protein 0.0035 0.0786 0.0149
Echinococcus multilocularis tm gpcr rhodopsin gpcr rhodopsin superfamily 0.0173 0.4296 0.4253
Mycobacterium tuberculosis Conserved protein 0.0035 0.0786 0.0149
Loa Loa (eye worm) 5-hydroxytryptamine 2C receptor 0.0173 0.4296 0.4246
Loa Loa (eye worm) hypothetical protein 0.0173 0.4296 0.4246
Trichomonas vaginalis myo inositol monophosphatase, putative 0.0036 0.0808 1
Brugia malayi Dopamine receptor protein 2 0.0173 0.4296 0.4246
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0035 0.0786 0.0786
Echinococcus multilocularis neuropeptide Y receptor 0.0173 0.4296 0.4253
Schistosoma mansoni amine GPCR 0.0173 0.4296 0.4296
Echinococcus multilocularis nuclear receptor subfamily 4 group A 0.0008 0.0104 0.003
Mycobacterium ulcerans extragenic suppressor protein SuhB 0.0036 0.0808 0.0377
Loa Loa (eye worm) hypothetical protein 0.0173 0.4296 0.4246
Schistosoma mansoni biogenic amine (dopamine) receptor 0.0173 0.4296 0.4296
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0173 0.4296 0.4296
Onchocerca volvulus 0.0028 0.0608 0.12
Wolbachia endosymbiont of Brugia malayi fructose-1,6-bisphosphatase 0.0036 0.0808 0.5
Schistosoma mansoni zinc finger protein 0.0008 0.0104 0.0104
Loa Loa (eye worm) hypothetical protein 0.0173 0.4296 0.4246
Loa Loa (eye worm) G-protein coupled receptor 0.0173 0.4296 0.4246
Echinococcus multilocularis rhodopsin orphan GPCR 0.0173 0.4296 0.4253
Onchocerca volvulus 0.0173 0.4296 1
Schistosoma mansoni biogenic amine receptor 0.0173 0.4296 0.4296
Loa Loa (eye worm) hypothetical protein 0.0173 0.4296 0.4246
Plasmodium vivax hypothetical protein, conserved 0.0035 0.0786 0.5
Loa Loa (eye worm) steroid hormone receptor 0.0017 0.0335 0.0234
Schistosoma mansoni nuclear hormone receptor 0.0008 0.0104 0.0104
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0017 0.0335 0.0263
Echinococcus granulosus rhodopsin orphan GPCR 0.0173 0.4296 0.4253
Echinococcus multilocularis FTZ F1 alpha 0.0017 0.0335 0.0263
Brugia malayi neuropeptide F receptor 0.0173 0.4296 0.4246
Echinococcus granulosus peptide allatostatin:somatostatin 0.0173 0.4296 0.4253
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0017 0.0335 0.0234
Brugia malayi beta-lactamase family protein 0.0035 0.0786 0.069
Loa Loa (eye worm) hypothetical protein 0.0173 0.4296 0.4246
Schistosoma mansoni ancient conserved domain protein 2 (cyclin m2) 0.0173 0.4296 0.4296
Brugia malayi hypothetical protein 0.0173 0.4296 0.4246
Echinococcus granulosus COUP TF:Svp nuclear hormone receptor 0.0017 0.0335 0.0263
Echinococcus granulosus rhodopsin orphan GPCR 0.0173 0.4296 0.4253
Loa Loa (eye worm) nuclear hormone receptor family member nhr-14 0.0017 0.0335 0.0234
Echinococcus granulosus g protein linked acetylcholine receptor gar 2a 0.0173 0.4296 0.4253
Schistosoma mansoni biogenic amine (dopamine) receptor 0.0173 0.4296 0.4296
Brugia malayi hypothetical protein 0.0173 0.4296 0.4246
Schistosoma mansoni hypothetical protein 0.0398 1 1
Echinococcus multilocularis g-protein coupled receptor 0.0173 0.4296 0.4253
Schistosoma mansoni neuropeptide receptor 0.0173 0.4296 0.4296
Schistosoma mansoni retinoid-x-receptor (RXR) 0.0017 0.0335 0.0335
Brugia malayi photoreceptor-specific nuclear receptor 0.0017 0.0335 0.0234
Echinococcus granulosus hepatocyte nuclear factor 4 alpha 0.0017 0.0335 0.0263
Echinococcus multilocularis nuclear receptor subfamily 1 group D 0.0009 0.0129 0.0055
Echinococcus granulosus histone lysine N methyltransferase MLL3 0.0009 0.0118 0.0044
Trichomonas vaginalis D-aminoacylase, putative 0.0035 0.0786 0.9694
Echinococcus granulosus growth hormone secretagogue receptor type 1 0.0173 0.4296 0.4253
Loa Loa (eye worm) hypothetical protein 0.0173 0.4296 0.4246
Trichomonas vaginalis penicillin-binding protein, putative 0.0035 0.0786 0.9694
Loa Loa (eye worm) nuclear Hormone Receptor family member 0.0017 0.0335 0.0234
Mycobacterium tuberculosis Probable lipase LipD 0.0035 0.0786 0.0149
Echinococcus multilocularis serotonin receptor 0.0173 0.4296 0.4253
Echinococcus multilocularis neuropeptide receptor A26 0.0173 0.4296 0.4253
Echinococcus granulosus inositol monophosphatase 1 0.0036 0.0808 0.0739
Echinococcus granulosus nuclear receptor nhr 48 0.0008 0.0104 0.003
Loa Loa (eye worm) hypothetical protein 0.0173 0.4296 0.4246
Loa Loa (eye worm) hypothetical protein 0.0009 0.0129 0.0025
Loa Loa (eye worm) hypothetical protein 0.0173 0.4296 0.4246
Loa Loa (eye worm) hypothetical protein 0.0173 0.4296 0.4246
Schistosoma mansoni alpha-1 adrenergic receptor 0.0173 0.4296 0.4296
Brugia malayi steroid hormone receptor 0.0017 0.0335 0.0234
Loa Loa (eye worm) hypothetical protein 0.0035 0.0786 0.069
Brugia malayi G-protein coupled receptor 0.0173 0.4296 0.4246
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0059 0.1403 0.1403
Schistosoma mansoni opsin-like receptor 0.0173 0.4296 0.4296
Echinococcus multilocularis dro:myosuppressin receptor 0.0173 0.4296 0.4253
Loa Loa (eye worm) hypothetical protein 0.0017 0.0335 0.0234
Brugia malayi beta-lactamase family protein 0.0035 0.0786 0.069
Schistosoma mansoni growth hormone secretagogue receptor 0.0173 0.4296 0.4296
Schistosoma mansoni FTZ-F1 nuclear receptor-like protein 0.0017 0.0335 0.0335
Loa Loa (eye worm) CXXC zinc finger family protein 0.0028 0.0608 0.051
Loa Loa (eye worm) hypothetical protein 0.0173 0.4296 0.4246
Schistosoma mansoni nuclear hormone receptor 0.0017 0.0335 0.0335
Brugia malayi G-protein coupled receptor 0.0173 0.4296 0.4246
Onchocerca volvulus Bile acid receptor homolog 0.0017 0.0335 0.055
Trypanosoma brucei inositol-1(or 4)-monophosphatase 1, putative 0.0036 0.0808 1
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0008 0.0104 0.003
Loa Loa (eye worm) histone methyltransferase 0.0009 0.0118 0.0014
Schistosoma mansoni neuropeptide receptor 0.0173 0.4296 0.4296
Mycobacterium leprae Probable lipase LipE 0.0035 0.0786 1
Trypanosoma cruzi myo-inositol-1(or 4)-monophosphatase 1, putative 0.0036 0.0808 1
Schistosoma mansoni biogenic amine receptor 0.0173 0.4296 0.4296
Loa Loa (eye worm) hypothetical protein 0.0173 0.4296 0.4246
Mycobacterium tuberculosis Probable esterase/lipase LipP 0.0035 0.0786 0.0149
Echinococcus multilocularis neuropeptide Y receptor 0.0173 0.4296 0.4253
Echinococcus multilocularis neuropeptide receptor 0.0173 0.4296 0.4253
Brugia malayi Nuclear hormone receptor family member nhr-14 0.0017 0.0335 0.0234
Loa Loa (eye worm) hypothetical protein 0.0173 0.4296 0.4246
Echinococcus multilocularis sex peptide receptor 0.0173 0.4296 0.4253
Echinococcus multilocularis retinoic acid receptor rxr beta a retinoic acid receptor rxr alpha a retinoic acid receptor rxr alpha 0.0008 0.0104 0.003
Mycobacterium tuberculosis Conserved protein 0.0035 0.0786 0.0149
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0173 0.4296 0.4296
Echinococcus multilocularis aldehyde dehydrogenase, mitochondrial 0.0059 0.1395 0.133
Schistosoma mansoni aldehyde dehydrogenase 0.0059 0.1395 0.1395
Brugia malayi Nuclear hormone receptor family member nhr-1 0.0017 0.0335 0.0234
Loa Loa (eye worm) hypothetical protein 0.0173 0.4296 0.4246
Loa Loa (eye worm) hypothetical protein 0.0173 0.4296 0.4246
Brugia malayi Nuclear hormone receptor family member nhr-41 0.0017 0.0335 0.0234
Schistosoma mansoni photoreceptor-specific nuclear receptor related 0.0017 0.0335 0.0335
Schistosoma mansoni biogenic amine (dopamine) receptor 0.0173 0.4296 0.4296
Echinococcus granulosus G protein coupled 5 hydroxytryptamine receptor 0.0173 0.4296 0.4253
Loa Loa (eye worm) hypothetical protein 0.0173 0.4296 0.4246
Echinococcus granulosus neuropeptide receptor 0.0173 0.4296 0.4253
Echinococcus multilocularis rhodopsin orphan GPCR 0.0173 0.4296 0.4253
Loa Loa (eye worm) nuclear hormone receptor family member nhr-31 0.0017 0.0335 0.0234
Brugia malayi hypothetical protein 0.0173 0.4296 0.4246
Brugia malayi larval opioid receptor 0.0173 0.4296 0.4246
Brugia malayi hypothetical protein 0.0173 0.4296 0.4246
Brugia malayi Nuclear hormone receptor-like 1 0.0009 0.0129 0.0025
Echinococcus granulosus 7TM GPCR rhodopsin 0.0173 0.4296 0.4253
Echinococcus granulosus tm gpcr rhodopsin 0.0173 0.4296 0.4253
Schistosoma mansoni nuclear receptor 0.0008 0.0104 0.0104
Echinococcus multilocularis inositol monophosphatase 1 0.0036 0.0808 0.0739
Echinococcus granulosus rhodopsin orphan GPCR 0.0173 0.4296 0.4253
Brugia malayi Nuclear hormone receptor-like 1 0.0009 0.0129 0.0025
Onchocerca volvulus 0.0173 0.4296 1
Brugia malayi hypothetical protein 0.0009 0.0129 0.0025
Brugia malayi sulfakinin receptor protein 0.0173 0.4296 0.4246
Onchocerca volvulus 0.0173 0.4296 1
Echinococcus multilocularis Nuclear hormone receptor family member nhr 41 0.0017 0.0335 0.0263
Echinococcus granulosus neuropeptide receptor A26 0.0173 0.4296 0.4253
Trichomonas vaginalis inositol monophosphatase, putative 0.0036 0.0808 1
Brugia malayi hypothetical protein 0.0009 0.0129 0.0025
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0017 0.0335 0.0234
Echinococcus multilocularis G-protein coupled receptor, putative 0.0173 0.4296 0.4253
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0173 0.4296 0.4296
Onchocerca volvulus 0.0173 0.4296 1
Echinococcus multilocularis neuropeptide s receptor 0.0173 0.4296 0.4253
Schistosoma mansoni muscarinic acetylcholine (GAR) receptor 0.0173 0.4296 0.4296
Onchocerca volvulus 0.0035 0.0786 0.1625
Loa Loa (eye worm) hypothetical protein 0.0173 0.4296 0.4246
Brugia malayi GnHR receptor homolog 0.0173 0.4296 0.4246
Echinococcus multilocularis COUP TF:Svp nuclear hormone receptor 0.0017 0.0335 0.0263
Brugia malayi Dopamine receptor protein 1 0.0173 0.4296 0.4246
Loa Loa (eye worm) neuropeptide F receptor 0.0173 0.4296 0.4246
Brugia malayi hypothetical protein 0.0173 0.4296 0.4246
Loa Loa (eye worm) cytochrome P450 family protein 0.0022 0.0457 0.0357
Echinococcus multilocularis Mitotic checkpoint protein PRCC, C terminal 0.0123 0.3007 0.2955
Leishmania major aldehyde dehydrogenase, mitochondrial precursor 0.0059 0.1395 1
Echinococcus multilocularis fmrfamide receptor 0.0173 0.4296 0.4253
Brugia malayi Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative 0.0035 0.0786 0.069
Echinococcus multilocularis fmrfamide receptor 0.0173 0.4296 0.4253
Brugia malayi Nuclear hormone receptor family member nhr-31 0.0017 0.0335 0.0234
Echinococcus granulosus serotonin receptor 0.0173 0.4296 0.4253
Brugia malayi neuropeptide F receptor 0.0173 0.4296 0.4246
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0017 0.0335 0.0263
Schistosoma mansoni neuropeptide receptor 0.0173 0.4296 0.4296
Schistosoma mansoni steroid hormone receptor ad4bp 0.0017 0.0335 0.0335
Echinococcus granulosus allatostatin A receptor 0.0173 0.4296 0.4253
Schistosoma mansoni ecdysone-induced protein 78c (dr-78) 0.0009 0.0129 0.0129
Schistosoma mansoni peptide (FMRFamide/neurokinin-3)-like receptor 0.0173 0.4296 0.4296
Loa Loa (eye worm) hypothetical protein 0.0173 0.4296 0.4246
Echinococcus multilocularis FTZ F1 nuclear receptor protein 0.0017 0.0335 0.0263
Mycobacterium tuberculosis Possible conserved lipoprotein LpqK 0.0035 0.0786 0.0149
Echinococcus multilocularis g protein coupled receptor 0.0173 0.4296 0.4253
Schistosoma mansoni opsin-like receptor 0.0173 0.4296 0.4296
Onchocerca volvulus Protein ultraspiracle homolog 0.0017 0.0335 0.055
Echinococcus granulosus nuclear receptor subfamily 1 group D 0.0009 0.0129 0.0055
Echinococcus granulosus neuropeptide receptor 0.0173 0.4296 0.4253
Echinococcus multilocularis pyroglutamylated rfamide peptide receptor 0.0173 0.4296 0.4253
Echinococcus granulosus tm gpcr rhodopsin 0.0173 0.4296 0.4253
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0173 0.4296 0.4296
Echinococcus multilocularis beta LACTamase domain containing family member 0.0035 0.0786 0.0716
Echinococcus multilocularis g protein coupled receptor 0.0173 0.4296 0.4253
Loa Loa (eye worm) hypothetical protein 0.0173 0.4296 0.4246
Loa Loa (eye worm) hypothetical protein 0.0017 0.0335 0.0234
Leishmania major myo-inositol-1(or 4)-monophosphatase 1, putative 0.0036 0.0808 0.0377
Echinococcus multilocularis g protein linked acetylcholine receptor gar 2a 0.0173 0.4296 0.4253
Echinococcus granulosus alpha 1A adrenergic receptor 0.0173 0.4296 0.4253
Trichomonas vaginalis myo inositol monophosphatase, putative 0.0036 0.0808 1
Echinococcus granulosus neuropeptides capa receptor 0.0173 0.4296 0.4253
Schistosoma mansoni hypothetical protein 0.0123 0.3007 0.3007
Onchocerca volvulus 0.0173 0.4296 1
Loa Loa (eye worm) TYRA-2 protein 0.0173 0.4296 0.4246
Echinococcus granulosus nuclear receptor subfamily 4 group A 0.0008 0.0104 0.003
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0173 0.4296 0.4296
Echinococcus multilocularis rhodopsin orphan GPCR 0.0173 0.4296 0.4253
Schistosoma mansoni amine GPCR 0.0173 0.4296 0.4296
Loa Loa (eye worm) hypothetical protein 0.0173 0.4296 0.4246
Loa Loa (eye worm) hypothetical protein 0.0173 0.4296 0.4246
Mycobacterium tuberculosis Possible penicillin-binding protein 0.0223 0.5567 1
Loa Loa (eye worm) hypothetical protein 0.0173 0.4296 0.4246
Schistosoma mansoni peptide (FMRFamide/somatostatin)-like receptor 0.0173 0.4296 0.4296
Echinococcus granulosus Nuclear hormone receptor HR96 0.0008 0.0104 0.003
Brugia malayi Nuclear hormone receptor family member nhr-49 0.0017 0.0335 0.0234
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0017 0.0335 0.0234
Loa Loa (eye worm) beta-LACTamase domain containing family member 0.0035 0.0786 0.069
Brugia malayi hypothetical protein 0.0173 0.4296 0.4246
Brugia malayi Nuclear hormone receptor-like 1 0.0017 0.0335 0.0234
Loa Loa (eye worm) hypothetical protein 0.0173 0.4296 0.4246
Schistosoma mansoni nuclear hormone receptor 0.0008 0.0104 0.0104
Onchocerca volvulus Neuropeptide F receptor homolog 0.0173 0.4296 1
Echinococcus granulosus g protein linked acetylcholine receptor gar 2a 0.0173 0.4296 0.4253
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0173 0.4296 0.4296
Brugia malayi Nuclear hormone receptor family member nhr-40 0.0017 0.0335 0.0234
Brugia malayi G-protein-linked acetylcholine receptor protein 2, putative 0.0173 0.4296 0.4246
Onchocerca volvulus 0.0017 0.0335 0.055
Trichomonas vaginalis penicillin-binding protein, putative 0.0035 0.0786 0.9694
Loa Loa (eye worm) hypothetical protein 0.0173 0.4296 0.4246
Onchocerca volvulus 0.0173 0.4296 1
Schistosoma mansoni biogenic amine (octopamine/dopamine) receptor 0.0173 0.4296 0.4296
Brugia malayi nuclear hormone receptor 0.0017 0.0335 0.0234
Schistosoma mansoni cpg binding protein 0.003 0.0648 0.0648
Brugia malayi beta-lactamase 0.0035 0.0786 0.069
Onchocerca volvulus 0.0173 0.4296 1
Echinococcus granulosus g protein coupled receptor 0.0173 0.4296 0.4253
Onchocerca volvulus 0.0035 0.0786 0.1625
Schistosoma mansoni cpg binding protein 0.0028 0.0608 0.0608
Schistosoma mansoni inositol monophosphatase 0.0036 0.0808 0.0808
Brugia malayi ORL1-like opioid receptor 0.0173 0.4296 0.4246
Echinococcus multilocularis rhodopsin orphan GPCR 0.0173 0.4296 0.4253
Mycobacterium leprae conserved hypothetical protein 0.0035 0.0786 1
Onchocerca volvulus 0.0173 0.4296 1
Loa Loa (eye worm) hypothetical protein 0.0173 0.4296 0.4246
Schistosoma mansoni retinoic acid receptor RXR 0.0017 0.0335 0.0335
Brugia malayi nuclear receptor NHR-88 0.0017 0.0335 0.0234
Loa Loa (eye worm) hypothetical protein 0.0173 0.4296 0.4246
Onchocerca volvulus 0.0173 0.4296 1
Brugia malayi hypothetical protein 0.0173 0.4296 0.4246
Echinococcus granulosus rhodopsin orphan GPCR 0.0173 0.4296 0.4253
Loa Loa (eye worm) hypothetical protein 0.0017 0.0335 0.0234
Onchocerca volvulus 0.0173 0.4296 1
Loa Loa (eye worm) hypothetical protein 0.0009 0.0129 0.0025
Loa Loa (eye worm) hypothetical protein 0.0035 0.0786 0.069
Mycobacterium ulcerans aldehyde dehydrogenase 0.0059 0.1395 1
Trichomonas vaginalis D-aminoacylase, putative 0.0035 0.0786 0.9694
Loa Loa (eye worm) hypothetical protein 0.0173 0.4296 0.4246
Schistosoma mansoni hypothetical protein 0.0173 0.4296 0.4296
Echinococcus multilocularis biogenic amine (5HT) receptor 0.0173 0.4296 0.4253
Onchocerca volvulus 0.0035 0.0786 0.1625
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0173 0.4296 0.4296

Activities

Activity type Activity value Assay description Source Reference
GI50 (functional) = 59.7 uM Inhibition of cell proliferation in HCT116 human colon cancer cell line ChEMBL. 16213716
GI50 (functional) = 59.7 uM Inhibition of cell proliferation in HCT116 human colon cancer cell line ChEMBL. 16213716
IC50 (binding) = 31.5 uM Binding affinity to Hsp90 by fluorescent polarization assay ChEMBL. 16213716
IC50 (binding) = 31.5 uM Binding affinity to Hsp90 by fluorescent polarization assay ChEMBL. 16213716

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

No external resources registered for this compound

Bibliographic References

1 literature reference was collected for this gene.

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