Detailed information for compound 1681866

Basic information

Technical information
  • TDR Targets ID: 1681866
  • Name: AIDS-191967
  • MW: 275.369 | Formula: C14H17N3OS
  • H donors: 2 H acceptors: 0 LogP: 1.68 Rotable bonds: 0
    Rule of 5 violations (Lipinski): 1
  • SMILES: N[C@H]1CSCON2[C@@H]1c1[nH]c3c(c1CC2)cccc3
  • InChi: 1S/C14H17N3OS/c15-11-7-19-8-18-17-6-5-10-9-3-1-2-4-12(9)16-13(10)14(11)17/h1-4,11,14,16H,5-8,15H2/t11-,14-/m0/s1
  • InChiKey: SFAMFXNCPDEYGA-FZMZJTMJSA-N  


Substructure search Similarity search

Network

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Synonyms

  • AIDS191967
  • [1,6,2]oxathiazepino[2',3':1,2]pyrido[3,4-b]indol-1-amine, 1,2,7,8,13,13b-hexahydro-, (1R,13bS)-

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 neuropeptide Y receptor 0.028 1 1
Loa Loa (eye worm) hypothetical protein 0.028 1 1
Entamoeba histolytica cysteine proteinase, putative 0.0072 0.0242 0.5
Brugia malayi hypothetical protein 0.028 1 1
Loa Loa (eye worm) G-protein coupled receptor 0.028 1 1
Leishmania major cathepsin L-like protease 0.0072 0.0242 0.0438
Onchocerca volvulus 0.028 1 1
Loa Loa (eye worm) hypothetical protein 0.028 1 1
Echinococcus granulosus g protein coupled receptor 0.028 1 1
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0072 0.0242 1
Loa Loa (eye worm) hypothetical protein 0.028 1 1
Schistosoma mansoni biogenic amine (5HT) receptor 0.028 1 1
Schistosoma mansoni alpha-1 adrenergic receptor 0.028 1 1
Echinococcus multilocularis neuropeptide s receptor 0.028 1 1
Echinococcus multilocularis tm gpcr rhodopsin gpcr rhodopsin superfamily 0.028 1 1
Brugia malayi hypothetical protein 0.028 1 1
Loa Loa (eye worm) TYRA-2 protein 0.028 1 1
Loa Loa (eye worm) hypothetical protein 0.028 1 1
Loa Loa (eye worm) hypothetical protein 0.028 1 1
Echinococcus granulosus neuropeptide Y receptor 0.028 1 1
Brugia malayi Dopamine receptor protein 1 0.028 1 1
Echinococcus multilocularis neuropeptide receptor A26 0.028 1 1
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0072 0.0242 1
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0072 0.0242 1
Loa Loa (eye worm) hypothetical protein 0.028 1 1
Brugia malayi GnHR receptor homolog 0.028 1 1
Onchocerca volvulus 0.028 1 1
Entamoeba histolytica cysteine protease, putative 0.0072 0.0242 0.5
Loa Loa (eye worm) hypothetical protein 0.028 1 1
Schistosoma mansoni rhodopsin-like orphan GPCR 0.028 1 1
Echinococcus multilocularis rhodopsin orphan GPCR 0.028 1 1
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0185 0.5529 1
Echinococcus multilocularis orexin receptor type 2 0.028 1 1
Echinococcus multilocularis neuropeptides capa receptor 0.028 1 1
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0072 0.0242 1
Schistosoma mansoni neuropeptide F-like receptor 0.028 1 1
Echinococcus granulosus growth hormone secretagogue receptor type 1 0.028 1 1
Echinococcus multilocularis thyrotropin releasing hormone receptor 0.028 1 1
Echinococcus granulosus rhodopsin orphan GPCR 0.028 1 1
Echinococcus multilocularis g protein linked acetylcholine receptor gar 2a 0.028 1 1
Schistosoma mansoni amine GPCR 0.028 1 1
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0072 0.0242 1
Schistosoma mansoni biogenic amine (dopamine) receptor 0.028 1 1
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0072 0.0242 1
Onchocerca volvulus 0.028 1 1
Echinococcus granulosus neuropeptide Y receptor 0.028 1 1
Echinococcus granulosus g protein coupled receptor 0.028 1 1
Giardia lamblia Cathepsin B precursor 0.0067 0 0.5
Schistosoma mansoni SmCB2 peptidase (C01 family) 0.0177 0.5169 0.5169
Schistosoma mansoni biogenic amine receptor 0.028 1 1
Schistosoma mansoni hypothetical protein 0.028 1 1
Loa Loa (eye worm) hypothetical protein 0.028 1 1
Loa Loa (eye worm) hypothetical protein 0.028 1 1
Schistosoma mansoni rhodopsin-like orphan GPCR 0.028 1 1
Echinococcus multilocularis G-protein coupled receptor, putative 0.028 1 1
Echinococcus granulosus neuropeptide s receptor 0.028 1 1
Echinococcus multilocularis rhodopsin orphan GPCR 0.028 1 1
Brugia malayi G protein-coupled receptor F59B2.13 0.028 1 1
Schistosoma mansoni hypothetical protein 0.028 1 1
Echinococcus granulosus dro:myosuppressin receptor 0.028 1 1
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0185 0.5529 1
Echinococcus multilocularis rhodopsin orphan GPCR 0.028 1 1
Loa Loa (eye worm) neuropeptide F receptor 0.028 1 1
Echinococcus granulosus sex peptide receptor 0.028 1 1
Brugia malayi G-protein coupled receptor 0.028 1 1
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0072 0.0242 1
Brugia malayi cathepsin B-like cysteine proteinase 0.0177 0.5169 0.5049
Loa Loa (eye worm) unidentified vitellogenin-linked transcript protein 6 0.028 1 1
Echinococcus granulosus tm gpcr rhodopsin 0.028 1 1
Onchocerca volvulus 0.028 1 1
Echinococcus granulosus alpha 1A adrenergic receptor 0.028 1 1
Echinococcus multilocularis sex peptide receptor 0.028 1 1
Onchocerca volvulus 0.028 1 1
Loa Loa (eye worm) hypothetical protein 0.028 1 1
Onchocerca volvulus 0.028 1 1
Onchocerca volvulus Dopamine\/Ecdysteroid receptor homolog 0.028 1 1
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0072 0.0242 1
Loa Loa (eye worm) G-protein-linked acetylcholine receptor protein 2 0.028 1 1
Onchocerca volvulus 0.028 1 1
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0185 0.5529 1
Echinococcus multilocularis fmrfamide receptor 0.028 1 1
Schistosoma mansoni opsin-like receptor 0.028 1 1
Brugia malayi hypothetical protein 0.028 1 1
Schistosoma mansoni amine GPCR 0.028 1 1
Loa Loa (eye worm) hypothetical protein 0.028 1 1
Echinococcus multilocularis g protein coupled receptor 0.028 1 1
Brugia malayi neuropeptide F receptor 0.028 1 1
Echinococcus granulosus g protein coupled receptor 0.028 1 1
Echinococcus granulosus G protein coupled 5 hydroxytryptamine receptor 0.028 1 1
Brugia malayi hypothetical protein 0.028 1 1
Schistosoma mansoni peptide (FMRFamide/neurokinin-3)-like receptor 0.028 1 1
Schistosoma mansoni cathepsin F (C01 family) 0.0072 0.0242 0.0242
Loa Loa (eye worm) hypothetical protein 0.028 1 1
Onchocerca volvulus 0.028 1 1
Loa Loa (eye worm) hypothetical protein 0.028 1 1
Plasmodium falciparum cysteine proteinase falcipain 3 0.0072 0.0242 0.5
Echinococcus granulosus neuropeptide FF receptor 2 0.028 1 1
Echinococcus granulosus neuropeptide receptor 0.028 1 1
Echinococcus multilocularis serotonin receptor 0.028 1 1
Loa Loa (eye worm) hypothetical protein 0.028 1 1
Trypanosoma cruzi cysteine peptidase, putative 0.0185 0.5529 1
Schistosoma mansoni thyrotropin-releasing hormone receptor 0.028 1 1
Loa Loa (eye worm) hypothetical protein 0.028 1 1
Leishmania major cathepsin L-like protease 0.0185 0.5529 1
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0072 0.0242 1
Schistosoma mansoni rhodopsin-like orphan GPCR 0.028 1 1
Loa Loa (eye worm) G-protein coupled receptor 0.028 1 1
Brugia malayi Serotonin receptor 0.028 1 1
Loa Loa (eye worm) hypothetical protein 0.028 1 1
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0185 0.5529 1
Schistosoma mansoni biogenic amine (dopamine) receptor 0.028 1 1
Echinococcus granulosus g-protein coupled receptor 0.028 1 1
Echinococcus multilocularis growth hormone secretagogue receptor type 1 0.028 1 1
Echinococcus multilocularis G protein coupled receptor 139 0.028 1 1
Schistosoma mansoni rhodopsin-like orphan GPCR 0.028 1 1
Echinococcus multilocularis neuropeptide receptor 0.028 1 1
Loa Loa (eye worm) hypothetical protein 0.028 1 1
Schistosoma mansoni histamine-responsive GPCR (AAF21638) 0.028 1 1
Echinococcus granulosus neuropeptides capa receptor 0.028 1 1
Brugia malayi Dopamine receptor protein 2 0.028 1 1
Plasmodium falciparum cysteine proteinase falcipain 2a 0.0072 0.0242 0.5
Schistosoma mansoni biogenic amine (dopamine) receptor 0.028 1 1
Schistosoma mansoni neuropeptide receptor 0.028 1 1
Echinococcus multilocularis cathepsin b 0.0177 0.5169 0.5049
Loa Loa (eye worm) hypothetical protein 0.028 1 1
Schistosoma mansoni peptide (allatostatin)-like receptor 0.028 1 1
Trichomonas vaginalis Clan CA, family C1, cathepsin L or K-like cysteine peptidase 0.0072 0.0242 1
Echinococcus granulosus g protein linked acetylcholine receptor gar 2a 0.028 1 1
Echinococcus multilocularis allatostatin A receptor 0.028 1 1
Leishmania major cathepsin L-like protease 0.0072 0.0242 0.0438
Loa Loa (eye worm) follicle stimulating hormone receptor 0.028 1 1
Echinococcus granulosus tm gpcr rhodopsin 0.028 1 1
Loa Loa (eye worm) hypothetical protein 0.028 1 1
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0072 0.0242 1
Loa Loa (eye worm) Papain cysteine protease/cathepsin propeptide inhibitor-containing protein 0.0072 0.0242 0.0242
Brugia malayi hypothetical protein 0.028 1 1
Brugia malayi Serotonin/octopamine receptor family protein 7 0.028 1 1
Schistosoma mansoni myosin xvIII 0.028 1 1
Brugia malayi Unidentified vitellogenin-linked transcript protein 6, putative 0.028 1 1
Brugia malayi Dopamine receptor protein 1, putative (partial) 0.028 1 1
Loa Loa (eye worm) hypothetical protein 0.028 1 1
Brugia malayi G-protein-linked acetylcholine receptor protein 2, putative 0.028 1 1
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0185 0.5529 1
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0185 0.5529 1
Loa Loa (eye worm) hypothetical protein 0.028 1 1
Echinococcus multilocularis rhodopsin orphan GPCR 0.028 1 1
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0072 0.0242 1
Schistosoma mansoni biogenic amine receptor 0.028 1 1
Loa Loa (eye worm) hypothetical protein 0.028 1 1
Echinococcus multilocularis biogenic amine (5HT) receptor 0.028 1 1
Loa Loa (eye worm) hypothetical protein 0.028 1 1
Echinococcus granulosus rhodopsin orphan GPCR 0.028 1 1
Loa Loa (eye worm) hypothetical protein 0.0177 0.5169 0.5169
Schistosoma mansoni cathepsin B-like peptidase (C01 family) 0.0177 0.5169 0.5169
Brugia malayi sulfakinin receptor protein 0.028 1 1
Loa Loa (eye worm) hypothetical protein 0.028 1 1
Echinococcus multilocularis alpha 1A adrenergic receptor 0.028 1 1
Brugia malayi hypothetical protein 0.028 1 1
Trypanosoma cruzi cruzipain precursor, putative 0.0185 0.5529 1
Giardia lamblia Cathepsin B precursor 0.0067 0 0.5
Giardia lamblia Cathepsin B precursor 0.0067 0 0.5
Echinococcus granulosus allatostatin A receptor 0.028 1 1
Brugia malayi G protein-coupled receptor 0.028 1 1
Plasmodium falciparum cysteine proteinase falcipain 2b 0.0072 0.0242 0.5
Brugia malayi putative neuropeptide receptor NPR1 0.028 1 1
Loa Loa (eye worm) hypothetical protein 0.028 1 1
Brugia malayi hypothetical protein 0.028 1 1
Trypanosoma cruzi cysteine peptidase, putative 0.0185 0.5529 1
Leishmania major cathepsin L-like protease 0.0072 0.0242 0.0438
Trypanosoma cruzi cysteine peptidase, putative 0.0185 0.5529 1
Schistosoma mansoni biogenic amine (5HT) receptor 0.028 1 1
Schistosoma mansoni cathepsin B-like peptidase (C01 family) 0.0177 0.5169 0.5169
Loa Loa (eye worm) neuropeptide F receptor 0.028 1 1
Echinococcus granulosus 7tm_1 domain containing protein 0.028 1 1
Loa Loa (eye worm) hypothetical protein 0.028 1 1
Onchocerca volvulus Neuropeptide F receptor homolog 0.028 1 1
Echinococcus granulosus neuropeptide receptor A26 0.028 1 1
Echinococcus multilocularis fmrfamide receptor 0.028 1 1
Echinococcus granulosus 7TM GPCR rhodopsin 0.028 1 1
Schistosoma mansoni opsin-like receptor 0.028 1 1
Brugia malayi G-protein coupled receptor 0.028 1 1
Echinococcus granulosus serotonin receptor 0.028 1 1
Schistosoma mansoni neuropeptide receptor 0.028 1 1
Loa Loa (eye worm) hypothetical protein 0.028 1 1
Echinococcus granulosus cathepsin b 0.0177 0.5169 0.5049
Echinococcus multilocularis g protein linked acetylcholine receptor gar 2a 0.028 1 1
Echinococcus multilocularis tachykinin peptides receptor 99D 0.028 1 1
Schistosoma mansoni adenoreceptor 0.028 1 1
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0072 0.0242 1
Echinococcus granulosus G protein coupled receptor 139 0.028 1 1
Echinococcus granulosus orexin receptor type 2 0.028 1 1
Brugia malayi Dopamine receptor 0.028 1 1
Echinococcus granulosus biogenic amine 5HT receptor 0.028 1 1
Echinococcus multilocularis neuropeptides capa receptor 0.028 1 1
Echinococcus granulosus tachykinin peptides receptor 99D 0.028 1 1
Plasmodium vivax vivapain-2 0.0072 0.0242 0.5
Schistosoma mansoni ancient conserved domain protein 2 (cyclin m2) 0.028 1 1
Loa Loa (eye worm) cysteine protease 0.0072 0.0242 0.0242
Leishmania major cysteine peptidase A (CPA) 0.0072 0.0242 0.0438
Echinococcus multilocularis cathepsin b 0.0177 0.5169 0.5049
Echinococcus multilocularis dro:myosuppressin receptor 0.028 1 1
Loa Loa (eye worm) hypothetical protein 0.028 1 1
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0185 0.5529 1
Echinococcus multilocularis G protein coupled 5 hydroxytryptamine receptor 0.028 1 1
Brugia malayi gonadotropin-releasing hormone receptor 2 0.028 1 1
Loa Loa (eye worm) hypothetical protein 0.028 1 1
Schistosoma mansoni amine GPCR 0.028 1 1
Loa Loa (eye worm) hypothetical protein 0.0072 0.0242 0.0242
Brugia malayi ORL1-like opioid receptor 0.028 1 1
Schistosoma mansoni growth hormone secretagogue receptor 0.028 1 1
Plasmodium vivax vivapain-2 0.0072 0.0242 0.5
Schistosoma mansoni rhodopsin-like orphan GPCR 0.028 1 1
Loa Loa (eye worm) melatonin receptor type 1A 0.028 1 1
Loa Loa (eye worm) hypothetical protein 0.028 1 1
Schistosoma mansoni neuropeptide f receptor 76f 0.028 1 1
Onchocerca volvulus 0.028 1 1
Brugia malayi hypothetical protein 0.028 1 1
Echinococcus granulosus peptide allatostatin:somatostatin 0.028 1 1
Echinococcus multilocularis 7TM GPCR, rhodopsin 0.028 1 1
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0185 0.5529 1
Echinococcus granulosus g protein linked acetylcholine receptor gar 2a 0.028 1 1
Echinococcus multilocularis g-protein coupled receptor 0.028 1 1
Echinococcus granulosus rhodopsin orphan GPCR 0.028 1 1
Schistosoma mansoni opsin-like receptor 0.028 1 1
Echinococcus multilocularis tm gpcr rhodopsin gpcr rhodopsin superfamily 0.028 1 1
Loa Loa (eye worm) hypothetical protein 0.028 1 1
Schistosoma mansoni biogenic amine receptor 0.028 1 1
Brugia malayi AKH receptor 0.028 1 1
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0072 0.0242 1
Loa Loa (eye worm) hypothetical protein 0.028 1 1
Loa Loa (eye worm) hypothetical protein 0.028 1 1
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0185 0.5529 1
Echinococcus multilocularis rhodopsin orphan GPCR 0.028 1 1
Schistosoma mansoni hypothetical protein 0.028 1 1
Trichomonas vaginalis Clan CA, family C1, cathepsin L or K-like cysteine peptidase 0.0072 0.0242 1
Trypanosoma cruzi major cysteine proteinase, putative 0.013 0.2972 0.5375
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0185 0.5529 1
Loa Loa (eye worm) 5-hydroxytryptamine 2C receptor 0.028 1 1
Echinococcus multilocularis g protein coupled receptor 0.028 1 1
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0072 0.0242 1
Echinococcus granulosus fmrfamide receptor 0.028 1 1
Loa Loa (eye worm) ctsf protein 0.0072 0.0242 0.0242
Echinococcus granulosus rhodopsin orphan GPCR 0.028 1 1
Echinococcus granulosus rhodopsin orphan GPCR 0.028 1 1
Loa Loa (eye worm) hypothetical protein 0.028 1 1
Schistosoma mansoni muscarinic acetylcholine (GAR) receptor 0.028 1 1
Schistosoma mansoni biogenic amine (octopamine/dopamine) receptor 0.028 1 1
Echinococcus multilocularis neuropeptide Y receptor 0.028 1 1
Onchocerca volvulus 0.028 1 1
Leishmania major cathepsin L-like protease 0.0072 0.0242 0.0438
Echinococcus multilocularis rhodopsin orphan GPCR 0.028 1 1
Echinococcus multilocularis pyroglutamylated rfamide peptide receptor 0.028 1 1
Echinococcus granulosus rhodopsin orphan GPCR 0.028 1 1
Toxoplasma gondii cathepsin CPL 0.0072 0.0242 1
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0072 0.0242 1
Echinococcus multilocularis g protein coupled receptor 0.028 1 1
Echinococcus granulosus neuropeptides capa receptor 0.028 1 1
Onchocerca volvulus 0.028 1 1
Schistosoma mansoni peptide (FMRFamide/somatostatin)-like receptor 0.028 1 1
Trypanosoma cruzi cysteine peptidase, clan CA, family C1, cathepsin L-like, putative 0.0163 0.4493 0.8125
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0072 0.0242 1
Leishmania major cathepsin L-like protease 0.0185 0.5529 1
Echinococcus granulosus thyrotropin releasing hormone receptor 0.028 1 1
Schistosoma mansoni peptide (FMRFamide/somatostatin)-like receptor 0.028 1 1
Loa Loa (eye worm) papain family cysteine protease containing protein 0.0072 0.0242 0.0242
Echinococcus multilocularis neuropeptide FF receptor 2 0.028 1 1
Loa Loa (eye worm) hypothetical protein 0.028 1 1
Schistosoma mansoni hypothetical protein 0.028 1 1
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0072 0.0242 1
Echinococcus granulosus rhodopsin orphan GPCR 0.028 1 1
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0072 0.0242 1
Loa Loa (eye worm) fibroinase 0.0072 0.0242 0.0242
Echinococcus multilocularis tm gpcr rhodopsin gpcr rhodopsin superfamily 0.028 1 1
Brugia malayi follicle stimulating hormone receptor 0.028 1 1
Schistosoma mansoni rhodopsin-like orphan GPCR 0.028 1 1
Echinococcus multilocularis peptide (allatostatin:somatostatin) 0.028 1 1
Loa Loa (eye worm) hypothetical protein 0.028 1 1
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0072 0.0242 1
Schistosoma mansoni cathepsin B-like peptidase (C01 family) 0.0177 0.5169 0.5169
Loa Loa (eye worm) gonadotropin-releasing hormone receptor 2 0.028 1 1
Onchocerca volvulus 0.028 1 1
Brugia malayi larval opioid receptor 0.028 1 1
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0072 0.0242 1
Brugia malayi neuropeptide F receptor 0.028 1 1
Schistosoma mansoni amine GPCR 0.028 1 1
Loa Loa (eye worm) hypothetical protein 0.028 1 1
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0072 0.0242 1
Loa Loa (eye worm) hypothetical protein 0.028 1 1
Loa Loa (eye worm) hypothetical protein 0.028 1 1
Echinococcus granulosus biogenic amine 5HT receptor 0.028 1 1
Brugia malayi Tachykinin-like peptides receptor 99D 0.028 1 1
Onchocerca volvulus 0.028 1 1
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0072 0.0242 1
Schistosoma mansoni neuropeptide receptor 0.028 1 1
Echinococcus granulosus tm gpcr rhodopsin 0.028 1 1
Onchocerca volvulus 0.028 1 1
Loa Loa (eye worm) hypothetical protein 0.028 1 1
Echinococcus multilocularis rhodopsin orphan GPCR 0.028 1 1
Loa Loa (eye worm) hypothetical protein 0.028 1 1
Schistosoma mansoni rhodopsin-like orphan GPCR 0.028 1 1
Schistosoma mansoni histamine h1 receptor 0.028 1 1
Trypanosoma cruzi cysteine peptidase C (CPC), putative 0.0177 0.5169 0.9349
Loa Loa (eye worm) hypothetical protein 0.028 1 1
Echinococcus multilocularis rhodopsin orphan GPCR 0.028 1 1
Brugia malayi Melatonin receptor type 1A 0.028 1 1
Onchocerca volvulus 0.028 1 1
Echinococcus granulosus pyroglutamylated rfamide peptide receptor 0.028 1 1
Schistosoma mansoni cathepsin F (C01 family) 0.0072 0.0242 0.0242
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0072 0.0242 1
Echinococcus granulosus hypothetical protein 0.028 1 1
Echinococcus multilocularis somatostatin receptor 0.028 1 1
Schistosoma mansoni neuropeptide receptor 0.028 1 1
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0185 0.5529 1
Leishmania major cathepsin L-like protease 0.0072 0.0242 0.0438
Schistosoma mansoni peptide (allatostatin/somatostatin)-like receptor 0.028 1 1
Loa Loa (eye worm) hypothetical protein 0.028 1 1
Trypanosoma cruzi cysteine peptidase, putative 0.0072 0.0242 0.0438
Schistosoma mansoni amine GPCR 0.028 1 1
Loa Loa (eye worm) hypothetical protein 0.028 1 1
Schistosoma mansoni rhodopsin-like orphan GPCR 0.028 1 1
Brugia malayi putative neuropeptide receptor 0.028 1 1
Echinococcus granulosus somatostatin receptor 0.028 1 1
Entamoeba histolytica cysteine proteinase, putative 0.0072 0.0242 0.5
Echinococcus granulosus neuropeptide receptor 0.028 1 1
Onchocerca volvulus 0.028 1 1
Onchocerca volvulus 0.028 1 1
Brugia malayi Serotonin receptor 0.028 1 1
Brugia malayi hypothetical protein 0.028 1 1
Schistosoma mansoni neuropeptide F-like receptor 0.028 1 1
Brugia malayi RE15519p 0.028 1 1
Loa Loa (eye worm) hypothetical protein 0.028 1 1
Echinococcus granulosus cathepsin b 0.0177 0.5169 0.5049
Schistosoma mansoni rhodopsin-like orphan GPCR 0.028 1 1
Echinococcus multilocularis neuropeptide receptor 0.028 1 1
Echinococcus multilocularis serotonin receptor 0.028 1 1
Leishmania major cathepsin L-like protease 0.0185 0.5529 1

Activities

Activity type Activity value Assay description Source Reference
ID50 (functional) = 0.6 ug ml-1 Inhibitory effect on the proliferation of human T-lymphoblast cells (Molt-4F) ChEMBL. 1324318
ID50 (functional) = 0.77 ug ml-1 Inhibitory effect on the proliferation of human T-lymphocyte (MT-4) ChEMBL. 1324318
ID50 (functional) = 1.4 ug ml-1 Inhibitory effect on the proliferation of murine leukemia cells (L1210) ChEMBL. 1324318
MCC (functional) > 4 ug ml-1 Evaluation in HeLa cell cultures for cytotoxicity that is to cause microscopically detectable alteration of normal cell morphology ChEMBL. 1324318
MIC (functional) > 1 ug ml-1 Evaluation for antiviral activity against vesicular stomatitis virus in HeLa cell cultures(Concentration required to reduce virus-induced cytopathogenicity by 50%) ChEMBL. 1324318
MIC (functional) > 1 ug ml-1 Evaluation for antiviral activity against Coxsackie virus B4 in HeLa cell cultures(Concentration required to reduce virus-induced cytopathogenicity by 50%) ChEMBL. 1324318
MIC (functional) > 1 ug ml-1 Evaluation for antiviral activity against polio virus-1 in HeLa cell cultures(Concentration required to reduce virus-induced cytopathogenicity by 50%) ChEMBL. 1324318
MIC (functional) > 1.6 ug ml-1 Compound was evaluated for antiviral activity against respiratory syncitial virus (long) in HeLa cell cultures(Concentration required to reduce virus-induced cytopathogenicity by 50%) ChEMBL. 1324318

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

No literature references available for this target.

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