Detailed information for compound 159141

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 536.747 | Formula: C36H44N2O2
  • H donors: 2 H acceptors: 2 LogP: 7.86 Rotable bonds: 9
    Rule of 5 violations (Lipinski): 2
  • SMILES: Oc1cccc(c1)C12C[C@H](CC(C1)N(CC2C)CCCc1ccccc1)NC(=O)C1(CCCC1)c1ccccc1
  • InChi: 1S/C36H44N2O2/c1-27-26-38(21-11-14-28-12-4-2-5-13-28)32-23-31(24-36(27,25-32)30-17-10-18-33(39)22-30)37-34(40)35(19-8-9-20-35)29-15-6-3-7-16-29/h2-7,10,12-13,15-18,22,27,31-32,39H,8-9,11,14,19-21,23-26H2,1H3,(H,37,40)/t27?,31-,32?,36?/m0/s1
  • InChiKey: NZPBORMKRQQWNV-UOTZXRTJSA-N  

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 opioid receptor, delta 1 Starlite/ChEMBL References

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Echinococcus granulosus tm gpcr rhodopsin Get druggable targets OG5_139759 All targets in OG5_139759
Echinococcus multilocularis tm gpcr rhodopsin gpcr rhodopsin superfamily Get druggable targets OG5_139759 All targets in OG5_139759

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
Toxoplasma gondii hypothetical protein 0.0808 0.0822 0.1111
Schistosoma mansoni sodium/chloride dependent neurotransmitter transporter 0.0808 0.0822 0.0822
Brugia malayi Sodium:neurotransmitter symporter family protein 1, putative 0.0808 0.0822 0.0822
Trypanosoma brucei lanosterol synthase 0.0378 0.0374 0.1451
Toxoplasma gondii hypothetical protein 0.7115 0.7402 1
Trichomonas vaginalis geranylgeranyl transferase type beta subunit, putative 0.1394 0.1434 0.142
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0059 0.0041 0.0041
Onchocerca volvulus 0.0808 0.0822 0.1593
Mycobacterium ulcerans cytochrome P450 125A7 Cyp125A7 0.002 0 0.5
Echinococcus granulosus tachykinin peptides receptor 99D 0.0059 0.0041 0.0041
Echinococcus multilocularis neuropeptide receptor 0.0059 0.0041 0.0041
Schistosoma mansoni neuropeptide receptor 0.0059 0.0041 0.0041
Brugia malayi Calcitonin receptor-like protein seb-1 0.0108 0.0093 0.0093
Echinococcus multilocularis neuropeptide Y receptor 0.0059 0.0041 0.0041
Echinococcus granulosus tm gpcr rhodopsin 0.0684 0.0693 0.0693
Schistosoma mansoni amine GPCR 0.0059 0.0041 0.0041
Brugia malayi Serotonin receptor 0.0059 0.0041 0.0041
Loa Loa (eye worm) hypothetical protein 0.0059 0.0041 0.0041
Loa Loa (eye worm) hypothetical protein 0.0059 0.0041 0.0041
Loa Loa (eye worm) hypothetical protein 0.0059 0.0041 0.0041
Brugia malayi AKH receptor 0.0059 0.0041 0.0041
Loa Loa (eye worm) hypothetical protein 0.0059 0.0041 0.0041
Echinococcus multilocularis 7TM GPCR, rhodopsin 0.0059 0.0041 0.0041
Brugia malayi RNA recognition motif domain containing protein 0.0064 0.0046 0.0046
Mycobacterium ulcerans cytochrome P450 108B4 Cyp108B4 0.002 0 0.5
Mycobacterium ulcerans cytochrome P450 187A5 Cyp187A5 0.002 0 0.5
Leishmania major farnesyltransferase beta subunit 0.1394 0.1434 0.5563
Schistosoma mansoni amine GPCR 0.0059 0.0041 0.0041
Echinococcus granulosus cadherin EGF LAG seven pass G type receptor 0.0034 0.0015 0.0015
Echinococcus multilocularis serotonin receptor 0.0789 0.0803 0.0803
Echinococcus multilocularis sodium dependent neurotransmitter transporter 0.0808 0.0822 0.0822
Trypanosoma brucei Protein prenyltransferase alpha subunit repeat, putative 0.249 0.2577 1
Loa Loa (eye worm) hypothetical protein 0.0059 0.0041 0.0041
Mycobacterium ulcerans cytochrome P450 142A3 Cyp142A3 0.002 0 0.5
Loa Loa (eye worm) hypothetical protein 0.0141 0.0127 0.0127
Echinococcus multilocularis cadherin EGF LAG seven pass G type receptor 0.0034 0.0015 0.0015
Brugia malayi latrophilin 2 splice variant baaae 0.0074 0.0057 0.0057
Mycobacterium ulcerans cytochrome P450 188A3 Cyp188A3 0.002 0 0.5
Echinococcus granulosus sex peptide receptor 0.0059 0.0041 0.0041
Brugia malayi Latrophilin receptor protein 2 0.0034 0.0015 0.0015
Trypanosoma brucei protein farnesyltransferase beta subunit 0.1394 0.1434 0.5563
Echinococcus multilocularis neuropeptide FF receptor 2 0.0059 0.0041 0.0041
Brugia malayi hypothetical protein 0.0024 0.0005 0.0005
Loa Loa (eye worm) hypothetical protein 0.0808 0.0822 0.0822
Mycobacterium ulcerans cytochrome P450 187A4 Cyp187A4 0.002 0 0.5
Echinococcus multilocularis g protein linked acetylcholine receptor gar 2a 0.0059 0.0041 0.0041
Mycobacterium ulcerans cytochrome P450 143A4 Cyp143A4 0.002 0 0.5
Plasmodium vivax farnesyltransferase beta subunit, putative 0.1394 0.1434 0.143
Schistosoma mansoni hypothetical protein 0.0074 0.0057 0.0057
Echinococcus multilocularis g protein linked acetylcholine receptor gar 2a 0.0059 0.0041 0.0041
Schistosoma mansoni opsin-like receptor 0.0059 0.0041 0.0041
Echinococcus granulosus g-protein coupled receptor 0.0059 0.0041 0.0041
Echinococcus granulosus neuropeptide receptor A26 0.0059 0.0041 0.0041
Schistosoma mansoni amine GPCR 0.0059 0.0041 0.0041
Loa Loa (eye worm) prenyltransferase and squalene oxidase repeat family protein 0.0378 0.0374 0.0374
Loa Loa (eye worm) neuropeptide F receptor 0.0059 0.0041 0.0041
Mycobacterium ulcerans cytochrome P450 105Q4 Cyp105Q4 0.002 0 0.5
Echinococcus multilocularis rhodopsin orphan GPCR 0.0059 0.0041 0.0041
Loa Loa (eye worm) gonadotropin-releasing hormone receptor 2 0.0059 0.0041 0.0041
Trypanosoma cruzi PAB1-binding protein , putative 0.0024 0.0005 0.0019
Loa Loa (eye worm) latrophilin receptor protein 2 0.0034 0.0015 0.0015
Toxoplasma gondii Rab geranylgeranyl transferase type II beta subunit, putative 0.0378 0.0374 0.0505
Trichomonas vaginalis protein farnesyltransferase alpha subunit/RAB geranylgeranyl transferase alpha subunit, putative 0.9605 1 1
Brugia malayi RNA binding protein 0.0064 0.0046 0.0046
Trypanosoma brucei protein farnesyltransferase alpha subunit, putative 0.249 0.2577 1
Echinococcus granulosus 7tm_1 domain containing protein 0.0059 0.0041 0.0041
Loa Loa (eye worm) hypothetical protein 0.0059 0.0041 0.0041
Loa Loa (eye worm) follicle stimulating hormone receptor 0.0059 0.0041 0.0041
Loa Loa (eye worm) hypothetical protein 0.0059 0.0041 0.0041
Echinococcus granulosus neuropeptides capa receptor 0.0059 0.0041 0.0041
Echinococcus multilocularis uncharacterized sodium dependent transporter 0.0808 0.0822 0.0822
Trichomonas vaginalis protein farnesyltransferase alpha subunit/RAB geranylgeranyl transferase alpha subunit, putative 0.7115 0.7402 0.7398
Onchocerca volvulus 0.249 0.2577 0.5174
Loa Loa (eye worm) hypothetical protein 0.0059 0.0041 0.0041
Schistosoma mansoni alpha-1 adrenergic receptor 0.0059 0.0041 0.0041
Echinococcus multilocularis rhodopsin orphan GPCR 0.0059 0.0041 0.0041
Brugia malayi Protein prenyltransferase alpha subunit repeat containing protein 0.249 0.2577 0.2577
Loa Loa (eye worm) hypothetical protein 0.0059 0.0041 0.0041
Trypanosoma cruzi protein farnesyltransferase alpha subunit, putative 0.249 0.2577 1
Trypanosoma cruzi protein farnesyltransferase, putative 0.1394 0.1434 0.5563
Schistosoma mansoni ancient conserved domain protein 2 (cyclin m2) 0.0059 0.0041 0.0041
Schistosoma mansoni sodium-dependent neurotransmitter transporter 0.0808 0.0822 0.0822
Loa Loa (eye worm) Sodium:neurotransmitter symporter family protein 0.0808 0.0822 0.0822
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.0034 0.0015 0.0015
Echinococcus granulosus neuropeptide Y receptor 0.0059 0.0041 0.0041
Loa Loa (eye worm) hypothetical protein 0.0108 0.0093 0.0093
Loa Loa (eye worm) hypothetical protein 0.0059 0.0041 0.0041
Mycobacterium ulcerans cytochrome P450 51B1 Cyp51B1 0.002 0 0.5
Loa Loa (eye worm) hypothetical protein 0.0059 0.0041 0.0041
Echinococcus granulosus GPCR family 2 0.0034 0.0015 0.0015
Trichomonas vaginalis geranylgeranyl transferase type II beta subunit, putative 0.1394 0.1434 0.142
Echinococcus multilocularis sex peptide receptor 0.0059 0.0041 0.0041
Loa Loa (eye worm) hypothetical protein 0.0059 0.0041 0.0041
Giardia lamblia Prenyltransferase 0.1394 0.1434 0.1101
Loa Loa (eye worm) hypothetical protein 0.0059 0.0041 0.0041
Schistosoma mansoni hypothetical protein 0.0059 0.0041 0.0041
Schistosoma mansoni tar DNA-binding protein 0.0064 0.0046 0.0046
Schistosoma mansoni biogenic amine (dopamine) receptor 0.0059 0.0041 0.0041
Loa Loa (eye worm) hypothetical protein 0.0059 0.0041 0.0041
Toxoplasma gondii LsmAD domain-containing protein 0.0024 0.0005 0.0007
Brugia malayi G-protein-linked acetylcholine receptor protein 2, putative 0.0059 0.0041 0.0041
Echinococcus granulosus neuropeptides capa receptor 0.0059 0.0041 0.0041
Echinococcus multilocularis neuropeptide receptor 0.0059 0.0041 0.0041
Leishmania major geranylgeranyltransferase, putative 0.0378 0.0374 0.1451
Schistosoma mansoni neuropeptide receptor 0.0059 0.0041 0.0041
Echinococcus granulosus biogenic amine 5HT receptor 0.0059 0.0041 0.0041
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0059 0.0041 0.0041
Loa Loa (eye worm) prenyltransferase alpha subunit repeat containing protein 0.9605 1 1
Giardia lamblia Rab geranylgeranyltransferase 0.9605 1 1
Brugia malayi G protein-coupled receptor F59B2.13 0.0059 0.0041 0.0041
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0059 0.0041 0.0041
Brugia malayi larval opioid receptor 0.0059 0.0041 0.0041
Schistosoma mansoni peptide (FMRFamide/neurokinin-3)-like receptor 0.0059 0.0041 0.0041
Echinococcus multilocularis protein farnesyltransferase alpha subunit 0.9605 1 1
Echinococcus multilocularis dro:myosuppressin receptor 0.0059 0.0041 0.0041
Loa Loa (eye worm) hypothetical protein 0.0808 0.0822 0.0822
Schistosoma mansoni sodium/chloride dependent transporter 0.4758 0.4944 0.4944
Schistosoma mansoni thyrotropin-releasing hormone receptor 0.0059 0.0041 0.0041
Plasmodium falciparum geranylgeranyl transferase type-2 subunit alpha, putative 0.249 0.2577 0.2574
Loa Loa (eye worm) hypothetical protein 0.0024 0.0005 0.0005
Toxoplasma gondii hypothetical protein 0.0808 0.0822 0.1111
Loa Loa (eye worm) hypothetical protein 0.0059 0.0041 0.0041
Schistosoma mansoni neuropeptide f receptor 76f 0.0059 0.0041 0.0041
Brugia malayi Tachykinin-like peptides receptor 99D 0.0059 0.0041 0.0041
Loa Loa (eye worm) neuropeptide F receptor 0.0059 0.0041 0.0041
Onchocerca volvulus Huntingtin homolog 0.0141 0.0127 0.0174
Echinococcus multilocularis allatostatin A receptor 0.0059 0.0041 0.0041
Echinococcus granulosus uncharacterized sodium dependent transporter 0.0808 0.0822 0.0822
Echinococcus granulosus allatostatin A receptor 0.0059 0.0041 0.0041
Echinococcus multilocularis g protein coupled receptor 0.0059 0.0041 0.0041
Loa Loa (eye worm) hypothetical protein 0.0789 0.0803 0.0803
Echinococcus granulosus rhodopsin orphan GPCR 0.0059 0.0041 0.0041
Loa Loa (eye worm) hypothetical protein 0.0032 0.0013 0.0013
Loa Loa (eye worm) hypothetical protein 0.0378 0.0374 0.0374
Schistosoma mansoni norepinephrine/norepinephrine transporter 0.0808 0.0822 0.0822
Trypanosoma cruzi lanosterol synthase, putative 0.0378 0.0374 0.1451
Echinococcus granulosus protein farnesyltransferase subunit beta 0.1394 0.1434 0.1434
Loa Loa (eye worm) solute carrier family 6 member 4 0.4758 0.4944 0.4944
Loa Loa (eye worm) hypothetical protein 0.0074 0.0057 0.0057
Leishmania major hypothetical protein, conserved 0.0024 0.0005 0.0019
Schistosoma mansoni protein farnesyltransferase alpha subunit 0.9605 1 1
Brugia malayi ORL1-like opioid receptor 0.0059 0.0041 0.0041
Entamoeba histolytica protein farnesyltransferase alpha subunit, putative 0.9605 1 1
Brugia malayi hypothetical protein 0.0059 0.0041 0.0041
Loa Loa (eye worm) hypothetical protein 0.0059 0.0041 0.0041
Echinococcus granulosus alpha 1A adrenergic receptor 0.0059 0.0041 0.0041
Schistosoma mansoni hypothetical protein 0.0059 0.0041 0.0041
Schistosoma mansoni tar DNA-binding protein 0.0064 0.0046 0.0046
Schistosoma mansoni hypothetical protein 0.0034 0.0015 0.0015
Echinococcus granulosus tar DNA binding protein 0.0064 0.0046 0.0046
Schistosoma mansoni growth hormone secretagogue receptor 0.0059 0.0041 0.0041
Loa Loa (eye worm) hypothetical protein 0.0059 0.0041 0.0041
Loa Loa (eye worm) 5-hydroxytryptamine 2C receptor 0.0059 0.0041 0.0041
Echinococcus granulosus potassium voltage gated channel subfamily H 0.0037 0.0018 0.0018
Entamoeba histolytica protein farnesyltransferase beta subunit, putative 0.1394 0.1434 0.1101
Trichomonas vaginalis geranylgeranyl transferase type I beta subunit, putative 0.0378 0.0374 0.0359
Mycobacterium ulcerans cytochrome P450 126A3 Cyp126A3 0.002 0 0.5
Trypanosoma brucei Protein prenyltransferase alpha subunit repeat, putative 0.249 0.2577 1
Brugia malayi hypothetical protein 0.0059 0.0041 0.0041
Brugia malayi G protein-coupled receptor 0.0059 0.0041 0.0041
Plasmodium vivax geranylgeranyl transferase type2 beta subunit, putative 0.0378 0.0374 0.0369
Loa Loa (eye worm) hypothetical protein 0.0059 0.0041 0.0041
Toxoplasma gondii Sodium:neurotransmitter symporter family protein 0.0808 0.0822 0.1111
Schistosoma mansoni tar DNA-binding protein 0.0064 0.0046 0.0046
Loa Loa (eye worm) hypothetical protein 0.0059 0.0041 0.0041
Schistosoma mansoni histamine-responsive GPCR (AAF21638) 0.0059 0.0041 0.0041
Echinococcus multilocularis neuropeptides capa receptor 0.0059 0.0041 0.0041
Brugia malayi Dopamine receptor protein 2 0.0059 0.0041 0.0041
Schistosoma mansoni opsin-like receptor 0.0059 0.0041 0.0041
Plasmodium vivax geranylgeranyltransferase, putative 0.0378 0.0374 0.0369
Schistosoma mansoni norepinephrine/norepinephrine transporter 0.4758 0.4944 0.4944
Brugia malayi Serotonin/octopamine receptor family protein 7 0.0059 0.0041 0.0041
Mycobacterium ulcerans cytochrome P450 140A5 Cyp140A5 0.002 0 0.5
Echinococcus multilocularis tachykinin peptides receptor 99D 0.0059 0.0041 0.0041
Schistosoma mansoni hypothetical protein 0.0034 0.0015 0.0015
Echinococcus granulosus dro:myosuppressin receptor 0.0059 0.0041 0.0041
Echinococcus granulosus g protein coupled receptor 0.0059 0.0041 0.0041
Brugia malayi neuropeptide F receptor 0.0059 0.0041 0.0041
Echinococcus multilocularis tm gpcr rhodopsin gpcr rhodopsin superfamily 0.0059 0.0041 0.0041
Echinococcus granulosus tm gpcr rhodopsin 0.0059 0.0041 0.0041
Echinococcus multilocularis sodium and chloride dependent glycine 0.0808 0.0822 0.0822
Brugia malayi Probable protein farnesyltransferase beta subunit, putative 0.0378 0.0374 0.0374
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0059 0.0041 0.0041
Echinococcus multilocularis tar DNA binding protein 0.0064 0.0046 0.0046
Loa Loa (eye worm) hypothetical protein 0.0059 0.0041 0.0041
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0059 0.0041 0.0041
Loa Loa (eye worm) hypothetical protein 0.0059 0.0041 0.0041
Echinococcus granulosus orexin receptor type 2 0.0059 0.0041 0.0041
Echinococcus granulosus 7TM GPCR rhodopsin 0.0059 0.0041 0.0041
Trypanosoma brucei hypothetical protein, conserved 0.249 0.2577 1
Schistosoma mansoni voltage-gated potassium channel 0.0041 0.0022 0.0022
Loa Loa (eye worm) MH2 domain-containing protein 0.0137 0.0123 0.0123
Loa Loa (eye worm) melatonin receptor type 1A 0.0059 0.0041 0.0041
Loa Loa (eye worm) hypothetical protein 0.0059 0.0041 0.0041
Loa Loa (eye worm) unidentified vitellogenin-linked transcript protein 6 0.0059 0.0041 0.0041
Schistosoma mansoni voltage-gated potassium channel 0.0041 0.0022 0.0022
Plasmodium vivax hypothetical protein, conserved 0.0808 0.0822 0.0818
Brugia malayi Sodium:neurotransmitter symporter family protein 0.0808 0.0822 0.0822
Brugia malayi hypothetical protein 0.0059 0.0041 0.0041
Trypanosoma cruzi hypothetical protein, conserved 0.249 0.2577 1
Echinococcus granulosus protein farnesyltransferase alpha subunit 0.9605 1 1
Schistosoma mansoni sodium-dependent amino acid transporter 0.0808 0.0822 0.0822
Brugia malayi hypothetical protein 0.0059 0.0041 0.0041
Loa Loa (eye worm) hypothetical protein 0.0059 0.0041 0.0041
Trypanosoma cruzi protein farnesyltransferase alpha subunit, putative 0.249 0.2577 1
Echinococcus granulosus g protein coupled receptor 0.0059 0.0041 0.0041
Onchocerca volvulus 0.0808 0.0822 0.1593
Brugia malayi follicle stimulating hormone receptor 0.0059 0.0041 0.0041
Echinococcus granulosus rhodopsin orphan GPCR 0.0059 0.0041 0.0041
Echinococcus multilocularis neuropeptide s receptor 0.0059 0.0041 0.0041
Schistosoma mansoni amine GPCR 0.0059 0.0041 0.0041
Loa Loa (eye worm) hypothetical protein 0.0141 0.0127 0.0127
Leishmania major protein farnesyltransferase alpha subunit, putative 0.249 0.2577 1
Plasmodium vivax prenyltransferase alpha subunit, putative 0.9605 1 1
Loa Loa (eye worm) hypothetical protein 0.4758 0.4944 0.4944
Schistosoma mansoni neuropeptide F-like receptor 0.0059 0.0041 0.0041
Schistosoma mansoni hypothetical protein 0.0059 0.0041 0.0041
Mycobacterium leprae Conserved hypothetical protein 0.002 0 0.5
Loa Loa (eye worm) hypothetical protein 0.0059 0.0041 0.0041
Brugia malayi Sodium:neurotransmitter symporter family protein 0.0808 0.0822 0.0822
Loa Loa (eye worm) G-protein coupled receptor 0.0059 0.0041 0.0041
Loa Loa (eye worm) hypothetical protein 0.0059 0.0041 0.0041
Echinococcus multilocularis biogenic amine (5HT) receptor 0.0059 0.0041 0.0041
Echinococcus multilocularis rhodopsin orphan GPCR 0.0059 0.0041 0.0041
Loa Loa (eye worm) norepinephrine transporter 0.4758 0.4944 0.4944
Brugia malayi Sodium:neurotransmitter symporter family protein 0.0808 0.0822 0.0822
Schistosoma mansoni hypothetical protein 0.0059 0.0041 0.0041
Echinococcus multilocularis sodium:chloride dependent neurotransmitter 0.0808 0.0822 0.0822
Schistosoma mansoni adenoreceptor 0.0059 0.0041 0.0041
Schistosoma mansoni muscarinic acetylcholine (GAR) receptor 0.0059 0.0041 0.0041
Brugia malayi Dopamine receptor protein 1 0.0059 0.0041 0.0041
Brugia malayi gonadotropin-releasing hormone receptor 2 0.0059 0.0041 0.0041
Onchocerca volvulus 0.4758 0.4944 1
Schistosoma mansoni hypothetical protein 0.0034 0.0015 0.0015
Loa Loa (eye worm) hypothetical protein 0.0059 0.0041 0.0041
Brugia malayi GnHR receptor homolog 0.0059 0.0041 0.0041
Schistosoma mansoni neuropeptide receptor 0.0059 0.0041 0.0041
Echinococcus multilocularis G protein coupled 5 hydroxytryptamine receptor 0.0059 0.0041 0.0041
Mycobacterium ulcerans cytochrome P450 144A4 Cyp144A4 0.002 0 0.5
Echinococcus multilocularis neuropeptides capa receptor 0.0059 0.0041 0.0041
Schistosoma mansoni tar DNA-binding protein 0.0064 0.0046 0.0046
Brugia malayi Dopamine receptor 0.0059 0.0041 0.0041
Loa Loa (eye worm) hypothetical protein 0.0059 0.0041 0.0041
Echinococcus multilocularis neuropeptide receptor A26 0.0059 0.0041 0.0041
Entamoeba histolytica Rab geranylgeranyltransferase alpha subunit, putative 0.249 0.2577 0.2289
Trichomonas vaginalis geranylgeranyl transferase type I beta subunit, putative 0.1394 0.1434 0.142
Brugia malayi hypothetical protein 0.0808 0.0822 0.0822
Echinococcus multilocularis pyroglutamylated rfamide peptide receptor 0.0059 0.0041 0.0041
Schistosoma mansoni neuropeptide receptor 0.0059 0.0041 0.0041
Echinococcus granulosus sodium and chloride dependent glycine 0.0808 0.0822 0.0822
Echinococcus granulosus tm gpcr rhodopsin 0.0059 0.0041 0.0041
Echinococcus multilocularis potassium voltage gated channel subfamily H 0.0037 0.0018 0.0018
Brugia malayi Dopamine receptor protein 1, putative (partial) 0.0059 0.0041 0.0041
Loa Loa (eye worm) hypothetical protein 0.9605 1 1
Echinococcus multilocularis growth hormone secretagogue receptor type 1 0.0059 0.0041 0.0041
Loa Loa (eye worm) hypothetical protein 0.0059 0.0041 0.0041
Loa Loa (eye worm) G-protein-linked acetylcholine receptor protein 2 0.0059 0.0041 0.0041
Loa Loa (eye worm) hypothetical protein 0.0059 0.0041 0.0041
Schistosoma mansoni biogenic amine (dopamine) receptor 0.0059 0.0041 0.0041
Mycobacterium ulcerans cytochrome P450 123A3 Cyp123A3 0.002 0 0.5
Echinococcus granulosus biogenic amine 5HT receptor 0.0789 0.0803 0.0803
Echinococcus granulosus rhodopsin orphan GPCR 0.0059 0.0041 0.0041
Loa Loa (eye worm) prenyltransferase and squalene oxidase repeat family protein 0.1394 0.1434 0.1434
Schistosoma mansoni histamine h1 receptor 0.0059 0.0041 0.0041
Loa Loa (eye worm) hypothetical protein 0.0059 0.0041 0.0041
Schistosoma mansoni geranylgeranyl transferase type II beta subunit 0.0378 0.0374 0.0374
Loa Loa (eye worm) hypothetical protein 0.0059 0.0041 0.0041
Echinococcus multilocularis thyrotropin releasing hormone receptor 0.0059 0.0041 0.0041
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.0064 0.0046 0.0046
Echinococcus multilocularis tm gpcr rhodopsin gpcr rhodopsin superfamily 0.0059 0.0041 0.0041
Trichomonas vaginalis geranylgeranyl transferase type II beta subunit, putative 0.1394 0.1434 0.142
Echinococcus multilocularis sodium and chloride dependent glycine 0.0808 0.0822 0.0822
Mycobacterium ulcerans cytochrome P450 143A3 Cyp143A3 0.002 0 0.5
Echinococcus multilocularis g protein coupled receptor 0.0059 0.0041 0.0041
Echinococcus multilocularis somatostatin receptor 0.0059 0.0041 0.0041
Echinococcus granulosus rhodopsin orphan GPCR 0.0059 0.0041 0.0041
Treponema pallidum sodium- and chloride- dependent transporter 0.4758 0.4944 0.5
Plasmodium falciparum amino acid transporter, putative 0.0808 0.0822 0.0818
Trypanosoma cruzi hypothetical protein, conserved 0.0378 0.0374 0.1451
Schistosoma mansoni biogenic amine receptor 0.0059 0.0041 0.0041
Loa Loa (eye worm) hypothetical protein 0.0059 0.0041 0.0041
Echinococcus multilocularis geranylgeranyl transferase type I beta subunit 0.0378 0.0374 0.0374
Brugia malayi putative neuropeptide receptor NPR1 0.0059 0.0041 0.0041
Brugia malayi RE15519p 0.0059 0.0041 0.0041
Loa Loa (eye worm) hypothetical protein 0.0808 0.0822 0.0822
Trichomonas vaginalis geranylgeranyl transferase type II beta subunit, putative 0.1394 0.1434 0.142
Trypanosoma cruzi lanosterol synthase, putative 0.0378 0.0374 0.1451
Trypanosoma cruzi hypothetical protein, conserved 0.249 0.2577 1
Trypanosoma cruzi Protein prenyltransferase alpha subunit repeat, putative 0.249 0.2577 1
Trypanosoma cruzi PAB1-binding protein , putative 0.0024 0.0005 0.0019
Echinococcus multilocularis neuropeptide Y receptor 0.0059 0.0041 0.0041
Brugia malayi MH2 domain containing protein 0.0137 0.0123 0.0123
Echinococcus multilocularis tm gpcr rhodopsin gpcr rhodopsin superfamily 0.0684 0.0693 0.0693
Trypanosoma cruzi geranylgeranyl transferase type II beta subunit, putative 0.0378 0.0374 0.1451
Brugia malayi hypothetical protein 0.0059 0.0041 0.0041
Loa Loa (eye worm) hypothetical protein 0.0808 0.0822 0.0822
Plasmodium vivax protein prenyltransferase alpha subunit, putative 0.249 0.2577 0.2574
Schistosoma mansoni peptide (FMRFamide/somatostatin)-like receptor 0.0059 0.0041 0.0041
Echinococcus granulosus hypothetical protein 0.0059 0.0041 0.0041
Schistosoma mansoni protein farnesyltransferase subunit beta 0.1394 0.1434 0.1434
Echinococcus multilocularis fmrfamide receptor 0.0059 0.0041 0.0041
Echinococcus multilocularis G-protein coupled receptor, putative 0.0059 0.0041 0.0041
Loa Loa (eye worm) hypothetical protein 0.0059 0.0041 0.0041
Trichomonas vaginalis protein farnesyltransferase alpha subunit, putative 0.9605 1 1
Brugia malayi hypothetical protein 0.0059 0.0041 0.0041
Loa Loa (eye worm) voltage and ligand gated potassium channel 0.0037 0.0018 0.0018
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0059 0.0041 0.0041
Mycobacterium ulcerans cytochrome P450 150A6 Cyp150A6 0.002 0 0.5
Mycobacterium leprae putative cytochrome p450 0.002 0 0.5
Echinococcus multilocularis peptide (allatostatin:somatostatin) 0.0059 0.0041 0.0041
Loa Loa (eye worm) hypothetical protein 0.0059 0.0041 0.0041
Loa Loa (eye worm) hypothetical protein 0.0059 0.0041 0.0041
Brugia malayi Sodium:neurotransmitter symporter family protein 0.4758 0.4944 0.4944
Brugia malayi Serotonin receptor 0.0059 0.0041 0.0041
Echinococcus multilocularis rhodopsin orphan GPCR 0.0059 0.0041 0.0041
Echinococcus granulosus somatostatin receptor 0.0059 0.0041 0.0041
Echinococcus granulosus G protein coupled receptor 139 0.0059 0.0041 0.0041
Schistosoma mansoni biogenic amine receptor 0.0059 0.0041 0.0041
Schistosoma mansoni rab geranylgeranyl transferase alpha subunit 0.249 0.2577 0.2577
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.0034 0.0015 0.0015
Schistosoma mansoni neuropeptide F-like receptor 0.0059 0.0041 0.0041
Echinococcus multilocularis Rab geranylgeranyltransferase, beta subunit 0.0378 0.0374 0.0374
Loa Loa (eye worm) hypothetical protein 0.0808 0.0822 0.0822
Echinococcus granulosus G protein coupled 5 hydroxytryptamine receptor 0.0059 0.0041 0.0041
Schistosoma mansoni sodium/chloride dependent neurotransmitter transporter 0.0808 0.0822 0.0822
Schistosoma mansoni biogenic amine (5HT) receptor 0.0789 0.0803 0.0803
Trypanosoma brucei PAB1-binding protein , putative 0.0024 0.0005 0.0019
Echinococcus granulosus peptide allatostatin:somatostatin 0.0059 0.0041 0.0041
Plasmodium falciparum protein farnesyltransferase subunit alpha 0.9605 1 1
Echinococcus multilocularis rhodopsin orphan GPCR 0.0059 0.0041 0.0041
Loa Loa (eye worm) hypothetical protein 0.0059 0.0041 0.0041
Echinococcus granulosus serotonin receptor 0.0059 0.0041 0.0041
Echinococcus multilocularis protein farnesyltransferase subunit beta 0.1394 0.1434 0.1434
Loa Loa (eye worm) prenyltransferase alpha subunit repeat containing protein 0.249 0.2577 0.2577
Loa Loa (eye worm) hypothetical protein 0.0789 0.0803 0.0803
Loa Loa (eye worm) hypothetical protein 0.0034 0.0015 0.0015
Brugia malayi Melatonin receptor type 1A 0.0059 0.0041 0.0041
Schistosoma mansoni biogenic amine (dopamine) receptor 0.0059 0.0041 0.0041
Echinococcus multilocularis protein prenyltransferase alpha subunit 0.249 0.2577 0.2577
Loa Loa (eye worm) hypothetical protein 0.0059 0.0041 0.0041
Echinococcus granulosus g protein coupled receptor 0.0059 0.0041 0.0041
Trichomonas vaginalis protein farnesyltransferase alpha subunit, putative 0.249 0.2577 0.2566
Loa Loa (eye worm) Sodium:neurotransmitter symporter family protein 0.0808 0.0822 0.0822
Echinococcus granulosus sodium:chloride dependent neurotransmitter 0.0808 0.0822 0.0822
Brugia malayi hypothetical protein 0.0059 0.0041 0.0041
Schistosoma mansoni sodium/chloride dependent transporter 0.0808 0.0822 0.0822
Mycobacterium tuberculosis Halimadienyl diphosphate synthase 0.0378 0.0374 1
Mycobacterium ulcerans cytochrome P450 185A4 Cyp185A4 0.002 0 0.5
Schistosoma mansoni sodium-dependent neurotransmitter transporter 0.0808 0.0822 0.0822
Echinococcus granulosus neuropeptide s receptor 0.0059 0.0041 0.0041
Echinococcus multilocularis alpha 1A adrenergic receptor 0.0059 0.0041 0.0041
Plasmodium falciparum protein farnesyltransferase subunit beta 0.1394 0.1434 0.143
Echinococcus granulosus neuropeptide receptor 0.0059 0.0041 0.0041
Brugia malayi TAR-binding protein 0.0064 0.0046 0.0046
Brugia malayi sulfakinin receptor protein 0.0059 0.0041 0.0041
Schistosoma mansoni sodium/chloride dependent neurotransmitter transporter 0.0808 0.0822 0.0822
Schistosoma mansoni myosin xvIII 0.0059 0.0041 0.0041
Echinococcus granulosus rhodopsin orphan GPCR 0.0059 0.0041 0.0041
Echinococcus multilocularis orexin receptor type 2 0.0059 0.0041 0.0041
Mycobacterium ulcerans cytochrome P450 189A7 Cyp189A7 0.002 0 0.5
Loa Loa (eye worm) hypothetical protein 0.0378 0.0374 0.0374
Schistosoma mansoni biogenic amine receptor 0.0059 0.0041 0.0041
Toxoplasma gondii Sodium:neurotransmitter symporter family protein 0.0808 0.0822 0.1111
Schistosoma mansoni geranylgeranyl transferase type I beta subunit 0.0378 0.0374 0.0374
Loa Loa (eye worm) hypothetical protein 0.4758 0.4944 0.4944
Echinococcus granulosus fmrfamide receptor 0.0059 0.0041 0.0041
Loa Loa (eye worm) hypothetical protein 0.0059 0.0041 0.0041
Trypanosoma brucei geranylgeranyl transferase type II beta subunit, putative 0.0378 0.0374 0.1451
Giardia lamblia Rab geranylgeranyltransferase 0.249 0.2577 0.2289
Brugia malayi G-protein coupled receptor 0.0059 0.0041 0.0041
Echinococcus multilocularis rhodopsin orphan GPCR 0.0059 0.0041 0.0041
Loa Loa (eye worm) hypothetical protein 0.0059 0.0041 0.0041
Echinococcus multilocularis serotonin receptor 0.0789 0.0803 0.0803
Chlamydia trachomatis Ssodium-dependent amino acid transporter 0.0808 0.0822 0.5
Loa Loa (eye worm) TYRA-2 protein 0.0059 0.0041 0.0041
Brugia malayi hypothetical protein 0.0059 0.0041 0.0041
Schistosoma mansoni hypothetical protein 0.0034 0.0015 0.0015
Brugia malayi Prenyltransferase and squalene oxidase repeat family protein 0.1394 0.1434 0.1434
Schistosoma mansoni amine GPCR 0.0059 0.0041 0.0041
Schistosoma mansoni opsin-like receptor 0.0059 0.0041 0.0041
Echinococcus granulosus geranylgeranyl transferase type I beta subunit 0.0378 0.0374 0.0374
Toxoplasma gondii prenyltransferase and squalene oxidase repeat-containing protein 0.1394 0.1434 0.1937
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0059 0.0041 0.0041
Brugia malayi Voltage-gated potassium channel, HERG (KCNH2)-related. C. elegans unc-103 ortholog 0.0037 0.0018 0.0018
Loa Loa (eye worm) serotonin transporter b 0.4758 0.4944 0.4944
Loa Loa (eye worm) transcription factor SMAD2 0.0137 0.0123 0.0123
Loa Loa (eye worm) hypothetical protein 0.0059 0.0041 0.0041
Trichomonas vaginalis protein farnesyltransferase beta subunit, putative 0.0378 0.0374 0.0359
Mycobacterium ulcerans cytochrome P450 124A1, Cyp124A1 0.002 0 0.5
Plasmodium vivax conserved Plasmodium protein, unknown function 0.1016 0.1039 0.1035
Brugia malayi hypothetical protein 0.0141 0.0127 0.0127
Schistosoma mansoni peptide (allatostatin)-like receptor 0.0059 0.0041 0.0041
Plasmodium vivax amine transporter, putative 0.0808 0.0822 0.0818
Echinococcus granulosus geranylgeranyl transferase type 2 subunit alpha 0.249 0.2577 0.2577
Schistosoma mansoni sodium-dependent neurotransmitter transporter 0.0808 0.0822 0.0822
Schistosoma mansoni geranylgeranyl transferase type I beta subunit 0.0378 0.0374 0.0374
Echinococcus granulosus sodium dependent neurotransmitter transporter 0.0808 0.0822 0.0822
Schistosoma mansoni biogenic amine (5HT) receptor 0.0059 0.0041 0.0041
Echinococcus multilocularis g protein coupled receptor 0.0059 0.0041 0.0041
Echinococcus multilocularis GPCR, family 2 0.0034 0.0015 0.0015
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0108 0.0093 0.0093
Brugia malayi hypothetical protein 0.0059 0.0041 0.0041
Loa Loa (eye worm) hypothetical protein 0.0808 0.0822 0.0822
Loa Loa (eye worm) hypothetical protein 0.0059 0.0041 0.0041
Schistosoma mansoni biogenic amine (octopamine/dopamine) receptor 0.0059 0.0041 0.0041
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0059 0.0041 0.0041
Loa Loa (eye worm) hypothetical protein 0.0059 0.0041 0.0041
Schistosoma mansoni norepinephrine/norepinephrine transporter 0.0808 0.0822 0.0822
Schistosoma mansoni peptide (FMRFamide/somatostatin)-like receptor 0.0059 0.0041 0.0041
Echinococcus granulosus protein prenyltransferase alpha subunit 0.249 0.2577 0.2577
Echinococcus granulosus rhodopsin orphan GPCR 0.0059 0.0041 0.0041
Echinococcus granulosus pyroglutamylated rfamide peptide receptor 0.0059 0.0041 0.0041
Echinococcus granulosus neuropeptide FF receptor 2 0.0059 0.0041 0.0041
Toxoplasma gondii Sodium:neurotransmitter symporter family protein 0.0808 0.0822 0.1111
Brugia malayi G-protein coupled receptor 0.0059 0.0041 0.0041
Echinococcus granulosus growth hormone secretagogue receptor type 1 0.0059 0.0041 0.0041
Echinococcus granulosus uncharacterized sodium dependent transporter 0.0808 0.0822 0.0822
Echinococcus multilocularis geranylgeranyl transferase type 2 subunit alpha 0.249 0.2577 0.2577
Onchocerca volvulus 0.0808 0.0822 0.1593
Loa Loa (eye worm) hypothetical protein 0.4758 0.4944 0.4944
Echinococcus granulosus thyrotropin releasing hormone receptor 0.0059 0.0041 0.0041
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0059 0.0041 0.0041
Mycobacterium ulcerans cytochrome p450 150 cyp150 0.002 0 0.5
Toxoplasma gondii prenyltransferase and squalene oxidase repeat-containing protein 0.0378 0.0374 0.0505
Schistosoma mansoni tar DNA-binding protein 0.0064 0.0046 0.0046
Brugia malayi neuropeptide F receptor 0.0059 0.0041 0.0041
Trichomonas vaginalis type I geranylgeranyltransferase beta subunit, putative 0.1394 0.1434 0.142
Schistosoma mansoni peptide (allatostatin/somatostatin)-like receptor 0.0059 0.0041 0.0041
Loa Loa (eye worm) hypothetical protein 0.0808 0.0822 0.0822
Trichomonas vaginalis protein farnesyltransferase alpha subunit, putative 0.9605 1 1
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.0034 0.0015 0.0015
Schistosoma mansoni sodium/chloride dependent transporter 0.0808 0.0822 0.0822
Loa Loa (eye worm) TAR-binding protein 0.0064 0.0046 0.0046
Trypanosoma cruzi hypothetical protein, conserved 0.0378 0.0374 0.1451
Echinococcus multilocularis fmrfamide receptor 0.0059 0.0041 0.0041
Loa Loa (eye worm) hypothetical protein 0.0059 0.0041 0.0041
Echinococcus multilocularis G protein coupled receptor 139 0.0059 0.0041 0.0041
Brugia malayi Prenyltransferase and squalene oxidase repeat family protein 0.0378 0.0374 0.0374
Plasmodium falciparum geranylgeranyl transferase type2 beta subunit, putative 0.0378 0.0374 0.0369
Echinococcus multilocularis g-protein coupled receptor 0.0059 0.0041 0.0041
Echinococcus multilocularis serotonin transporter 0.4758 0.4944 0.4944
Loa Loa (eye worm) RNA binding protein 0.0064 0.0046 0.0046
Echinococcus multilocularis rhodopsin orphan GPCR 0.0059 0.0041 0.0041
Echinococcus multilocularis rhodopsin orphan GPCR 0.0059 0.0041 0.0041
Echinococcus granulosus neuropeptide receptor 0.0059 0.0041 0.0041
Echinococcus granulosus sodium and chloride dependent glycine 0.0808 0.0822 0.0822
Echinococcus granulosus g protein linked acetylcholine receptor gar 2a 0.0059 0.0041 0.0041
Echinococcus granulosus serotonin transporter 0.4758 0.4944 0.4944
Brugia malayi Unidentified vitellogenin-linked transcript protein 6, putative 0.0059 0.0041 0.0041
Loa Loa (eye worm) G-protein coupled receptor 0.0059 0.0041 0.0041
Trypanosoma cruzi protein farnesyltransferase, putative 0.1394 0.1434 0.5563
Brugia malayi hypothetical protein 0.0059 0.0041 0.0041
Trichomonas vaginalis protein farnesyltransferase beta subunit, putative 0.0378 0.0374 0.0359
Plasmodium falciparum geranylgeranyltransferase, putative 0.0378 0.0374 0.0369
Echinococcus granulosus rhodopsin orphan GPCR 0.0059 0.0041 0.0041
Toxoplasma gondii hypothetical protein 0.249 0.2577 0.3482
Echinococcus granulosus neuropeptide Y receptor 0.0059 0.0041 0.0041
Mycobacterium ulcerans cytochrome P450 191A3 Cyp191A3 0.002 0 0.5
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0108 0.0093 0.0093
Plasmodium falciparum transporter, putative 0.0808 0.0822 0.0818
Onchocerca volvulus Huntingtin homolog 0.0141 0.0127 0.0174
Mycobacterium ulcerans cytochrome P450 136A2 Cyp136A2 0.002 0 0.5
Brugia malayi putative neuropeptide receptor 0.0059 0.0041 0.0041
Echinococcus granulosus g protein linked acetylcholine receptor gar 2a 0.0059 0.0041 0.0041

Activities

Activity type Activity value Assay description Source Reference
Basal binding (binding) = 78 % Efficacy of the compound at cloned human opioid receptor delta 1, expressed as percent of basal binding ChEMBL. 14711299
Basal binding (binding) = 78 % Efficacy of the compound at cloned human opioid receptor delta 1, expressed as percent of basal binding ChEMBL. 14711299
IC50 (functional) = 15.2 nM Inverse agonist potency of the compound at cloned human opioid receptor delta 1 ChEMBL. 14711299
IC50 (functional) = 15.2 nM Inverse agonist potency of the compound at cloned human opioid receptor delta 1 ChEMBL. 14711299
Ke (functional) = 4.24 nM Ability to inhibit agonist-stimulated (DPDPE) [35S]-GTP-gammaS, binding, using cloned human opioid receptor delta 1 expressed in CHO cells ChEMBL. 14711299
Ke (functional) = 4.24 nM Ability to inhibit agonist-stimulated (DPDPE) [35S]-GTP-gammaS, binding, using cloned human opioid receptor delta 1 expressed in CHO cells ChEMBL. 14711299
Ke (functional) = 5.51 nM Ability to inhibit agonist-stimulated (U69,593) [35S]-GTP-gammaS, binding, using cloned human Opioid receptor kappa 1 expressed in CHO cells ChEMBL. 14711299
Ke (functional) = 5.51 nM Ability to inhibit agonist-stimulated (U69,593) [35S]-GTP-gammaS, binding, using cloned human Opioid receptor kappa 1 expressed in CHO cells ChEMBL. 14711299
Ke (functional) = 40.3 nM Ability to inhibit agonist-stimulated (DAMGO) [35S]-GTP-gammaS, binding, using cloned human Opioid receptor mu 1
expressed in CHO cells
ChEMBL. 14711299
Ke (functional) = 40.3 nM Ability to inhibit agonist-stimulated (DAMGO) [35S]-GTP-gammaS, binding, using cloned human Opioid receptor mu 1
expressed in CHO cells
ChEMBL. 14711299
Ki (binding) = 9.3 nM [3H]-Cl-DPDPE competition binding assay using human cloned opioid receptor delta 1 ChEMBL. 14711299
Ki (binding) = 9.3 nM [3H]-Cl-DPDPE competition binding assay using human cloned opioid receptor delta 1 ChEMBL. 14711299
Selectivity ratio (functional) = 1.3 Selectivity ratio of agonist stimulated [35S]-GTP-gammaS, binding in cloned human kappa-opioid receptor versus delta-opioid receptor ChEMBL. 14711299
Selectivity ratio (functional) = 9.5 Selectivity ratio of agonist stimulated [35S]-GTP-gammaS, binding in cloned human mu-opioid receptor versus delta-opioid receptor ChEMBL. 14711299

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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