Detailed information for compound 419459

Basic information

Technical information
  • TDR Targets ID: 419459
  • Name: 6-(3-azidophenyl)-6-ethylpyrrolo[2,1-d][1,5]b enzoxazepin-7-one
  • MW: 344.367 | Formula: C20H16N4O2
  • H donors: 0 H acceptors: 1 LogP: 5.55 Rotable bonds: 3
    Rule of 5 violations (Lipinski): 1
  • SMILES: [N-]=[N+]=Nc1cccc(c1)C1(CC)Oc2ccccc2n2c(C1=O)ccc2
  • InChi: 1S/C20H16N4O2/c1-2-20(14-7-5-8-15(13-14)22-23-21)19(25)17-10-6-12-24(17)16-9-3-4-11-18(16)26-20/h3-13H,2H2,1H3
  • InChiKey: QAKDTHVBWJMBHY-UHFFFAOYSA-N  

Network

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Synonyms

  • 6-(3-azidophenyl)-6-ethyl-pyrrolo[2,1-d][1,5]benzoxazepin-7-one
  • 6-(3-azidophenyl)-6-ethyl-7-pyrrolo[2,1-d][1,5]benzoxazepinone
  • AIDS-345978
  • AIDS345978
  • Pyrrolo[2,1-d][1,5]benzoxazepin-7(6H)-one, 6-(3-azidophenyl)-6-ethyl-

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
Brugia malayi hypothetical protein 0.0047 1 1
Echinococcus multilocularis G protein coupled 5 hydroxytryptamine receptor 0.0047 1 1
Brugia malayi cytochrome P450 0.0022 0.3789 0.3789
Mycobacterium ulcerans cytochrome p450 150 cyp150 0.0022 0.3789 0.5
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0047 1 1
Schistosoma mansoni opsin-like receptor 0.0047 1 1
Onchocerca volvulus 0.0047 1 0.5
Mycobacterium tuberculosis Cytochrome P450 51 Cyp51 (CYPL1) (P450-L1A1) (sterol 14-alpha demethylase) (lanosterol 14-alpha demethylase) (P450-14DM) 0.0022 0.3789 0.5
Mycobacterium tuberculosis Probable cytochrome P450 125 Cyp125 0.0022 0.3789 0.5
Echinococcus granulosus thyrotropin releasing hormone receptor 0.0047 1 1
Echinococcus granulosus fmrfamide receptor 0.0047 1 1
Loa Loa (eye worm) hypothetical protein 0.0047 1 1
Echinococcus multilocularis sex peptide receptor 0.0047 1 1
Mycobacterium leprae Conserved hypothetical protein 0.0022 0.3789 0.5
Mycobacterium ulcerans cytochrome P450 124A1, Cyp124A1 0.0022 0.3789 0.5
Echinococcus multilocularis neuropeptide s receptor 0.0047 1 1
Brugia malayi hypothetical protein 0.0047 1 1
Brugia malayi G protein-coupled receptor F59B2.13 0.0047 1 1
Mycobacterium ulcerans cytochrome P450 126A3 Cyp126A3 0.0022 0.3789 0.5
Schistosoma mansoni peptide (allatostatin)-like receptor 0.0047 1 1
Schistosoma mansoni biogenic amine receptor 0.0047 1 1
Schistosoma mansoni biogenic amine (5HT) receptor 0.0047 1 1
Loa Loa (eye worm) hypothetical protein 0.0047 1 1
Mycobacterium ulcerans cytochrome P450 108B4 Cyp108B4 0.0022 0.3789 0.5
Loa Loa (eye worm) cytochrome P450 0.0022 0.3789 0.3789
Schistosoma mansoni neuropeptide F-like receptor 0.0047 1 1
Echinococcus granulosus allatostatin A receptor 0.0047 1 1
Schistosoma mansoni biogenic amine receptor 0.0047 1 1
Echinococcus granulosus 7TM GPCR rhodopsin 0.0047 1 1
Loa Loa (eye worm) unidentified vitellogenin-linked transcript protein 6 0.0047 1 1
Mycobacterium tuberculosis Probable cytochrome P450 130 Cyp130 0.0022 0.3789 0.5
Schistosoma mansoni biogenic amine (dopamine) receptor 0.0047 1 1
Echinococcus granulosus rhodopsin orphan GPCR 0.0047 1 1
Brugia malayi Melatonin receptor type 1A 0.0047 1 1
Brugia malayi hypothetical protein 0.0047 1 1
Echinococcus granulosus pyroglutamylated rfamide peptide receptor 0.0047 1 1
Brugia malayi ORL1-like opioid receptor 0.0047 1 1
Loa Loa (eye worm) hypothetical protein 0.0047 1 1
Onchocerca volvulus 0.0047 1 0.5
Echinococcus granulosus neuropeptides capa receptor 0.0047 1 1
Loa Loa (eye worm) hypothetical protein 0.0047 1 1
Echinococcus multilocularis potassium voltage gated channel subfamily H 0.0011 0.0854 0.0854
Echinococcus multilocularis g protein coupled receptor 0.0047 1 1
Echinococcus granulosus neuropeptide s receptor 0.0047 1 1
Echinococcus granulosus rhodopsin orphan GPCR 0.0047 1 1
Echinococcus multilocularis G-protein coupled receptor, putative 0.0047 1 1
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0047 1 1
Schistosoma mansoni neuropeptide F-like receptor 0.0047 1 1
Loa Loa (eye worm) hypothetical protein 0.0047 1 1
Echinococcus granulosus neuropeptide Y receptor 0.0047 1 1
Brugia malayi Cytochrome P450 family protein 0.0022 0.3789 0.3789
Echinococcus multilocularis growth hormone secretagogue receptor type 1 0.0047 1 1
Loa Loa (eye worm) cytochrome P450 family protein 0.0022 0.3789 0.3789
Schistosoma mansoni neuropeptide receptor 0.0047 1 1
Schistosoma mansoni thyrotropin-releasing hormone receptor 0.0047 1 1
Echinococcus multilocularis neuropeptide receptor A26 0.0047 1 1
Loa Loa (eye worm) voltage and ligand gated potassium channel 0.0037 0.7459 0.7459
Echinococcus multilocularis fmrfamide receptor 0.0047 1 1
Schistosoma mansoni peptide (FMRFamide/somatostatin)-like receptor 0.0047 1 1
Echinococcus multilocularis voltage gated potassium channel 0.0011 0.0854 0.0854
Loa Loa (eye worm) hypothetical protein 0.0047 1 1
Mycobacterium tuberculosis Probable cytochrome P450 128 Cyp128 0.0022 0.3789 0.5
Echinococcus multilocularis serotonin receptor 0.0047 1 1
Echinococcus granulosus neuropeptide Y receptor 0.0047 1 1
Echinococcus multilocularis fmrfamide receptor 0.0047 1 1
Brugia malayi G-protein-linked acetylcholine receptor protein 2, putative 0.0047 1 1
Schistosoma mansoni hypothetical protein 0.0047 1 1
Loa Loa (eye worm) hypothetical protein 0.0047 1 1
Onchocerca volvulus 0.0047 1 0.5
Loa Loa (eye worm) hypothetical protein 0.0047 1 1
Mycobacterium tuberculosis Possible cytochrome P450 126 Cyp126 0.0022 0.3789 0.5
Onchocerca volvulus 0.0047 1 0.5
Schistosoma mansoni myosin xvIII 0.0047 1 1
Echinococcus multilocularis g protein coupled receptor 0.0047 1 1
Echinococcus multilocularis tachykinin peptides receptor 99D 0.0047 1 1
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0047 1 1
Onchocerca volvulus 0.0047 1 0.5
Echinococcus granulosus alpha 1A adrenergic receptor 0.0047 1 1
Schistosoma mansoni cytochrome P450 0.0022 0.3789 0.3789
Onchocerca volvulus 0.0047 1 0.5
Echinococcus multilocularis g protein linked acetylcholine receptor gar 2a 0.0047 1 1
Echinococcus multilocularis alpha 1A adrenergic receptor 0.0047 1 1
Schistosoma mansoni muscarinic acetylcholine (GAR) receptor 0.0047 1 1
Echinococcus granulosus somatostatin receptor 0.0047 1 1
Mycobacterium ulcerans cytochrome P450 187A5 Cyp187A5 0.0022 0.3789 0.5
Loa Loa (eye worm) hypothetical protein 0.0047 1 1
Loa Loa (eye worm) hypothetical protein 0.0047 1 1
Brugia malayi sulfakinin receptor protein 0.0047 1 1
Schistosoma mansoni histamine-responsive GPCR (AAF21638) 0.0047 1 1
Echinococcus granulosus potassium voltage gated channel subfamily H 0.0011 0.0854 0.0854
Schistosoma mansoni opsin-like receptor 0.0047 1 1
Echinococcus multilocularis tm gpcr rhodopsin gpcr rhodopsin superfamily 0.0047 1 1
Echinococcus granulosus biogenic amine 5HT receptor 0.0047 1 1
Echinococcus granulosus neuropeptide receptor 0.0047 1 1
Schistosoma mansoni voltage-gated potassium channel 0.0011 0.0854 0.0854
Loa Loa (eye worm) hypothetical protein 0.0047 1 1
Echinococcus multilocularis rhodopsin orphan GPCR 0.0047 1 1
Echinococcus granulosus G protein coupled receptor 139 0.0047 1 1
Loa Loa (eye worm) melatonin receptor type 1A 0.0047 1 1
Mycobacterium ulcerans cytochrome P450 136A2 Cyp136A2 0.0022 0.3789 0.5
Loa Loa (eye worm) CYP4Cod1 0.0022 0.3789 0.3789
Echinococcus multilocularis serotonin receptor 0.0047 1 1
Brugia malayi Dopamine receptor protein 1, putative (partial) 0.0047 1 1
Mycobacterium tuberculosis Probable cytochrome P450 141 Cyp141 0.0022 0.3789 0.5
Mycobacterium ulcerans cytochrome P450 185A4 Cyp185A4 0.0022 0.3789 0.5
Onchocerca volvulus 0.0047 1 0.5
Brugia malayi hypothetical protein 0.0047 1 1
Echinococcus multilocularis G protein coupled receptor 139 0.0047 1 1
Echinococcus granulosus neuropeptides capa receptor 0.0047 1 1
Loa Loa (eye worm) hypothetical protein 0.0047 1 1
Echinococcus granulosus rhodopsin orphan GPCR 0.0047 1 1
Brugia malayi hypothetical protein 0.0047 1 1
Mycobacterium ulcerans cytochrome P450 105Q4 Cyp105Q4 0.0022 0.3789 0.5
Brugia malayi Tachykinin-like peptides receptor 99D 0.0047 1 1
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0047 1 1
Loa Loa (eye worm) gonadotropin-releasing hormone receptor 2 0.0047 1 1
Schistosoma mansoni voltage-gated potassium channel 0.0011 0.0854 0.0854
Echinococcus multilocularis neuropeptides capa receptor 0.0047 1 1
Schistosoma mansoni biogenic amine receptor 0.0047 1 1
Brugia malayi RE15519p 0.0047 1 1
Mycobacterium tuberculosis Cytochrome P450 121 Cyp121 0.0022 0.3789 0.5
Loa Loa (eye worm) TYRA-2 protein 0.0047 1 1
Loa Loa (eye worm) hypothetical protein 0.0047 1 1
Echinococcus granulosus g protein coupled receptor 0.0047 1 1
Onchocerca volvulus 0.0047 1 0.5
Loa Loa (eye worm) hypothetical protein 0.0047 1 1
Brugia malayi hypothetical protein 0.0047 1 1
Trypanosoma cruzi cytochrome P450, putative 0.0022 0.3789 0.5
Loa Loa (eye worm) hypothetical protein 0.0047 1 1
Schistosoma mansoni peptide (FMRFamide/somatostatin)-like receptor 0.0047 1 1
Echinococcus granulosus growth hormone secretagogue receptor type 1 0.0047 1 1
Echinococcus multilocularis neuropeptides capa receptor 0.0047 1 1
Brugia malayi neuropeptide F receptor 0.0047 1 1
Schistosoma mansoni biogenic amine (5HT) receptor 0.0047 1 1
Echinococcus granulosus tm gpcr rhodopsin 0.0047 1 1
Echinococcus multilocularis somatostatin receptor 0.0047 1 1
Brugia malayi Unidentified vitellogenin-linked transcript protein 6, putative 0.0047 1 1
Echinococcus granulosus g protein coupled receptor 0.0047 1 1
Loa Loa (eye worm) hypothetical protein 0.0047 1 1
Loa Loa (eye worm) hypothetical protein 0.0047 1 1
Echinococcus multilocularis rhodopsin orphan GPCR 0.0047 1 1
Trypanosoma cruzi Lanosterol 14-alpha demethylase 0.0022 0.3789 0.5
Echinococcus multilocularis neuropeptide receptor 0.0047 1 1
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0047 1 1
Mycobacterium ulcerans cytochrome P450 143A4 Cyp143A4 0.0022 0.3789 0.5
Leishmania major cytochrome p450-like protein 0.0022 0.3789 0.5
Schistosoma mansoni biogenic amine (octopamine/dopamine) receptor 0.0047 1 1
Echinococcus multilocularis rhodopsin orphan GPCR 0.0047 1 1
Brugia malayi Cytochrome P450 family protein 0.0022 0.3789 0.3789
Mycobacterium ulcerans cytochrome P450 143A3 Cyp143A3 0.0022 0.3789 0.5
Leishmania major cytochrome p450-like protein 0.0022 0.3789 0.5
Mycobacterium ulcerans cytochrome P450 187A4 Cyp187A4 0.0022 0.3789 0.5
Onchocerca volvulus 0.0047 1 0.5
Echinococcus granulosus dro:myosuppressin receptor 0.0047 1 1
Mycobacterium tuberculosis Possible cytochrome P450 135B1 Cyp135B1 0.0022 0.3789 0.5
Mycobacterium ulcerans cytochrome P450 123A3 Cyp123A3 0.0022 0.3789 0.5
Echinococcus granulosus tm gpcr rhodopsin 0.0047 1 1
Echinococcus granulosus g protein linked acetylcholine receptor gar 2a 0.0047 1 1
Loa Loa (eye worm) hypothetical protein 0.0047 1 1
Echinococcus multilocularis rhodopsin orphan GPCR 0.0047 1 1
Schistosoma mansoni amine GPCR 0.0047 1 1
Brugia malayi Cytochrome P450 family protein 0.0022 0.3789 0.3789
Schistosoma mansoni peptide (FMRFamide/neurokinin-3)-like receptor 0.0047 1 1
Loa Loa (eye worm) hypothetical protein 0.0047 1 1
Brugia malayi putative neuropeptide receptor NPR1 0.0047 1 1
Schistosoma mansoni ancient conserved domain protein 2 (cyclin m2) 0.0047 1 1
Echinococcus multilocularis g protein linked acetylcholine receptor gar 2a 0.0047 1 1
Echinococcus multilocularis rhodopsin orphan GPCR 0.0047 1 1
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0047 1 1
Onchocerca volvulus 0.0047 1 0.5
Loa Loa (eye worm) hypothetical protein 0.0047 1 1
Echinococcus multilocularis orexin receptor type 2 0.0047 1 1
Echinococcus multilocularis potassium voltage gated channel subfamily H 0.0037 0.7459 0.7459
Schistosoma mansoni opsin-like receptor 0.0047 1 1
Onchocerca volvulus 0.0047 1 0.5
Loa Loa (eye worm) hypothetical protein 0.0047 1 1
Mycobacterium ulcerans cytochrome P450 51B1 Cyp51B1 0.0022 0.3789 0.5
Onchocerca volvulus Neuropeptide F receptor homolog 0.0047 1 0.5
Echinococcus granulosus g protein linked acetylcholine receptor gar 2a 0.0047 1 1
Echinococcus multilocularis neuropeptide Y receptor 0.0047 1 1
Schistosoma mansoni amine GPCR 0.0047 1 1
Loa Loa (eye worm) hypothetical protein 0.0047 1 1
Echinococcus multilocularis g protein coupled receptor 0.0047 1 1
Loa Loa (eye worm) hypothetical protein 0.0047 1 1
Schistosoma mansoni neuropeptide receptor 0.0047 1 1
Echinococcus granulosus rhodopsin orphan GPCR 0.0047 1 1
Echinococcus granulosus neuropeptide receptor A26 0.0047 1 1
Mycobacterium tuberculosis Possible cytochrome P450 135A1 Cyp135A1 0.0022 0.3789 0.5
Brugia malayi larval opioid receptor 0.0047 1 1
Brugia malayi Serotonin receptor 0.0047 1 1
Brugia malayi Dopamine receptor 0.0047 1 1
Loa Loa (eye worm) hypothetical protein 0.0047 1 1
Onchocerca volvulus Dopamine\/Ecdysteroid receptor homolog 0.0047 1 0.5
Mycobacterium ulcerans cytochrome P450 142A3 Cyp142A3 0.0022 0.3789 0.5
Loa Loa (eye worm) G-protein-linked acetylcholine receptor protein 2 0.0047 1 1
Onchocerca volvulus 0.0047 1 0.5
Echinococcus granulosus neuropeptide receptor 0.0047 1 1
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0047 1 1
Loa Loa (eye worm) hypothetical protein 0.0047 1 1
Trypanosoma cruzi Lanosterol 14-alpha demethylase 0.0022 0.3789 0.5
Loa Loa (eye worm) G-protein coupled receptor 0.0047 1 1
Echinococcus multilocularis 7TM GPCR, rhodopsin 0.0047 1 1
Toxoplasma gondii cytochrome p450 superfamily protein 0.0022 0.3789 0.5
Echinococcus granulosus tachykinin peptides receptor 99D 0.0047 1 1
Schistosoma mansoni hypothetical protein 0.0047 1 1
Loa Loa (eye worm) 5-hydroxytryptamine 2C receptor 0.0047 1 1
Trypanosoma cruzi cytochrome p450-like protein, putative 0.0022 0.3789 0.5
Echinococcus granulosus hypothetical protein 0.0047 1 1
Brugia malayi hypothetical protein 0.0047 1 1
Loa Loa (eye worm) hypothetical protein 0.0047 1 1
Echinococcus multilocularis rhodopsin orphan GPCR 0.0047 1 1
Echinococcus granulosus rhodopsin orphan GPCR 0.0047 1 1
Schistosoma mansoni hypothetical protein 0.0047 1 1
Echinococcus multilocularis thyrotropin releasing hormone receptor 0.0047 1 1
Mycobacterium tuberculosis Probable cytochrome P450 132 Cyp132 0.0022 0.3789 0.5
Echinococcus multilocularis tm gpcr rhodopsin gpcr rhodopsin superfamily 0.0047 1 1
Mycobacterium ulcerans cytochrome P450 191A3 Cyp191A3 0.0022 0.3789 0.5
Mycobacterium ulcerans cytochrome P450 189A7 Cyp189A7 0.0022 0.3789 0.5
Loa Loa (eye worm) hypothetical protein 0.0047 1 1
Onchocerca volvulus 0.0047 1 0.5
Schistosoma mansoni neuropeptide receptor 0.0047 1 1
Echinococcus multilocularis peptide (allatostatin:somatostatin) 0.0047 1 1
Trypanosoma cruzi cytochrome P450, putative 0.0022 0.3789 0.5
Schistosoma mansoni voltage-gated potassium channel 0.004 0.8314 0.8314
Loa Loa (eye worm) cytochrome P450 family protein 0.0022 0.3789 0.3789
Brugia malayi gonadotropin-releasing hormone receptor 2 0.0047 1 1
Echinococcus multilocularis allatostatin A receptor 0.0047 1 1
Onchocerca volvulus 0.0047 1 0.5
Trypanosoma brucei cytochrome P450, putative 0.0022 0.3789 0.5
Echinococcus multilocularis neuropeptide receptor 0.0047 1 1
Brugia malayi AKH receptor 0.0047 1 1
Echinococcus multilocularis pyroglutamylated rfamide peptide receptor 0.0047 1 1
Brugia malayi GnHR receptor homolog 0.0047 1 1
Brugia malayi follicle stimulating hormone receptor 0.0047 1 1
Loa Loa (eye worm) hypothetical protein 0.0047 1 1
Mycobacterium tuberculosis Probable cytochrome P450 143 Cyp143 0.0022 0.3789 0.5
Schistosoma mansoni biogenic amine (dopamine) receptor 0.0047 1 1
Brugia malayi Dopamine receptor protein 2 0.0047 1 1
Loa Loa (eye worm) neuropeptide F receptor 0.0047 1 1
Echinococcus granulosus peptide allatostatin:somatostatin 0.0047 1 1
Mycobacterium ulcerans cytochrome P450 188A3 Cyp188A3 0.0022 0.3789 0.5
Brugia malayi Voltage-gated potassium channel, EAG (KCNH1)-related. C. elegans egl-2 ortholog 0.0011 0.0854 0.0854
Brugia malayi Serotonin receptor 0.0047 1 1
Loa Loa (eye worm) hypothetical protein 0.0047 1 1
Brugia malayi hypothetical protein 0.0047 1 1
Schistosoma mansoni voltage-gated potassium channel 0.004 0.8314 0.8314
Echinococcus granulosus biogenic amine 5HT receptor 0.0047 1 1
Brugia malayi neuropeptide F receptor 0.0047 1 1
Schistosoma mansoni amine GPCR 0.0047 1 1
Echinococcus granulosus G protein coupled 5 hydroxytryptamine receptor 0.0047 1 1
Brugia malayi Serotonin/octopamine receptor family protein 7 0.0047 1 1
Brugia malayi Dopamine receptor protein 1 0.0047 1 1
Echinococcus multilocularis rhodopsin orphan GPCR 0.0047 1 1
Loa Loa (eye worm) cytochrome P450 family protein 0.0022 0.3789 0.3789
Loa Loa (eye worm) hypothetical protein 0.0047 1 1
Schistosoma mansoni alpha-1 adrenergic receptor 0.0047 1 1
Trichomonas vaginalis voltage and ligand gated potassium channel, putative 0.0034 0.6847 1
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0047 1 1
Echinococcus multilocularis g-protein coupled receptor 0.0047 1 1
Brugia malayi Voltage-gated potassium channel, HERG (KCNH2)-related. C. elegans unc-103 ortholog 0.0037 0.7459 0.7459
Schistosoma mansoni biogenic amine (dopamine) receptor 0.0047 1 1
Mycobacterium tuberculosis Probable cytochrome P450 138 Cyp138 0.0022 0.3789 0.5
Loa Loa (eye worm) hypothetical protein 0.0047 1 1
Schistosoma mansoni hypothetical protein 0.0047 1 1
Echinococcus multilocularis neuropeptide FF receptor 2 0.0047 1 1
Echinococcus multilocularis rhodopsin orphan GPCR 0.0047 1 1
Echinococcus granulosus voltage gated potassium channel 0.0011 0.0854 0.0854
Schistosoma mansoni hypothetical protein 0.0022 0.3789 0.3789
Schistosoma mansoni neuropeptide receptor 0.0047 1 1
Echinococcus granulosus rhodopsin orphan GPCR 0.0047 1 1
Schistosoma mansoni adenoreceptor 0.0047 1 1
Loa Loa (eye worm) follicle stimulating hormone receptor 0.0047 1 1
Mycobacterium tuberculosis Probable cytochrome P450 137 Cyp137 0.0022 0.3789 0.5
Mycobacterium tuberculosis Probable cytochrome P450 monooxygenase 142 Cyp142 0.0022 0.3789 0.5
Brugia malayi G-protein coupled receptor 0.0047 1 1
Echinococcus granulosus g protein coupled receptor 0.0047 1 1
Schistosoma mansoni amine GPCR 0.0047 1 1
Loa Loa (eye worm) neuropeptide F receptor 0.0047 1 1
Brugia malayi Cytochrome P450 family protein 0.0022 0.3789 0.3789
Echinococcus granulosus 7tm_1 domain containing protein 0.0047 1 1
Echinococcus granulosus serotonin receptor 0.0047 1 1
Brugia malayi putative neuropeptide receptor 0.0047 1 1
Schistosoma mansoni histamine h1 receptor 0.0047 1 1
Schistosoma mansoni growth hormone secretagogue receptor 0.0047 1 1
Mycobacterium ulcerans cytochrome P450 150A6 Cyp150A6 0.0022 0.3789 0.5
Echinococcus granulosus g-protein coupled receptor 0.0047 1 1
Loa Loa (eye worm) hypothetical protein 0.0032 0.6231 0.6231
Brugia malayi G-protein coupled receptor 0.0047 1 1
Loa Loa (eye worm) G-protein coupled receptor 0.0047 1 1
Echinococcus multilocularis neuropeptide Y receptor 0.0047 1 1
Echinococcus multilocularis tm gpcr rhodopsin gpcr rhodopsin superfamily 0.0047 1 1
Echinococcus multilocularis 0.0022 0.3789 0.3789
Brugia malayi G protein-coupled receptor 0.0047 1 1
Echinococcus multilocularis biogenic amine (5HT) receptor 0.0047 1 1
Loa Loa (eye worm) hypothetical protein 0.0047 1 1
Leishmania major lanosterol 14-alpha-demethylase, putative 0.0022 0.3789 0.5
Loa Loa (eye worm) hypothetical protein 0.0047 1 1
Loa Loa (eye worm) hypothetical protein 0.0047 1 1
Schistosoma mansoni peptide (allatostatin/somatostatin)-like receptor 0.0047 1 1
Onchocerca volvulus 0.0047 1 0.5
Mycobacterium tuberculosis Probable cytochrome P450 136 Cyp136 0.0022 0.3789 0.5
Loa Loa (eye worm) hypothetical protein 0.0047 1 1
Trypanosoma brucei Lanosterol 14-alpha demethylase 0.0022 0.3789 0.5
Echinococcus granulosus neuropeptide FF receptor 2 0.0047 1 1
Echinococcus granulosus cytochrome P450 2K1 0.0022 0.3789 0.3789
Onchocerca volvulus 0.0047 1 0.5
Loa Loa (eye worm) hypothetical protein 0.0047 1 1
Mycobacterium ulcerans cytochrome P450 140A5 Cyp140A5 0.0022 0.3789 0.5
Onchocerca volvulus 0.0047 1 0.5
Loa Loa (eye worm) hypothetical protein 0.0047 1 1
Loa Loa (eye worm) hypothetical protein 0.0047 1 1
Echinococcus multilocularis dro:myosuppressin receptor 0.0047 1 1
Mycobacterium leprae putative cytochrome p450 0.0022 0.3789 0.5
Loa Loa (eye worm) hypothetical protein 0.0047 1 1
Mycobacterium ulcerans cytochrome P450 125A7 Cyp125A7 0.0022 0.3789 0.5
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0047 1 1
Trichomonas vaginalis voltage and ligand gated potassium channel, putative 0.0034 0.6847 1
Mycobacterium ulcerans cytochrome P450 144A4 Cyp144A4 0.0022 0.3789 0.5
Loa Loa (eye worm) hypothetical protein 0.0047 1 1
Loa Loa (eye worm) hypothetical protein 0.0011 0.0854 0.0854
Echinococcus granulosus potassium voltage gated channel subfamily H 0.0037 0.7459 0.7459
Echinococcus granulosus sex peptide receptor 0.0047 1 1
Loa Loa (eye worm) hypothetical protein 0.0047 1 1
Brugia malayi hypothetical protein 0.0047 1 1
Loa Loa (eye worm) hypothetical protein 0.0047 1 1
Echinococcus granulosus tm gpcr rhodopsin 0.0047 1 1
Mycobacterium tuberculosis Probable cytochrome P450 124 Cyp124 0.0022 0.3789 0.5
Echinococcus granulosus orexin receptor type 2 0.0047 1 1
Loa Loa (eye worm) hypothetical protein 0.0047 1 1
Mycobacterium tuberculosis Probable cytochrome P450 140 Cyp140 0.0022 0.3789 0.5
Schistosoma mansoni amine GPCR 0.0047 1 1
Loa Loa (eye worm) hypothetical protein 0.0047 1 1
Loa Loa (eye worm) hypothetical protein 0.0047 1 1
Mycobacterium tuberculosis Probable cytochrome P450 144 Cyp144 0.0022 0.3789 0.5
Mycobacterium tuberculosis Probable cytochrome P450 123 Cyp123 0.0022 0.3789 0.5
Leishmania major cytochrome p450-like protein 0.0022 0.3789 0.5
Mycobacterium tuberculosis Probable cytochrome P450 139 Cyp139 0.0022 0.3789 0.5
Echinococcus granulosus rhodopsin orphan GPCR 0.0047 1 1
Schistosoma mansoni neuropeptide f receptor 76f 0.0047 1 1

Activities

Activity type Activity value Assay description Source Reference
IC50 (binding) 0 Inhibition of HIV1 RT K103N mutant ChEMBL. 16279773
IC50 (binding) 0 Inhibition of HIV1 RT V106A mutant ChEMBL. 16279773
IC50 (binding) 0 Inhibition of HIV1 RT Y181I mutant ChEMBL. 16279773
IC50 (binding) 0 Inhibition of HIV1 RT Y188L mutant ChEMBL. 16279773
IC50 (binding) 0 Inhibition of HIV1 RT L100I mutant ChEMBL. 16279773
Inhibition (binding) <= 10 % Inhibition of HIV1 RT at 100 uM ChEMBL. 16279773

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.

If you have references for this compound, please enter them in a user comment (below) or Contact us.