Detailed information for compound 1471751

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 573.87 | Formula: C34H55NO4S
  • H donors: 3 H acceptors: 4 LogP: 7.43 Rotable bonds: 16
    Rule of 5 violations (Lipinski): 2
  • SMILES: CCCCN(C(=O)CCCCCCCCCCS[C@@H]1[C@H](O)c2cc(O)ccc2[C@@H]2[C@@H]1[C@@H]1CC[C@@H]([C@]1(CC2)C)O)C
  • InChi: 1S/C34H55NO4S/c1-4-5-21-35(3)30(38)14-12-10-8-6-7-9-11-13-22-40-33-31-26(19-20-34(2)28(31)17-18-29(34)37)25-16-15-24(36)23-27(25)32(33)39/h15-16,23,26,28-29,31-33,36-37,39H,4-14,17-22H2,1-3H3/t26-,28+,29+,31-,32-,33+,34+/m1/s1
  • InChiKey: BCOZZDRWMQBVGK-VZQPPDIBSA-N  


Substructure search Similarity search

Network

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Synonyms

No synonyms found for this compound

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens estrogen receptor 1 Starlite/ChEMBL References
Homo sapiens estrogen receptor 2 (ER beta) 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
Species Potential target Known druggable target Length Alignment span Identity
Loa Loa (eye worm) hypothetical protein estrogen receptor 2 (ER beta) 495 aa 418 aa 25.8 %
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0153 0.207 0.207
Echinococcus multilocularis Membrane bound O acyl transferase, MBOAT 0.0114 0.1473 0.1473
Trichomonas vaginalis conserved hypothetical protein 0.002 0.0047 0.0039
Echinococcus multilocularis rhodopsin orphan GPCR 0.0153 0.207 0.207
Loa Loa (eye worm) hypothetical protein 0.0153 0.207 0.207
Echinococcus granulosus axis inhibition protein axin 0.002 0.0047 0.0047
Loa Loa (eye worm) hypothetical protein 0.0153 0.207 0.207
Echinococcus multilocularis alpha 1A adrenergic receptor 0.0153 0.207 0.207
Loa Loa (eye worm) hypothetical protein 0.0153 0.207 0.207
Schistosoma mansoni opsin-like receptor 0.0153 0.207 0.207
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0153 0.207 0.207
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0153 0.207 0.207
Loa Loa (eye worm) hypothetical protein 0.0153 0.207 0.207
Brugia malayi Regulator of G protein signaling domain containing protein 0.002 0.0047 0.0047
Brugia malayi GnHR receptor homolog 0.0153 0.207 0.207
Schistosoma mansoni ap endonuclease 0.0019 0.0041 0.0041
Schistosoma mansoni regulator of G protein signaling 0.002 0.0047 0.0047
Echinococcus multilocularis expressed protein 0.0381 0.5515 0.5515
Echinococcus granulosus neuropeptide receptor 0.0153 0.207 0.207
Echinococcus multilocularis neuropeptide receptor 0.0153 0.207 0.207
Schistosoma mansoni histamine-responsive GPCR (AAF21638) 0.0153 0.207 0.207
Schistosoma mansoni peptide (FMRFamide/somatostatin)-like receptor 0.0153 0.207 0.207
Loa Loa (eye worm) hypothetical protein 0.0114 0.1473 0.1473
Echinococcus granulosus neuropeptides capa receptor 0.0153 0.207 0.207
Onchocerca volvulus 0.0153 0.207 1
Brugia malayi Dopamine receptor protein 2 0.0153 0.207 0.207
Brugia malayi follicle stimulating hormone receptor 0.0153 0.207 0.207
Schistosoma mansoni regulator of G protein signaling 3 rgs3 0.002 0.0047 0.0047
Brugia malayi A-kinase anchor protein 10, precursor 0.002 0.0047 0.0047
Brugia malayi hypothetical protein 0.0153 0.207 0.207
Echinococcus granulosus expressed protein 0.0381 0.5515 0.5515
Loa Loa (eye worm) AGC/GRK/GRK protein kinase 0.002 0.0047 0.0047
Echinococcus granulosus neuropeptides capa receptor 0.0153 0.207 0.207
Echinococcus multilocularis o acyltransferase (membrane bound) domain 0.0114 0.1473 0.1473
Entamoeba histolytica vacuolar protein sorting 26 0.0114 0.1473 1
Echinococcus multilocularis G protein coupled 5 hydroxytryptamine receptor 0.0153 0.207 0.207
Schistosoma mansoni peptide (allatostatin/somatostatin)-like receptor 0.0153 0.207 0.207
Schistosoma mansoni biogenic amine receptor 0.0153 0.207 0.207
Onchocerca volvulus 0.0153 0.207 1
Schistosoma mansoni amine GPCR 0.0153 0.207 0.207
Loa Loa (eye worm) 5-hydroxytryptamine 2C receptor 0.0153 0.207 0.207
Echinococcus multilocularis tachykinin peptides receptor 99D 0.0153 0.207 0.207
Brugia malayi hypothetical protein 0.002 0.0047 0.0047
Schistosoma mansoni amine GPCR 0.0153 0.207 0.207
Loa Loa (eye worm) hypothetical protein 0.0153 0.207 0.207
Loa Loa (eye worm) hypothetical protein 0.0153 0.207 0.207
Loa Loa (eye worm) hypothetical protein 0.002 0.0047 0.0047
Brugia malayi Unidentified vitellogenin-linked transcript protein 6, putative 0.0153 0.207 0.207
Schistosoma mansoni regulator of G protein signaling 0.002 0.0047 0.0047
Schistosoma mansoni neuropeptide receptor 0.0153 0.207 0.207
Loa Loa (eye worm) hypothetical protein 0.0153 0.207 0.207
Echinococcus multilocularis rhodopsin orphan GPCR 0.0153 0.207 0.207
Echinococcus granulosus A kinase anchor protein 10 mitochondrial 0.002 0.0047 0.0047
Trypanosoma brucei glycerol uptake protein, putative 0.0114 0.1473 1
Echinococcus multilocularis G-protein coupled receptor, putative 0.0153 0.207 0.207
Loa Loa (eye worm) hypothetical protein 0.0153 0.207 0.207
Echinococcus granulosus neuropeptide Y receptor 0.0153 0.207 0.207
Brugia malayi G-protein coupled receptor 0.0153 0.207 0.207
Onchocerca volvulus 0.0153 0.207 1
Echinococcus granulosus neuropeptide s receptor 0.0153 0.207 0.207
Echinococcus multilocularis axis inhibition protein axin 0.002 0.0047 0.0047
Onchocerca volvulus 0.0153 0.207 1
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0153 0.207 0.207
Loa Loa (eye worm) TYRA-2 protein 0.0153 0.207 0.207
Loa Loa (eye worm) hypothetical protein 0.0114 0.1473 0.1473
Schistosoma mansoni hypothetical protein 0.0153 0.207 0.207
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0153 0.207 0.207
Loa Loa (eye worm) hypothetical protein 0.0153 0.207 0.207
Onchocerca volvulus 0.0114 0.1473 0.7117
Loa Loa (eye worm) unidentified vitellogenin-linked transcript protein 6 0.0153 0.207 0.207
Brugia malayi ORL1-like opioid receptor 0.0153 0.207 0.207
Schistosoma mansoni zinc finger protein 0.0114 0.1473 0.1473
Echinococcus granulosus peptide allatostatin:somatostatin 0.0153 0.207 0.207
Loa Loa (eye worm) membrane bound O-acyltransferase domain containing 1 0.0114 0.1473 0.1473
Echinococcus granulosus growth hormone secretagogue receptor type 1 0.0153 0.207 0.207
Echinococcus multilocularis somatostatin receptor 0.0153 0.207 0.207
Trypanosoma brucei glycerol uptake protein, putative 0.0114 0.1473 1
Schistosoma mansoni biogenic amine (dopamine) receptor 0.0153 0.207 0.207
Brugia malayi G protein-coupled receptor 0.0153 0.207 0.207
Brugia malayi hypothetical protein 0.002 0.0047 0.0047
Echinococcus granulosus regulator of G protein signaling 7 0.002 0.0047 0.0047
Onchocerca volvulus Dopamine\/Ecdysteroid receptor homolog 0.0153 0.207 1
Echinococcus multilocularis rhodopsin orphan GPCR 0.0153 0.207 0.207
Brugia malayi regulator of G-protein signaling rgs-7 0.002 0.0047 0.0047
Echinococcus multilocularis regulator of G protein signaling 3 0.002 0.0047 0.0047
Loa Loa (eye worm) hypothetical protein 0.0153 0.207 0.207
Echinococcus granulosus Membrane bound O acyl transferase MBOAT 0.0114 0.1473 0.1473
Trichomonas vaginalis transmembrane protein nessy, putative 0.0114 0.1473 1
Brugia malayi hypothetical protein 0.0153 0.207 0.207
Leishmania major glycerol uptake protein, putative 0.0114 0.1473 1
Loa Loa (eye worm) G protein signaling regulator EGL-10 0.002 0.0047 0.0047
Echinococcus granulosus sex peptide receptor 0.0153 0.207 0.207
Loa Loa (eye worm) hypothetical protein 0.0153 0.207 0.207
Loa Loa (eye worm) hypothetical protein 0.0153 0.207 0.207
Loa Loa (eye worm) hypothetical protein 0.0114 0.1473 0.1473
Brugia malayi neuropeptide F receptor 0.0153 0.207 0.207
Echinococcus granulosus neuropeptide receptor 0.0153 0.207 0.207
Schistosoma mansoni myosin xvIII 0.0153 0.207 0.207
Echinococcus multilocularis peptide (allatostatin:somatostatin) 0.0153 0.207 0.207
Echinococcus granulosus serotonin receptor 0.0153 0.207 0.207
Brugia malayi Hhat protein 0.0114 0.1473 0.1473
Schistosoma mansoni membrane-bound acyltransferase/hhat 0.0114 0.1473 0.1473
Echinococcus multilocularis rhodopsin orphan GPCR 0.0153 0.207 0.207
Loa Loa (eye worm) RGS-3 protein 0.002 0.0047 0.0047
Schistosoma mansoni hypothetical protein 0.0153 0.207 0.207
Trichomonas vaginalis conserved hypothetical protein 0.002 0.0047 0.0039
Mycobacterium ulcerans exodeoxyribonuclease III protein XthA 0.0019 0.0041 0.5
Toxoplasma gondii acyl-CoA:cholesterol acyltransferase alpha ACAT1-alpha 0.0677 1 1
Schistosoma mansoni adenoreceptor 0.0153 0.207 0.207
Schistosoma mansoni z-protein (S1r protein) 0.002 0.0047 0.0047
Echinococcus granulosus orexin receptor type 2 0.0153 0.207 0.207
Onchocerca volvulus Neuropeptide F receptor homolog 0.0153 0.207 1
Echinococcus granulosus g protein coupled receptor 0.0153 0.207 0.207
Toxoplasma gondii hypothetical protein 0.0114 0.1473 0.1438
Schistosoma mansoni diacylglycerol O-acyltransferase 1 0.0677 1 1
Loa Loa (eye worm) hypothetical protein 0.0153 0.207 0.207
Loa Loa (eye worm) hypothetical protein 0.0153 0.207 0.207
Loa Loa (eye worm) hypothetical protein 0.0153 0.207 0.207
Echinococcus granulosus 7tm_1 domain containing protein 0.0153 0.207 0.207
Onchocerca volvulus 0.0153 0.207 1
Schistosoma mansoni amine GPCR 0.0153 0.207 0.207
Trichomonas vaginalis conserved hypothetical protein 0.002 0.0047 0.0039
Brugia malayi MBOAT family protein 0.0114 0.1473 0.1473
Echinococcus granulosus rhodopsin orphan GPCR 0.0153 0.207 0.207
Schistosoma mansoni o-acyltransferase (membrane bound) domain containing protein 0.0114 0.1473 0.1473
Schistosoma mansoni peptide (allatostatin)-like receptor 0.0153 0.207 0.207
Trypanosoma cruzi GUP1, putative 0.0114 0.1473 1
Echinococcus granulosus hypothetical protein 0.0153 0.207 0.207
Loa Loa (eye worm) hypothetical protein 0.0153 0.207 0.207
Echinococcus multilocularis rhodopsin orphan GPCR 0.0153 0.207 0.207
Schistosoma mansoni biogenic amine (octopamine/dopamine) receptor 0.0153 0.207 0.207
Echinococcus granulosus alpha 1A adrenergic receptor 0.0153 0.207 0.207
Echinococcus multilocularis neuropeptide Y receptor 0.0153 0.207 0.207
Loa Loa (eye worm) hypothetical protein 0.002 0.0047 0.0047
Plasmodium vivax diacylglycerol O-acyltransferase, putative 0.0677 1 1
Echinococcus multilocularis fmrfamide receptor 0.0153 0.207 0.207
Echinococcus multilocularis allatostatin A receptor 0.0153 0.207 0.207
Loa Loa (eye worm) G-protein coupled receptor 0.0153 0.207 0.207
Echinococcus multilocularis protein cysteine N palmitoyltransferase 0.0114 0.1473 0.1473
Schistosoma mansoni thyrotropin-releasing hormone receptor 0.0153 0.207 0.207
Loa Loa (eye worm) hypothetical protein 0.0153 0.207 0.207
Brugia malayi putative neuropeptide receptor NPR1 0.0153 0.207 0.207
Onchocerca volvulus 0.0153 0.207 1
Echinococcus granulosus g protein coupled receptor 0.0153 0.207 0.207
Schistosoma mansoni growth hormone secretagogue receptor 0.0153 0.207 0.207
Onchocerca volvulus 0.0153 0.207 1
Schistosoma mansoni opsin-like receptor 0.0153 0.207 0.207
Loa Loa (eye worm) hypothetical protein 0.0153 0.207 0.207
Echinococcus multilocularis thyrotropin releasing hormone receptor 0.0153 0.207 0.207
Schistosoma mansoni amine GPCR 0.0153 0.207 0.207
Trichomonas vaginalis conserved hypothetical protein 0.002 0.0047 0.0039
Loa Loa (eye worm) hypothetical protein 0.0153 0.207 0.207
Echinococcus multilocularis Regulator of G protein signaling 20 0.002 0.0047 0.0047
Schistosoma mansoni hypothetical protein 0.0114 0.1473 0.1473
Schistosoma mansoni biogenic amine (5HT) receptor 0.0153 0.207 0.207
Brugia malayi hypothetical protein 0.0153 0.207 0.207
Echinococcus multilocularis o acyltransferase (membrane bound) domain 0.0114 0.1473 0.1473
Brugia malayi hypothetical protein 0.0153 0.207 0.207
Echinococcus granulosus biogenic amine 5HT receptor 0.0153 0.207 0.207
Schistosoma mansoni regulator of G protein signaling 17 19 20 (rgs17 19 20) 0.002 0.0047 0.0047
Loa Loa (eye worm) hypothetical protein 0.0153 0.207 0.207
Echinococcus multilocularis neuropeptide s receptor 0.0153 0.207 0.207
Echinococcus multilocularis tm gpcr rhodopsin gpcr rhodopsin superfamily 0.0153 0.207 0.207
Loa Loa (eye worm) hypothetical protein 0.0153 0.207 0.207
Entamoeba histolytica hypothetical protein 0.002 0.0047 0.0039
Echinococcus multilocularis beta adrenergic receptor kinase 0.002 0.0047 0.0047
Onchocerca volvulus 0.0153 0.207 1
Brugia malayi MBOAT family protein 0.0114 0.1473 0.1473
Echinococcus granulosus beta-adrenergic receptor kinase 0.002 0.0047 0.0047
Echinococcus granulosus sterol O acyltransferase 1 0.0114 0.1473 0.1473
Brugia malayi G protein-coupled receptor F59B2.13 0.0153 0.207 0.207
Echinococcus granulosus lysophospholipid acyltransferase 7 0.0114 0.1473 0.1473
Plasmodium falciparum diacylglycerol O-acyltransferase 0.0677 1 1
Brugia malayi larval opioid receptor 0.0153 0.207 0.207
Brugia malayi neuropeptide F receptor 0.0153 0.207 0.207
Echinococcus granulosus neuropeptide Y receptor 0.0153 0.207 0.207
Onchocerca volvulus 0.0153 0.207 1
Loa Loa (eye worm) hypothetical protein 0.0153 0.207 0.207
Schistosoma mansoni opsin-like receptor 0.0153 0.207 0.207
Echinococcus granulosus DNA apurinic or apyrimidinic site lyase 0.0019 0.0041 0.0041
Echinococcus granulosus biogenic amine 5HT receptor 0.0153 0.207 0.207
Loa Loa (eye worm) hypothetical protein 0.0114 0.1473 0.1473
Echinococcus granulosus fmrfamide receptor 0.0153 0.207 0.207
Loa Loa (eye worm) melatonin receptor type 1A 0.0153 0.207 0.207
Echinococcus multilocularis dro:myosuppressin receptor 0.0153 0.207 0.207
Schistosoma mansoni o-acyltransferase (membrane bound) domain containing protein 0.0114 0.1473 0.1473
Loa Loa (eye worm) hhat protein 0.0114 0.1473 0.1473
Loa Loa (eye worm) hypothetical protein 0.0153 0.207 0.207
Schistosoma mansoni hypothetical protein 0.0153 0.207 0.207
Loa Loa (eye worm) hypothetical protein 0.0153 0.207 0.207
Loa Loa (eye worm) G-protein-linked acetylcholine receptor protein 2 0.0153 0.207 0.207
Echinococcus granulosus rhodopsin orphan GPCR 0.0153 0.207 0.207
Echinococcus multilocularis neuropeptide Y receptor 0.0153 0.207 0.207
Echinococcus multilocularis g protein linked acetylcholine receptor gar 2a 0.0153 0.207 0.207
Loa Loa (eye worm) neuropeptide F receptor 0.0153 0.207 0.207
Loa Loa (eye worm) gonadotropin-releasing hormone receptor 2 0.0153 0.207 0.207
Echinococcus granulosus regulator of G protein signaling 3 0.002 0.0047 0.0047
Schistosoma mansoni sterol O-acyltransferase 1 0.0114 0.1473 0.1473
Echinococcus granulosus 7TM GPCR rhodopsin 0.0153 0.207 0.207
Brugia malayi hypothetical protein 0.0153 0.207 0.207
Trichomonas vaginalis conserved hypothetical protein 0.0114 0.1473 1
Loa Loa (eye worm) hypothetical protein 0.0153 0.207 0.207
Loa Loa (eye worm) exodeoxyribonuclease III family protein 0.0019 0.0041 0.0041
Echinococcus granulosus G protein coupled receptor 139 0.0153 0.207 0.207
Schistosoma mansoni neuropeptide receptor 0.0153 0.207 0.207
Echinococcus multilocularis neuropeptides capa receptor 0.0153 0.207 0.207
Echinococcus granulosus regulator of G protein signaling 3 0.002 0.0047 0.0047
Loa Loa (eye worm) hypothetical protein 0.002 0.0047 0.0047
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0153 0.207 0.207
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0153 0.207 0.207
Trichomonas vaginalis conserved hypothetical protein 0.002 0.0047 0.0039
Onchocerca volvulus 0.0153 0.207 1
Onchocerca volvulus 0.0153 0.207 1
Echinococcus multilocularis neuropeptides capa receptor 0.0153 0.207 0.207
Loa Loa (eye worm) hypothetical protein 0.0153 0.207 0.207
Leishmania major hypothetical protein, conserved 0.0114 0.1473 1
Loa Loa (eye worm) hypothetical protein 0.0563 0.8277 0.8277
Loa Loa (eye worm) AGC/GRK/BARK protein kinase 0.002 0.0047 0.0047
Echinococcus multilocularis axis inhibition protein axin 0.002 0.0047 0.0047
Brugia malayi G-protein-linked acetylcholine receptor protein 2, putative 0.0153 0.207 0.207
Trichomonas vaginalis conserved hypothetical protein 0.0114 0.1473 1
Entamoeba histolytica membrane-bound O-acyltransferase (MBOAT ) family protein 0.0114 0.1473 1
Schistosoma mansoni regulator of G protein signaling 0.002 0.0047 0.0047
Loa Loa (eye worm) hypothetical protein 0.0153 0.207 0.207
Brugia malayi Serotonin receptor 0.0153 0.207 0.207
Schistosoma mansoni amine GPCR 0.0153 0.207 0.207
Echinococcus granulosus rhodopsin orphan GPCR 0.0153 0.207 0.207
Echinococcus granulosus g protein linked acetylcholine receptor gar 2a 0.0153 0.207 0.207
Schistosoma mansoni serine/threonine protein kinase 0.002 0.0047 0.0047
Schistosoma mansoni biogenic amine (5HT) receptor 0.0153 0.207 0.207
Echinococcus multilocularis A kinase anchor protein 10, mitochondrial 0.002 0.0047 0.0047
Loa Loa (eye worm) hypothetical protein 0.0153 0.207 0.207
Loa Loa (eye worm) hypothetical protein 0.002 0.0047 0.0047
Brugia malayi Serotonin receptor 0.0153 0.207 0.207
Entamoeba histolytica hypothetical protein 0.0114 0.1473 1
Brugia malayi G-protein coupled receptor 0.0153 0.207 0.207
Echinococcus multilocularis G protein coupled receptor 139 0.0153 0.207 0.207
Trypanosoma cruzi glycerol uptake protein, putative 0.0114 0.1473 1
Trichomonas vaginalis porcupine, putative 0.0114 0.1473 1
Echinococcus multilocularis regulator of G protein signaling 0.002 0.0047 0.0047
Echinococcus granulosus axis inhibition protein axin 0.002 0.0047 0.0047
Brugia malayi MBOAT family protein 0.0114 0.1473 0.1473
Brugia malayi gonadotropin-releasing hormone receptor 2 0.0153 0.207 0.207
Brugia malayi putative neuropeptide receptor 0.0153 0.207 0.207
Echinococcus granulosus regulator of G protein signaling 7 0.002 0.0047 0.0047
Echinococcus multilocularis neuropeptide receptor A26 0.0153 0.207 0.207
Schistosoma mansoni neuropeptide receptor 0.0153 0.207 0.207
Loa Loa (eye worm) diacylglycerol acyltransferase 0.0677 1 1
Schistosoma mansoni neuropeptide receptor 0.0153 0.207 0.207
Trypanosoma cruzi GUP1, putative 0.0114 0.1473 1
Echinococcus granulosus o acyltransferase membrane bound domain 0.0114 0.1473 0.1473
Echinococcus multilocularis serotonin receptor 0.0153 0.207 0.207
Giardia lamblia Endonuclease/Exonuclease/phosphatase 0.0019 0.0041 0.5
Brugia malayi PXA domain containing protein 0.002 0.0047 0.0047
Loa Loa (eye worm) hypothetical protein 0.002 0.0047 0.0047
Echinococcus granulosus g protein coupled receptor 0.0153 0.207 0.207
Treponema pallidum alginate O-acetylation protein (algI) 0.0114 0.1473 1
Schistosoma mansoni peptide (FMRFamide/somatostatin)-like receptor 0.0153 0.207 0.207
Schistosoma mansoni alpha-1 adrenergic receptor 0.0153 0.207 0.207
Echinococcus granulosus thyrotropin releasing hormone receptor 0.0153 0.207 0.207
Schistosoma mansoni biogenic amine receptor 0.0153 0.207 0.207
Mycobacterium tuberculosis Probable exodeoxyribonuclease III protein XthA (exonuclease III) (EXO III) (AP endonuclease VI) 0.0019 0.0041 0.5
Loa Loa (eye worm) neuropeptide F receptor 0.0153 0.207 0.207
Brugia malayi regulator of G-protein signaling egl-10 0.002 0.0047 0.0047
Trypanosoma cruzi glycerol uptake protein, putative 0.0114 0.1473 1
Toxoplasma gondii acyl-CoA:diacylglycerol acyltransferase 1-related enzyme 0.0677 1 1
Echinococcus multilocularis o acyltransferase (membrane bound) domain 0.0114 0.1473 0.1473
Echinococcus multilocularis g protein coupled receptor 0.0153 0.207 0.207
Echinococcus granulosus somatostatin receptor 0.0153 0.207 0.207
Schistosoma mansoni peptide (FMRFamide/neurokinin-3)-like receptor 0.0153 0.207 0.207
Echinococcus multilocularis g protein linked acetylcholine receptor gar 2a 0.0153 0.207 0.207
Echinococcus granulosus tachykinin peptides receptor 99D 0.0153 0.207 0.207
Schistosoma mansoni biogenic amine (dopamine) receptor 0.0153 0.207 0.207
Schistosoma mansoni axis inhibition protein axin 0.002 0.0047 0.0047
Loa Loa (eye worm) MBOAT family protein 0.0114 0.1473 0.1473
Echinococcus granulosus protein cysteine N palmitoyltransferase 0.0114 0.1473 0.1473
Echinococcus multilocularis sterol O acyltransferase 1 0.0114 0.1473 0.1473
Brugia malayi Tachykinin-like peptides receptor 99D 0.0153 0.207 0.207
Brugia malayi Dopamine receptor protein 1, putative (partial) 0.0153 0.207 0.207
Echinococcus granulosus membrane bound acyltransferase:hhat 0.0114 0.1473 0.1473
Echinococcus multilocularis rhodopsin orphan GPCR 0.0153 0.207 0.207
Loa Loa (eye worm) MBOAT family protein 0.0114 0.1473 0.1473
Loa Loa (eye worm) hypothetical protein 0.0153 0.207 0.207
Echinococcus granulosus o acyltransferase membrane bound domain 0.0114 0.1473 0.1473
Echinococcus granulosus pyroglutamylated rfamide peptide receptor 0.0153 0.207 0.207
Schistosoma mansoni histamine h1 receptor 0.0153 0.207 0.207
Loa Loa (eye worm) hypothetical protein 0.0153 0.207 0.207
Loa Loa (eye worm) hypothetical protein 0.0153 0.207 0.207
Echinococcus multilocularis pyroglutamylated rfamide peptide receptor 0.0153 0.207 0.207
Echinococcus granulosus g-protein coupled receptor 0.0153 0.207 0.207
Echinococcus multilocularis 7TM GPCR, rhodopsin 0.0153 0.207 0.207
Leishmania major glycerol uptake protein, putative 0.0114 0.1473 1
Brugia malayi RE15519p 0.0153 0.207 0.207
Onchocerca volvulus 0.0153 0.207 1
Echinococcus granulosus neuropeptide FF receptor 2 0.0153 0.207 0.207
Schistosoma mansoni serine/threonine protein kinase 0.002 0.0047 0.0047
Leishmania major glycerol uptake protein, putative 0.0114 0.1473 1
Loa Loa (eye worm) hypothetical protein 0.0153 0.207 0.207
Trichomonas vaginalis conserved hypothetical protein 0.0114 0.1473 1
Schistosoma mansoni o-acyltransferase (membrane bound) domain containing protein 0.0114 0.1473 0.1473
Brugia malayi hypothetical protein 0.0153 0.207 0.207
Schistosoma mansoni regulator of G protein signaling 0.002 0.0047 0.0047
Loa Loa (eye worm) hypothetical protein 0.002 0.0047 0.0047
Echinococcus multilocularis membrane bound acyltransferase:hhat 0.0114 0.1473 0.1473
Loa Loa (eye worm) hypothetical protein 0.0153 0.207 0.207
Brugia malayi PXA domain containing protein 0.002 0.0047 0.0047
Echinococcus granulosus o acyltransferase membrane bound domain 0.0114 0.1473 0.1473
Brugia malayi Regulator of G protein signaling domain containing protein 0.002 0.0047 0.0047
Echinococcus granulosus rhodopsin orphan GPCR 0.0153 0.207 0.207
Trypanosoma cruzi glycerol uptake protein, putative 0.0114 0.1473 1
Leishmania major glycerol uptake protein, putative 0.0114 0.1473 1
Echinococcus multilocularis neuropeptide receptor 0.0153 0.207 0.207
Onchocerca volvulus 0.0153 0.207 1
Entamoeba histolytica membrane-bound O-acyltransferase (MBOAT ) family protein 0.0114 0.1473 1
Schistosoma mansoni neuropeptide f receptor 76f 0.0153 0.207 0.207
Loa Loa (eye worm) follicle stimulating hormone receptor 0.0153 0.207 0.207
Echinococcus granulosus diacylglycerol O acyltransferase 1 0.0677 1 1
Echinococcus multilocularis DNA (apurinic or apyrimidinic site) lyase 0.0019 0.0041 0.0041
Loa Loa (eye worm) hypothetical protein 0.0153 0.207 0.207
Echinococcus granulosus tm gpcr rhodopsin 0.0153 0.207 0.207
Loa Loa (eye worm) hypothetical protein 0.0153 0.207 0.207
Schistosoma mansoni ap endonuclease 0.0019 0.0041 0.0041
Echinococcus multilocularis biogenic amine (5HT) receptor 0.0153 0.207 0.207
Echinococcus multilocularis serotonin receptor 0.0153 0.207 0.207
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0153 0.207 0.207
Schistosoma mansoni regulator of G protein signaling 0.002 0.0047 0.0047
Brugia malayi AKH receptor 0.0153 0.207 0.207
Echinococcus granulosus Regulator of G protein signaling 20 0.002 0.0047 0.0047
Trichomonas vaginalis regulator of G protein signaling 5, rgs5, putative 0.002 0.0047 0.0039
Brugia malayi sulfakinin receptor protein 0.0153 0.207 0.207
Echinococcus multilocularis rhodopsin orphan GPCR 0.0153 0.207 0.207
Schistosoma mansoni regulator of G protein signaling 17 19 20 (rgs17 19 20) 0.002 0.0047 0.0047
Echinococcus multilocularis orexin receptor type 2 0.0153 0.207 0.207
Loa Loa (eye worm) hypothetical protein 0.0153 0.207 0.207
Wolbachia endosymbiont of Brugia malayi exonuclease III 0.0019 0.0041 0.5
Entamoeba histolytica membrane-bound O-acyltransferase (MBOAT ) family protein 0.0114 0.1473 1
Loa Loa (eye worm) hypothetical protein 0.0153 0.207 0.207
Loa Loa (eye worm) hypothetical protein 0.0153 0.207 0.207
Loa Loa (eye worm) hypothetical protein 0.0153 0.207 0.207
Echinococcus multilocularis tm gpcr rhodopsin gpcr rhodopsin superfamily 0.0153 0.207 0.207
Echinococcus granulosus tm gpcr rhodopsin 0.0153 0.207 0.207
Echinococcus multilocularis neuropeptide FF receptor 2 0.0153 0.207 0.207
Loa Loa (eye worm) G-protein coupled receptor 0.0153 0.207 0.207
Loa Loa (eye worm) PXA domain-containing protein 0.002 0.0047 0.0047
Loa Loa (eye worm) hypothetical protein 0.0153 0.207 0.207
Loa Loa (eye worm) hypothetical protein 0.0153 0.207 0.207
Entamoeba histolytica hypothetical protein, conserved 0.0114 0.1473 1
Echinococcus granulosus rhodopsin orphan GPCR 0.0153 0.207 0.207
Brugia malayi Serotonin/octopamine receptor family protein 7 0.0153 0.207 0.207
Schistosoma mansoni neuropeptide F-like receptor 0.0153 0.207 0.207
Onchocerca volvulus 0.0153 0.207 1
Schistosoma mansoni hypothetical protein 0.0153 0.207 0.207
Echinococcus multilocularis growth hormone secretagogue receptor type 1 0.0153 0.207 0.207
Brugia malayi hypothetical protein 0.0153 0.207 0.207
Schistosoma mansoni biogenic amine receptor 0.0153 0.207 0.207
Schistosoma mansoni muscarinic acetylcholine (GAR) receptor 0.0153 0.207 0.207
Loa Loa (eye worm) hypothetical protein 0.0153 0.207 0.207
Schistosoma mansoni axis inhibition protein axin 0.002 0.0047 0.0047
Echinococcus multilocularis sex peptide receptor 0.0153 0.207 0.207
Echinococcus multilocularis regulator of G protein signaling 7 0.002 0.0047 0.0047
Echinococcus multilocularis g protein coupled receptor 0.0153 0.207 0.207
Echinococcus multilocularis g-protein coupled receptor 0.0153 0.207 0.207
Brugia malayi MBOAT family protein 0.0114 0.1473 0.1473
Brugia malayi Probable G protein-coupled receptor kinase F19C6.1, putative 0.002 0.0047 0.0047
Onchocerca volvulus 0.0153 0.207 1
Echinococcus multilocularis regulator of G protein signaling 3 0.002 0.0047 0.0047
Echinococcus multilocularis fmrfamide receptor 0.0153 0.207 0.207
Brugia malayi Melatonin receptor type 1A 0.0153 0.207 0.207
Schistosoma mansoni ancient conserved domain protein 2 (cyclin m2) 0.0153 0.207 0.207
Loa Loa (eye worm) hypothetical protein 0.0153 0.207 0.207
Brugia malayi hypothetical protein 0.0153 0.207 0.207
Loa Loa (eye worm) hypothetical protein 0.0153 0.207 0.207
Brugia malayi Dopamine receptor protein 1 0.0153 0.207 0.207
Echinococcus multilocularis g protein coupled receptor 0.0153 0.207 0.207
Onchocerca volvulus 0.0153 0.207 1
Echinococcus granulosus allatostatin A receptor 0.0153 0.207 0.207
Brugia malayi exodeoxyribonuclease III family protein 0.0019 0.0041 0.0041
Brugia malayi Dopamine receptor 0.0153 0.207 0.207
Echinococcus granulosus tm gpcr rhodopsin 0.0153 0.207 0.207
Echinococcus granulosus neuropeptide receptor A26 0.0153 0.207 0.207
Loa Loa (eye worm) hypothetical protein 0.0153 0.207 0.207
Schistosoma mansoni leukocyte receptor cluster (lrc) member 4 protein 0.0114 0.1473 0.1473
Echinococcus granulosus g protein linked acetylcholine receptor gar 2a 0.0153 0.207 0.207
Brugia malayi hypothetical protein 0.0153 0.207 0.207
Echinococcus multilocularis tm gpcr rhodopsin gpcr rhodopsin superfamily 0.0153 0.207 0.207
Onchocerca volvulus 0.0153 0.207 1
Brugia malayi hypothetical protein 0.0153 0.207 0.207
Loa Loa (eye worm) hhat protein 0.0114 0.1473 0.1473
Echinococcus multilocularis regulator of G protein signaling 7 0.002 0.0047 0.0047
Brugia malayi MBOAT family protein 0.0114 0.1473 0.1473
Trichomonas vaginalis conserved hypothetical protein 0.002 0.0047 0.0039
Echinococcus granulosus G protein coupled 5 hydroxytryptamine receptor 0.0153 0.207 0.207
Schistosoma mansoni biogenic amine (dopamine) receptor 0.0153 0.207 0.207
Leishmania major glycerol uptake protein, putative 0.0114 0.1473 1
Echinococcus multilocularis rhodopsin orphan GPCR 0.0153 0.207 0.207
Schistosoma mansoni serine/threonine protein kinase 0.002 0.0047 0.0047
Echinococcus multilocularis lysophospholipid acyltransferase 7 0.0114 0.1473 0.1473
Entamoeba histolytica hypothetical protein 0.002 0.0047 0.0039
Echinococcus multilocularis diacylglycerol O acyltransferase 1 0.0677 1 1
Entamoeba histolytica hypothetical protein 0.002 0.0047 0.0039
Echinococcus granulosus rhodopsin orphan GPCR 0.0153 0.207 0.207
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0153 0.207 0.207
Echinococcus granulosus dro:myosuppressin receptor 0.0153 0.207 0.207
Schistosoma mansoni neuropeptide F-like receptor 0.0153 0.207 0.207
Echinococcus granulosus rhodopsin orphan GPCR 0.0153 0.207 0.207
Loa Loa (eye worm) MBOAT family protein 0.0114 0.1473 0.1473

Activities

Activity type Activity value Assay description Source Reference
EC50 (functional) = 40 nM Agonist effect on transcriptional activation in MCF-7 cells expressing estrogen receptor alpha ChEMBL. 10673099
IC50 (binding) = 32 nM Displacement of [3H]-17-beta-estradiol from human Estrogen receptor alpha ChEMBL. 10673099
IC50 (binding) = 32 nM Displacement of [3H]-17-beta-estradiol from human Estrogen receptor beta ChEMBL. 10673099
IC50 (functional) = 316 nM Antagonist effect on transcriptional activation in MCF-7 cells expressing estrogen receptor alpha ChEMBL. 10673099

Phenotypes

Whole-cell/tissue/organism interactions

We have no records of whole-cell/tissue assays done with this compound What does this mean?

Many chemical entities in TDR Targets come from high-throughput screenings with whole cells or tissue samples, and not all assayed compounds have been tested against a single a single target protein, probably because they get ruled out during screening process. Even if these compounds may have not been of interest in the original screening, they may come as interesting leads for other screening assays. Furthermore, we may be able to propose drug-target associations using chemical similarities and network patterns.

Annotated phenotypes:

We have no manually annotated phenotypes for this drug. What does this mean? / Care to help?
In TDR Targets, information about phenotypes that are caused by drugs, or by genetic manipulation of cells (e.g. gene knockouts or knockdowns) is manually curated from the literature. These descriptions help to describe the potential of the target for drug development. If no information is available for this gene or if the information is incomplete, this may mean that i) the papers containing this information either appeared after the curation effort for this organism was carried out or they were inadvertently missed by curators; or that ii) the curation effort for this organism has not yet started.
 
In any case, if you have information about papers containing relevant validation data for this target, please log in using your TDR Targets username and password and send them to us using the corresponding form in this page (only visible to registered users) or contact us.

External resources for this compound

Bibliographic References

1 literature reference was collected for this gene.

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