Detailed information for compound 1847623

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 1376.4 | Formula: C57H84IN15O13S2
  • H donors: 12 H acceptors: 12 LogP: 1.72 Rotable bonds: 44
    Rule of 5 violations (Lipinski): 4
  • SMILES: NCCC[C@@H](C(=O)N[C@H](C(=O)N)Cc1ccc(c(c1)[125I])N=[N+]=[N-])NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)[C@H]([C@H](CC)C)NC(=O)[C@H](Cc1ccc(cc1)OC)NC(=O)CC1(SCCC(=O)N)CCCCC1)CC(=O)N)CS
  • InChi: 1S/C57H84IN15O13S2/c1-5-31(2)47(69-52(81)40(26-33-13-16-35(86-4)17-14-33)64-46(77)29-57(20-7-6-8-21-57)88-24-19-44(60)75)54(83)70-48(32(3)74)55(84)67-41(28-45(61)76)51(80)68-42(30-87)56(85)73-23-10-12-43(73)53(82)65-38(11-9-22-59)50(79)66-39(49(62)78)27-34-15-18-37(71-72-63)36(58)25-34/h13-18,25,31-32,38-43,47-48,74,87H,5-12,19-24,26-30,59H2,1-4H3,(H2,60,75)(H2,61,76)(H2,62,78)(H,64,77)(H,65,82)(H,66,79)(H,67,84)(H,68,80)(H,69,81)(H,70,83)/t31-,32+,38-,39-,40-,41-,42-,43-,47-,48-/m0/s1/i58-2
  • InChiKey: QCTGMXVVKPQUMV-RLDPEHNRSA-N  


Substructure search Similarity search

Network

Hover on a compound node to display the structore

Synonyms

No synonyms found for this compound

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens oxytocin receptor Starlite/ChEMBL References

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 granulosus G protein coupled 5 hydroxytryptamine receptor 0.0025 0.1964 0.1945
Trypanosoma brucei DNA topoisomerase IB, large subunit 0.0092 1 1
Echinococcus granulosus orexin receptor type 2 0.0025 0.1964 0.1945
Schistosoma mansoni amine GPCR 0.0025 0.1964 0.1945
Echinococcus multilocularis tm gpcr rhodopsin gpcr rhodopsin superfamily 0.0025 0.1964 0.1945
Schistosoma mansoni peptide (FMRFamide/somatostatin)-like receptor 0.0025 0.1964 0.1945
Echinococcus multilocularis g protein coupled receptor 0.0025 0.1964 0.1945
Loa Loa (eye worm) hypothetical protein 0.0025 0.1964 0.1945
Echinococcus multilocularis protein kinase c epsilon type 0.0017 0.0951 0.093
Trichomonas vaginalis AGC family protein kinase 0.0009 0.0023 1
Loa Loa (eye worm) hypothetical protein 0.0025 0.1964 0.1945
Brugia malayi Tachykinin-like peptides receptor 99D 0.0025 0.1964 0.1945
Echinococcus multilocularis fmrfamide receptor 0.0025 0.1964 0.1945
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0025 0.1964 0.1945
Echinococcus multilocularis G protein coupled receptor 139 0.0025 0.1964 0.1945
Onchocerca volvulus 0.0025 0.1964 0.5
Loa Loa (eye worm) hypothetical protein 0.0025 0.1964 0.1945
Brugia malayi ORL1-like opioid receptor 0.0025 0.1964 0.1945
Loa Loa (eye worm) hypothetical protein 0.0025 0.1964 0.1945
Onchocerca volvulus 0.0025 0.1964 0.5
Onchocerca volvulus 0.0025 0.1964 0.5
Echinococcus granulosus g protein coupled receptor 0.0025 0.1964 0.1945
Echinococcus granulosus G protein coupled receptor 139 0.0025 0.1964 0.1945
Brugia malayi Dopamine receptor protein 2 0.0025 0.1964 0.1945
Echinococcus multilocularis 7TM GPCR, rhodopsin 0.0025 0.1964 0.1945
Loa Loa (eye worm) gonadotropin-releasing hormone receptor 2 0.0025 0.1964 0.1945
Echinococcus multilocularis rhodopsin orphan GPCR 0.0025 0.1964 0.1945
Schistosoma mansoni myosin xvIII 0.0025 0.1964 0.1945
Schistosoma mansoni biogenic amine (dopamine) receptor 0.0025 0.1964 0.1945
Loa Loa (eye worm) hypothetical protein 0.0025 0.1964 0.1945
Onchocerca volvulus 0.0025 0.1964 0.5
Brugia malayi neuropeptide F receptor 0.0025 0.1964 0.1945
Loa Loa (eye worm) hypothetical protein 0.0025 0.1964 0.1945
Loa Loa (eye worm) TYRA-2 protein 0.0025 0.1964 0.1945
Schistosoma mansoni neuropeptide F-like receptor 0.0025 0.1964 0.1945
Loa Loa (eye worm) hypothetical protein 0.0025 0.1964 0.1945
Echinococcus multilocularis neuropeptide FF receptor 2 0.0025 0.1964 0.1945
Echinococcus multilocularis rhodopsin orphan GPCR 0.0025 0.1964 0.1945
Onchocerca volvulus 0.0025 0.1964 0.5
Echinococcus multilocularis serotonin receptor 0.0025 0.1964 0.1945
Entamoeba histolytica protein kinase, putative 0.0009 0.0023 0.5
Echinococcus multilocularis rhodopsin orphan GPCR 0.0025 0.1964 0.1945
Echinococcus granulosus tachykinin peptides receptor 99D 0.0025 0.1964 0.1945
Trypanosoma cruzi DNA topoisomerase IB, large subunit, putative 0.0092 1 0.5
Loa Loa (eye worm) hypothetical protein 0.0025 0.1964 0.1945
Schistosoma mansoni neuropeptide f receptor 76f 0.0025 0.1964 0.1945
Brugia malayi hypothetical protein 0.0025 0.1964 0.1945
Trichomonas vaginalis AGC family protein kinase 0.0009 0.0023 1
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0025 0.1964 0.1945
Echinococcus granulosus dro:myosuppressin receptor 0.0025 0.1964 0.1945
Echinococcus granulosus thyrotropin releasing hormone receptor 0.0025 0.1964 0.1945
Onchocerca volvulus 0.0025 0.1964 0.5
Echinococcus granulosus tm gpcr rhodopsin 0.0025 0.1964 0.1945
Brugia malayi Serotonin/octopamine receptor family protein 7 0.0025 0.1964 0.1945
Echinococcus granulosus biogenic amine 5HT receptor 0.0025 0.1964 0.1945
Loa Loa (eye worm) hypothetical protein 0.0025 0.1964 0.1945
Echinococcus multilocularis growth hormone secretagogue receptor type 1 0.0025 0.1964 0.1945
Loa Loa (eye worm) hypothetical protein 0.0025 0.1964 0.1945
Echinococcus multilocularis serotonin receptor 0.0025 0.1964 0.1945
Echinococcus multilocularis g protein coupled receptor 0.0025 0.1964 0.1945
Brugia malayi protein kinase C II. 0.0017 0.0951 0.093
Schistosoma mansoni hypothetical protein 0.0025 0.1964 0.1945
Echinococcus granulosus 7tm_1 domain containing protein 0.0025 0.1964 0.1945
Schistosoma mansoni neuropeptide F-like receptor 0.0025 0.1964 0.1945
Schistosoma mansoni atypical protein kinase C 0.0015 0.0791 0.077
Brugia malayi gonadotropin-releasing hormone receptor 2 0.0025 0.1964 0.1945
Echinococcus granulosus hypothetical protein 0.0025 0.1964 0.1945
Schistosoma mansoni biogenic amine receptor 0.0025 0.1964 0.1945
Loa Loa (eye worm) hypothetical protein 0.0025 0.1964 0.1945
Echinococcus multilocularis orexin receptor type 2 0.0025 0.1964 0.1945
Echinococcus granulosus protein kinase c iota type 0.0015 0.0791 0.077
Schistosoma mansoni muscarinic acetylcholine (GAR) receptor 0.0025 0.1964 0.1945
Trichomonas vaginalis AGC family protein kinase 0.0009 0.0023 1
Echinococcus multilocularis tm gpcr rhodopsin gpcr rhodopsin superfamily 0.0025 0.1964 0.1945
Onchocerca volvulus 0.0025 0.1964 0.5
Echinococcus multilocularis g protein linked acetylcholine receptor gar 2a 0.0025 0.1964 0.1945
Leishmania major DNA topoisomerase IB, large subunit 0.0092 1 0.5
Brugia malayi Dopamine receptor protein 1, putative (partial) 0.0025 0.1964 0.1945
Schistosoma mansoni DNA topoisomerase type I 0.0092 1 1
Echinococcus granulosus RNA directed DNA polymerase 0.0042 0.3947 0.3933
Echinococcus granulosus serotonin receptor 0.0025 0.1964 0.1945
Echinococcus multilocularis thyrotropin releasing hormone receptor 0.0025 0.1964 0.1945
Loa Loa (eye worm) hypothetical protein 0.0025 0.1964 0.1945
Schistosoma mansoni hypothetical protein 0.0025 0.1964 0.1945
Echinococcus granulosus pyroglutamylated rfamide peptide receptor 0.0025 0.1964 0.1945
Schistosoma mansoni biogenic amine (dopamine) receptor 0.0025 0.1964 0.1945
Brugia malayi G-protein-linked acetylcholine receptor protein 2, putative 0.0025 0.1964 0.1945
Brugia malayi hypothetical protein 0.0025 0.1964 0.1945
Schistosoma mansoni neuropeptide receptor 0.0025 0.1964 0.1945
Brugia malayi sulfakinin receptor protein 0.0025 0.1964 0.1945
Echinococcus multilocularis neuropeptide receptor 0.0025 0.1964 0.1945
Echinococcus multilocularis RNA directed DNA polymerase 0.0042 0.3947 0.3933
Onchocerca volvulus Neuropeptide F receptor homolog 0.0025 0.1964 0.5
Brugia malayi RE15519p 0.0025 0.1964 0.1945
Echinococcus multilocularis peptide (allatostatin:somatostatin) 0.0025 0.1964 0.1945
Loa Loa (eye worm) hypothetical protein 0.0025 0.1964 0.1945
Echinococcus multilocularis somatostatin receptor 0.0025 0.1964 0.1945
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0025 0.1964 0.1945
Loa Loa (eye worm) unidentified vitellogenin-linked transcript protein 6 0.0025 0.1964 0.1945
Onchocerca volvulus 0.0025 0.1964 0.5
Loa Loa (eye worm) hypothetical protein 0.0025 0.1964 0.1945
Plasmodium vivax topoisomerase I, putative 0.0092 1 0.5
Plasmodium falciparum topoisomerase I 0.0092 1 0.5
Schistosoma mansoni peptide (FMRFamide/somatostatin)-like receptor 0.0025 0.1964 0.1945
Echinococcus multilocularis rhodopsin orphan GPCR 0.0025 0.1964 0.1945
Echinococcus multilocularis alpha 1A adrenergic receptor 0.0025 0.1964 0.1945
Loa Loa (eye worm) hypothetical protein 0.0042 0.3947 0.3933
Loa Loa (eye worm) hypothetical protein 0.0025 0.1964 0.1945
Schistosoma mansoni opsin-like receptor 0.0025 0.1964 0.1945
Echinococcus granulosus fmrfamide receptor 0.0025 0.1964 0.1945
Echinococcus multilocularis dro:myosuppressin receptor 0.0025 0.1964 0.1945
Schistosoma mansoni opsin-like receptor 0.0025 0.1964 0.1945
Entamoeba histolytica protein kinase, putative 0.0009 0.0023 0.5
Loa Loa (eye worm) hypothetical protein 0.0025 0.1964 0.1945
Echinococcus granulosus neuropeptide receptor 0.0025 0.1964 0.1945
Echinococcus granulosus neuropeptide s receptor 0.0025 0.1964 0.1945
Onchocerca volvulus 0.0025 0.1964 0.5
Brugia malayi hypothetical protein 0.0025 0.1964 0.1945
Echinococcus multilocularis fmrfamide receptor 0.0025 0.1964 0.1945
Brugia malayi Melatonin receptor type 1A 0.0025 0.1964 0.1945
Loa Loa (eye worm) hypothetical protein 0.0025 0.1964 0.1945
Echinococcus granulosus g protein linked acetylcholine receptor gar 2a 0.0025 0.1964 0.1945
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0025 0.1964 0.1945
Brugia malayi hypothetical protein 0.0025 0.1964 0.1945
Loa Loa (eye worm) G-protein-linked acetylcholine receptor protein 2 0.0025 0.1964 0.1945
Brugia malayi hypothetical protein 0.0025 0.1964 0.1945
Loa Loa (eye worm) hypothetical protein 0.0025 0.1964 0.1945
Loa Loa (eye worm) hypothetical protein 0.0025 0.1964 0.1945
Echinococcus granulosus rhodopsin orphan GPCR 0.0025 0.1964 0.1945
Toxoplasma gondii DNA topoisomerase I, putative 0.0092 1 1
Echinococcus granulosus tm gpcr rhodopsin 0.0025 0.1964 0.1945
Brugia malayi neuropeptide F receptor 0.0025 0.1964 0.1945
Loa Loa (eye worm) hypothetical protein 0.0025 0.1964 0.1945
Echinococcus granulosus rhodopsin orphan GPCR 0.0025 0.1964 0.1945
Echinococcus multilocularis serine threonine protein kinase 0.0052 0.5193 0.5182
Onchocerca volvulus 0.0025 0.1964 0.5
Loa Loa (eye worm) hypothetical protein 0.0025 0.1964 0.1945
Echinococcus granulosus protein kinase C gamma type 0.0052 0.5193 0.5182
Schistosoma mansoni DNA topoisomerase type I 0.0092 1 1
Echinococcus granulosus neuropeptide Y receptor 0.0025 0.1964 0.1945
Brugia malayi hypothetical protein 0.0025 0.1964 0.1945
Schistosoma mansoni peptide (allatostatin/somatostatin)-like receptor 0.0025 0.1964 0.1945
Echinococcus multilocularis g protein linked acetylcholine receptor gar 2a 0.0025 0.1964 0.1945
Schistosoma mansoni peptide (FMRFamide/neurokinin-3)-like receptor 0.0025 0.1964 0.1945
Echinococcus granulosus rhodopsin orphan GPCR 0.0025 0.1964 0.1945
Brugia malayi AKH receptor 0.0025 0.1964 0.1945
Loa Loa (eye worm) hypothetical protein 0.0025 0.1964 0.1945
Echinococcus granulosus allatostatin A receptor 0.0025 0.1964 0.1945
Brugia malayi G protein-coupled receptor F59B2.13 0.0025 0.1964 0.1945
Echinococcus granulosus growth hormone secretagogue receptor type 1 0.0025 0.1964 0.1945
Brugia malayi Serotonin receptor 0.0025 0.1964 0.1945
Echinococcus multilocularis neuropeptide receptor 0.0025 0.1964 0.1945
Loa Loa (eye worm) hypothetical protein 0.0025 0.1964 0.1945
Schistosoma mansoni serine/threonine protein kinase 0.0017 0.0951 0.093
Echinococcus granulosus protein kinase c epsilon type 0.0017 0.0951 0.093
Brugia malayi Dopamine receptor protein 1 0.0025 0.1964 0.1945
Echinococcus multilocularis tachykinin peptides receptor 99D 0.0025 0.1964 0.1945
Loa Loa (eye worm) hypothetical protein 0.0025 0.1964 0.1945
Echinococcus multilocularis rhodopsin orphan GPCR 0.0025 0.1964 0.1945
Loa Loa (eye worm) AGC/PKC/ETA protein kinase 0.0017 0.0951 0.093
Brugia malayi G-protein coupled receptor 0.0025 0.1964 0.1945
Loa Loa (eye worm) 5-hydroxytryptamine 2C receptor 0.0025 0.1964 0.1945
Entamoeba histolytica protein kinase, putative 0.0009 0.0023 0.5
Loa Loa (eye worm) follicle stimulating hormone receptor 0.0025 0.1964 0.1945
Echinococcus multilocularis rhodopsin orphan GPCR 0.0025 0.1964 0.1945
Loa Loa (eye worm) AGC/PKC/ALPHA protein kinase 0.0043 0.413 0.4116
Onchocerca volvulus 0.0025 0.1964 0.5
Echinococcus multilocularis G-protein coupled receptor, putative 0.0025 0.1964 0.1945
Schistosoma mansoni serine/threonine protein kinase 0.0058 0.5961 0.5951
Brugia malayi hypothetical protein 0.0025 0.1964 0.1945
Loa Loa (eye worm) hypothetical protein 0.0025 0.1964 0.1945
Loa Loa (eye worm) hypothetical protein 0.0025 0.1964 0.1945
Echinococcus multilocularis tm gpcr rhodopsin gpcr rhodopsin superfamily 0.0025 0.1964 0.1945
Loa Loa (eye worm) neuropeptide F receptor 0.0025 0.1964 0.1945
Loa Loa (eye worm) hypothetical protein 0.0025 0.1964 0.1945
Loa Loa (eye worm) hypothetical protein 0.0025 0.1964 0.1945
Echinococcus granulosus tm gpcr rhodopsin 0.0025 0.1964 0.1945
Echinococcus granulosus neuropeptide receptor 0.0025 0.1964 0.1945
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0025 0.1964 0.1945
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0025 0.1964 0.1945
Loa Loa (eye worm) hypothetical protein 0.0025 0.1964 0.1945
Brugia malayi G protein-coupled receptor 0.0025 0.1964 0.1945
Loa Loa (eye worm) G-protein coupled receptor 0.0025 0.1964 0.1945
Brugia malayi larval opioid receptor 0.0025 0.1964 0.1945
Echinococcus multilocularis g protein coupled receptor 0.0025 0.1964 0.1945
Schistosoma mansoni alpha-1 adrenergic receptor 0.0025 0.1964 0.1945
Onchocerca volvulus 0.0025 0.1964 0.5
Loa Loa (eye worm) DNA topoisomerase I 0.0092 1 1
Loa Loa (eye worm) hypothetical protein 0.0025 0.1964 0.1945
Echinococcus multilocularis biogenic amine (5HT) receptor 0.0025 0.1964 0.1945
Entamoeba histolytica protein kinase, putative 0.0009 0.0023 0.5
Echinococcus granulosus somatostatin receptor 0.0025 0.1964 0.1945
Schistosoma mansoni ancient conserved domain protein 2 (cyclin m2) 0.0025 0.1964 0.1945
Trichomonas vaginalis AGC family protein kinase 0.0009 0.0023 1
Trichomonas vaginalis AGC family protein kinase 0.0009 0.0023 1
Trichomonas vaginalis AGC family protein kinase 0.0009 0.0023 1
Onchocerca volvulus 0.0025 0.1964 0.5
Echinococcus multilocularis allatostatin A receptor 0.0025 0.1964 0.1945
Schistosoma mansoni adenoreceptor 0.0025 0.1964 0.1945
Loa Loa (eye worm) hypothetical protein 0.0025 0.1964 0.1945
Trichomonas vaginalis AGC family protein kinase 0.0009 0.0023 1
Echinococcus multilocularis neuropeptide receptor A26 0.0025 0.1964 0.1945
Echinococcus granulosus biogenic amine 5HT receptor 0.0025 0.1964 0.1945
Schistosoma mansoni thyrotropin-releasing hormone receptor 0.0025 0.1964 0.1945
Brugia malayi follicle stimulating hormone receptor 0.0025 0.1964 0.1945
Schistosoma mansoni histamine h1 receptor 0.0025 0.1964 0.1945
Echinococcus granulosus neuropeptide receptor A26 0.0025 0.1964 0.1945
Schistosoma mansoni biogenic amine (5HT) receptor 0.0025 0.1964 0.1945
Echinococcus granulosus rhodopsin orphan GPCR 0.0025 0.1964 0.1945
Echinococcus granulosus rhodopsin orphan GPCR 0.0025 0.1964 0.1945
Trichomonas vaginalis AGC family protein kinase 0.0009 0.0023 1
Brugia malayi hypothetical protein 0.0025 0.1964 0.1945
Brugia malayi hypothetical protein 0.0025 0.1964 0.1945
Echinococcus granulosus g protein coupled receptor 0.0025 0.1964 0.1945
Echinococcus granulosus DNA topoisomerase 1 0.0092 1 1
Loa Loa (eye worm) hypothetical protein 0.0025 0.1964 0.1945
Echinococcus multilocularis G protein coupled 5 hydroxytryptamine receptor 0.0025 0.1964 0.1945
Loa Loa (eye worm) hypothetical protein 0.0025 0.1964 0.1945
Loa Loa (eye worm) melatonin receptor type 1A 0.0025 0.1964 0.1945
Echinococcus multilocularis Protein kinase C, brain isozyme 0.0058 0.5961 0.5951
Loa Loa (eye worm) hypothetical protein 0.0025 0.1964 0.1945
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0025 0.1964 0.1945
Echinococcus multilocularis rhodopsin orphan GPCR 0.0025 0.1964 0.1945
Schistosoma mansoni biogenic amine (5HT) receptor 0.0025 0.1964 0.1945
Brugia malayi Protein kinase c protein 2 0.0049 0.4898 0.4886
Echinococcus multilocularis telomerase reverse transcriptase subunit 0.0042 0.3947 0.3933
Schistosoma mansoni growth hormone secretagogue receptor 0.0025 0.1964 0.1945
Echinococcus granulosus g-protein coupled receptor 0.0025 0.1964 0.1945
Onchocerca volvulus 0.0025 0.1964 0.5
Echinococcus granulosus alpha 1A adrenergic receptor 0.0025 0.1964 0.1945
Loa Loa (eye worm) hypothetical protein 0.0025 0.1964 0.1945
Echinococcus granulosus g protein coupled receptor 0.0025 0.1964 0.1945
Loa Loa (eye worm) G-protein coupled receptor 0.0025 0.1964 0.1945
Schistosoma mansoni DNA topoisomerase type I 0.0092 1 1
Schistosoma mansoni serine/threonine protein kinase 0.0058 0.5961 0.5951
Loa Loa (eye worm) hypothetical protein 0.0048 0.4715 0.4703
Echinococcus multilocularis neuropeptide Y receptor 0.0025 0.1964 0.1945
Echinococcus multilocularis sex peptide receptor 0.0025 0.1964 0.1945
Echinococcus multilocularis neuropeptide s receptor 0.0025 0.1964 0.1945
Echinococcus granulosus sex peptide receptor 0.0025 0.1964 0.1945
Onchocerca volvulus 0.0025 0.1964 0.5
Loa Loa (eye worm) hypothetical protein 0.0025 0.1964 0.1945
Schistosoma mansoni amine GPCR 0.0025 0.1964 0.1945
Schistosoma mansoni neuropeptide receptor 0.0025 0.1964 0.1945
Echinococcus granulosus g protein linked acetylcholine receptor gar 2a 0.0025 0.1964 0.1945
Loa Loa (eye worm) hypothetical protein 0.0025 0.1964 0.1945
Schistosoma mansoni neuropeptide receptor 0.0025 0.1964 0.1945
Brugia malayi Dopamine receptor 0.0025 0.1964 0.1945
Echinococcus multilocularis rhodopsin orphan GPCR 0.0025 0.1964 0.1945
Schistosoma mansoni biogenic amine (octopamine/dopamine) receptor 0.0025 0.1964 0.1945
Loa Loa (eye worm) hypothetical protein 0.0025 0.1964 0.1945
Echinococcus granulosus neuropeptide Y receptor 0.0025 0.1964 0.1945
Echinococcus multilocularis neuropeptides capa receptor 0.0025 0.1964 0.1945
Echinococcus granulosus rhodopsin orphan GPCR 0.0025 0.1964 0.1945
Echinococcus granulosus peptide allatostatin:somatostatin 0.0025 0.1964 0.1945
Echinococcus granulosus neuropeptides capa receptor 0.0025 0.1964 0.1945
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0025 0.1964 0.1945
Brugia malayi GnHR receptor homolog 0.0025 0.1964 0.1945
Onchocerca volvulus Dopamine\/Ecdysteroid receptor homolog 0.0025 0.1964 0.5
Schistosoma mansoni biogenic amine receptor 0.0025 0.1964 0.1945
Echinococcus granulosus Protein kinase C brain isozyme 0.0058 0.5961 0.5951
Brugia malayi putative neuropeptide receptor 0.0025 0.1964 0.1945
Schistosoma mansoni hypothetical protein 0.0025 0.1964 0.1945
Brugia malayi hypothetical protein 0.0025 0.1964 0.1945
Echinococcus multilocularis neuropeptide Y receptor 0.0025 0.1964 0.1945
Echinococcus multilocularis neuropeptides capa receptor 0.0025 0.1964 0.1945
Trichomonas vaginalis AGC family protein kinase 0.0009 0.0023 1
Schistosoma mansoni peptide (allatostatin)-like receptor 0.0025 0.1964 0.1945
Loa Loa (eye worm) neuropeptide F receptor 0.0025 0.1964 0.1945
Loa Loa (eye worm) hypothetical protein 0.0025 0.1964 0.1945
Echinococcus multilocularis DNA topoisomerase 1 0.0092 1 1
Loa Loa (eye worm) hypothetical protein 0.0025 0.1964 0.1945
Schistosoma mansoni biogenic amine receptor 0.0025 0.1964 0.1945
Schistosoma mansoni hypothetical protein 0.0025 0.1964 0.1945
Schistosoma mansoni histamine-responsive GPCR (AAF21638) 0.0025 0.1964 0.1945
Brugia malayi Serotonin receptor 0.0025 0.1964 0.1945
Schistosoma mansoni amine GPCR 0.0025 0.1964 0.1945
Echinococcus granulosus 7TM GPCR rhodopsin 0.0025 0.1964 0.1945
Schistosoma mansoni opsin-like receptor 0.0025 0.1964 0.1945
Loa Loa (eye worm) hypothetical protein 0.0025 0.1964 0.1945
Onchocerca volvulus 0.0025 0.1964 0.5
Onchocerca volvulus 0.0025 0.1964 0.5
Echinococcus granulosus neuropeptide FF receptor 2 0.0025 0.1964 0.1945
Loa Loa (eye worm) hypothetical protein 0.0025 0.1964 0.1945
Trichomonas vaginalis AGC family protein kinase 0.0009 0.0023 1
Loa Loa (eye worm) hypothetical protein 0.0025 0.1964 0.1945
Trichomonas vaginalis AGC family protein kinase 0.0009 0.0023 1
Brugia malayi putative neuropeptide receptor NPR1 0.0025 0.1964 0.1945
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0025 0.1964 0.1945
Schistosoma mansoni biogenic amine (dopamine) receptor 0.0025 0.1964 0.1945
Echinococcus multilocularis pyroglutamylated rfamide peptide receptor 0.0025 0.1964 0.1945
Loa Loa (eye worm) hypothetical protein 0.0025 0.1964 0.1945
Brugia malayi Unidentified vitellogenin-linked transcript protein 6, putative 0.0025 0.1964 0.1945
Brugia malayi G-protein coupled receptor 0.0025 0.1964 0.1945
Echinococcus multilocularis g-protein coupled receptor 0.0025 0.1964 0.1945
Loa Loa (eye worm) hypothetical protein 0.0025 0.1964 0.1945
Echinococcus granulosus rhodopsin orphan GPCR 0.0025 0.1964 0.1945
Schistosoma mansoni neuropeptide receptor 0.0025 0.1964 0.1945
Echinococcus multilocularis protein kinase c iota type 0.0015 0.0791 0.077
Schistosoma mansoni amine GPCR 0.0025 0.1964 0.1945
Schistosoma mansoni amine GPCR 0.0025 0.1964 0.1945
Echinococcus granulosus neuropeptides capa receptor 0.0025 0.1964 0.1945

Activities

Activity type Activity value Assay description Source Reference
Kd (binding) = 0.25 nM Dissociation constant value of the compound was determined for human OT-receptor ChEMBL. 11520211

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.