Detailed information for compound 1746785

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 656.727 | Formula: C32H44N6O9
  • H donors: 9 H acceptors: 9 LogP: -0.85 Rotable bonds: 23
    Rule of 5 violations (Lipinski): 3
  • SMILES: NCCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CC(=O)N)Cc1ccccc1)[C@H](CC)C)NC(=O)c1cc(O)ccc1O
  • InChi: 1S/C32H44N6O9/c1-3-18(2)27(38-29(43)22(11-7-8-14-33)35-28(42)21-16-20(39)12-13-25(21)40)31(45)36-23(15-19-9-5-4-6-10-19)30(44)37-24(32(46)47)17-26(34)41/h4-6,9-10,12-13,16,18,22-24,27,39-40H,3,7-8,11,14-15,17,33H2,1-2H3,(H2,34,41)(H,35,42)(H,36,45)(H,37,44)(H,38,43)(H,46,47)/t18-,22-,23-,24-,27-/m0/s1
  • InChiKey: AOFIIRBNRCTWMC-QSFSQKMHSA-N  

Network

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Synonyms

No synonyms found for this compound

Targets

Known targets for this compound

No curated genes were found associated with this compound

Predicted pathogen targets for this compound

By orthology
No druggable targets predicted by orthology data
By sequence similarity to non orthologous known druggable targets
No druggable targets predicted by sequence similarity

Obtained from network model

Ranking Plot


Putative Targets List


Species Potential target Raw Global Species
Onchocerca volvulus 0.0458 0.1264 1
Echinococcus granulosus 7tm_1 domain containing protein 0.0458 0.1264 0.1264
Schistosoma mansoni histamine h1 receptor 0.0458 0.1264 0.1264
Echinococcus granulosus glycine receptor subunit alpha 1 0.0079 0.0127 0.0127
Onchocerca volvulus 0.0251 0.0645 0.51
Loa Loa (eye worm) hypothetical protein 0.0458 0.1264 1
Brugia malayi Neurotransmitter-gated ion-channel transmembrane region family protein 0.0079 0.0127 0.1003
Brugia malayi Kringle domain containing protein 0.0044 0.0022 0.0177
Brugia malayi Dopamine receptor protein 1, putative (partial) 0.0458 0.1264 1
Onchocerca volvulus 0.0085 0.0146 0.1152
Entamoeba histolytica protein kinase , putative 0.0057 0.0063 1
Schistosoma mansoni biogenic amine receptor 0.0458 0.1264 0.1264
Echinococcus multilocularis neuropeptides capa receptor 0.0458 0.1264 0.1264
Echinococcus granulosus neuropeptide receptor A26 0.0458 0.1264 0.1264
Echinococcus multilocularis dro:myosuppressin receptor 0.0458 0.1264 0.1264
Echinococcus multilocularis serotonin receptor 0.0458 0.1264 0.1264
Schistosoma mansoni nAChR subunit (ShAR1-alpha-like) 0.0251 0.0645 0.0645
Schistosoma mansoni cercarial elastase (S01 family) 0.006 0.0071 0.0071
Schistosoma mansoni biogenic amine (5HT) receptor 0.0458 0.1264 0.1264
Brugia malayi AKH receptor 0.0458 0.1264 1
Trichomonas vaginalis AGC family protein kinase 0.0057 0.0063 0.5
Brugia malayi PAN domain containing protein 0.0085 0.0146 0.1152
Echinococcus multilocularis g protein coupled receptor 0.0458 0.1264 0.1264
Loa Loa (eye worm) hypothetical protein 0.0458 0.1264 1
Loa Loa (eye worm) neuropeptide F receptor 0.0458 0.1264 1
Loa Loa (eye worm) hypothetical protein 0.0079 0.0127 0.1003
Echinococcus granulosus rhodopsin orphan GPCR 0.0458 0.1264 0.1264
Brugia malayi Serotonin receptor 0.0458 0.1264 1
Loa Loa (eye worm) hypothetical protein 0.0458 0.1264 1
Onchocerca volvulus 0.0042 0.0018 0.0142
Onchocerca volvulus 0.006 0.0071 0.0563
Brugia malayi nicotinic acetylcholine receptor beta-1 chain precursor 0.0079 0.0127 0.1003
Schistosoma mansoni hypothetical protein 0.0458 0.1264 0.1264
Loa Loa (eye worm) hypothetical protein 0.0458 0.1264 1
Toxoplasma gondii PAN domain-containing protein 0.0907 0.2613 1
Onchocerca volvulus 0.0458 0.1264 1
Loa Loa (eye worm) hypothetical protein 0.0458 0.1264 1
Echinococcus granulosus glycine receptor subunit alpha 1 0.0079 0.0127 0.0127
Loa Loa (eye worm) hypothetical protein 0.0458 0.1264 1
Loa Loa (eye worm) hypothetical protein 0.0079 0.0127 0.1003
Echinococcus granulosus subfamily S1A unassigned peptidase S01 family 0.006 0.0071 0.0071
Brugia malayi Cation transporter family protein 0.0079 0.0127 0.1003
Toxoplasma gondii PAN domain-containing protein 0.0085 0.0146 0.0476
Brugia malayi Serotonin/octopamine receptor family protein 7 0.0458 0.1264 1
Loa Loa (eye worm) hypothetical protein 0.0085 0.0146 0.1152
Loa Loa (eye worm) hypothetical protein 0.0458 0.1264 1
Brugia malayi PAN domain containing protein 0.0085 0.0146 0.1152
Echinococcus multilocularis neuropeptide receptor 0.0458 0.1264 0.1264
Loa Loa (eye worm) PAN domain-containing protein 0.0085 0.0146 0.1152
Loa Loa (eye worm) hypothetical protein 0.0079 0.0127 0.1003
Echinococcus granulosus alpha 1A adrenergic receptor 0.0458 0.1264 0.1264
Echinococcus granulosus ephrin type A receptor 4 A 0.0063 0.008 0.008
Loa Loa (eye worm) glutamate-gated chloride channel alpha3A subunit 0.0079 0.0127 0.1003
Brugia malayi Neurotransmitter-gated ion-channel ligand binding domain containing protein 0.0079 0.0127 0.1003
Onchocerca volvulus 0.006 0.0071 0.0563
Echinococcus multilocularis G-protein coupled receptor, putative 0.0458 0.1264 0.1264
Schistosoma mansoni hypothetical protein 0.006 0.0071 0.0071
Trichomonas vaginalis AGC family protein kinase 0.0057 0.0063 0.5
Onchocerca volvulus 0.006 0.0071 0.0563
Brugia malayi PAN domain containing protein 0.0085 0.0146 0.1152
Schistosoma mansoni neuropeptide receptor 0.3371 1 1
Loa Loa (eye worm) hypothetical protein 0.0458 0.1264 1
Loa Loa (eye worm) hypothetical protein 0.0215 0.0536 0.4239
Loa Loa (eye worm) hypothetical protein 0.0079 0.0127 0.1003
Schistosoma mansoni biogenic amine (dopamine) receptor 0.0458 0.1264 0.1264
Loa Loa (eye worm) hypothetical protein 0.0042 0.0018 0.0142
Loa Loa (eye worm) hypothetical protein 0.0458 0.1264 1
Onchocerca volvulus 0.0458 0.1264 1
Schistosoma mansoni peptide (allatostatin)-like receptor 0.0458 0.1264 0.1264
Schistosoma mansoni biogenic amine (dopamine) receptor 0.0458 0.1264 0.1264
Onchocerca volvulus 0.0085 0.0146 0.1152
Schistosoma mansoni cercarial elastase (S01 family) 0.006 0.0071 0.0071
Onchocerca volvulus 0.0085 0.0146 0.1152
Loa Loa (eye worm) PAN domain-containing protein 0.0085 0.0146 0.1152
Loa Loa (eye worm) hypothetical protein 0.006 0.0071 0.0563
Brugia malayi Unidentified vitellogenin-linked transcript protein 6, putative 0.0458 0.1264 1
Loa Loa (eye worm) PAN domain-containing protein 0.0085 0.0146 0.1152
Onchocerca volvulus 0.0079 0.0127 0.1003
Echinococcus multilocularis ephrin type A receptor 4 A 0.0063 0.008 0.008
Onchocerca volvulus 0.0085 0.0146 0.1152
Loa Loa (eye worm) G-protein coupled receptor 0.0458 0.1264 1
Echinococcus multilocularis nicotinic acetylcholine receptor alpha subunit 0.0147 0.0332 0.0332
Loa Loa (eye worm) hypothetical protein 0.006 0.0071 0.0563
Echinococcus granulosus transmembrane protease serine 3 0.006 0.0071 0.0071
Loa Loa (eye worm) G-protein-linked acetylcholine receptor protein 2 0.0458 0.1264 1
Loa Loa (eye worm) hypothetical protein 0.006 0.0071 0.0563
Brugia malayi sulfakinin receptor protein 0.0458 0.1264 1
Loa Loa (eye worm) LGC-31 protein 0.0079 0.0127 0.1003
Loa Loa (eye worm) hypothetical protein 0.0458 0.1264 1
Echinococcus multilocularis nicotinic acetylcholine receptor a11 subunit 0.0147 0.0332 0.0332
Echinococcus granulosus g protein coupled receptor 0.0458 0.1264 0.1264
Schistosoma mansoni neuropeptide f receptor 76f 0.0458 0.1264 0.1264
Schistosoma mansoni peptide (FMRFamide/neurokinin-3)-like receptor 0.0458 0.1264 0.1264
Onchocerca volvulus 0.0458 0.1264 1
Echinococcus granulosus g-protein coupled receptor 0.0458 0.1264 0.1264
Echinococcus granulosus enteropeptidase 0.006 0.0071 0.0071
Loa Loa (eye worm) hypothetical protein 0.0085 0.0146 0.1152
Brugia malayi hypothetical protein 0.0458 0.1264 1
Loa Loa (eye worm) hypothetical protein 0.0458 0.1264 1
Echinococcus multilocularis rhodopsin orphan GPCR 0.0458 0.1264 0.1264
Echinococcus multilocularis rhodopsin orphan GPCR 0.0458 0.1264 0.1264
Echinococcus granulosus nicotinic acetylcholine receptor subunit type 0.0079 0.0127 0.0127
Loa Loa (eye worm) TK/ROR protein kinase 0.0044 0.0024 0.0193
Echinococcus granulosus somatostatin receptor 0.0458 0.1264 0.1264
Toxoplasma gondii microneme protein MIC17A 0.0085 0.0146 0.0476
Echinococcus multilocularis Peptidase S1 S6, chymotrypsin Hap 0.006 0.0071 0.0071
Echinococcus granulosus glycine receptor subunit alpha 1 0.0079 0.0127 0.0127
Echinococcus multilocularis rhodopsin orphan GPCR 0.0458 0.1264 0.1264
Schistosoma mansoni subfamily S1A unassigned peptidase (S01 family) 0.006 0.0071 0.0071
Schistosoma mansoni thyrotropin-releasing hormone receptor 0.0458 0.1264 0.1264
Echinococcus granulosus tm gpcr rhodopsin 0.0458 0.1264 0.1264
Brugia malayi Dopamine receptor 0.0458 0.1264 1
Brugia malayi Neurotransmitter-gated ion-channel ligand binding domain containing protein 0.0079 0.0127 0.1003
Loa Loa (eye worm) hypothetical protein 0.0079 0.0127 0.1003
Brugia malayi RE15519p 0.0458 0.1264 1
Echinococcus multilocularis orexin receptor type 2 0.0458 0.1264 0.1264
Loa Loa (eye worm) melatonin receptor type 1A 0.0458 0.1264 1
Echinococcus granulosus nAChR subunit 0.0042 0.0018 0.0018
Toxoplasma gondii subtilisin SUB12 0.0085 0.0146 0.0476
Loa Loa (eye worm) G-protein coupled receptor 0.0458 0.1264 1
Toxoplasma gondii microneme protein MIC4 0.0085 0.0146 0.0476
Loa Loa (eye worm) hypothetical protein 0.0458 0.1264 1
Loa Loa (eye worm) AUR protein kinase 0.0057 0.0063 0.0497
Loa Loa (eye worm) ACC-1 protein 0.0079 0.0127 0.1003
Echinococcus granulosus orexin receptor type 2 0.0458 0.1264 0.1264
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0458 0.1264 0.1264
Schistosoma mansoni cercarial elastase (S01 family) 0.006 0.0071 0.0071
Leishmania major protein kinase, putative 0.0057 0.0063 1
Schistosoma mansoni opsin-like receptor 0.0458 0.1264 0.1264
Echinococcus multilocularis acetylcholine receptor subunit beta 1 0.0079 0.0127 0.0127
Loa Loa (eye worm) 5-hydroxytryptamine 2C receptor 0.0458 0.1264 1
Brugia malayi Trypsin-like protease protein 5 0.006 0.0071 0.0563
Brugia malayi Neurotransmitter-gated ion-channel ligand binding domain containing protein 0.0079 0.0127 0.1003
Loa Loa (eye worm) hypothetical protein 0.0458 0.1264 1
Brugia malayi gonadotropin-releasing hormone receptor 2 0.0458 0.1264 1
Echinococcus granulosus glycine receptor subunit beta 0.0079 0.0127 0.0127
Onchocerca volvulus 0.0458 0.1264 1
Loa Loa (eye worm) hypothetical protein 0.0251 0.0645 0.51
Echinococcus multilocularis subfamily S1A unassigned peptidase (S01 family) 0.006 0.0071 0.0071
Schistosoma mansoni hypothetical protein 0.0458 0.1264 0.1264
Echinococcus multilocularis tm gpcr rhodopsin gpcr rhodopsin superfamily 0.0458 0.1264 0.1264
Schistosoma mansoni biogenic amine (dopamine) receptor 0.0458 0.1264 0.1264
Echinococcus multilocularis peptide (allatostatin:somatostatin) 0.0458 0.1264 0.1264
Schistosoma mansoni biogenic amine (5HT) receptor 0.0458 0.1264 0.1264
Echinococcus multilocularis aurora kinase A 0.0057 0.0063 0.0063
Schistosoma mansoni hypothetical protein 0.0044 0.0022 0.0022
Echinococcus granulosus rhodopsin orphan GPCR 0.0458 0.1264 0.1264
Loa Loa (eye worm) gonadotropin-releasing hormone receptor 2 0.0458 0.1264 1
Schistosoma mansoni hypothetical protein 0.0458 0.1264 0.1264
Schistosoma mansoni nAChR subunit (ShAR1-beta-like) 0.0251 0.0645 0.0645
Brugia malayi hypothetical protein 0.0458 0.1264 1
Loa Loa (eye worm) hypothetical protein 0.0458 0.1264 1
Echinococcus multilocularis neuropeptide receptor A26 0.0458 0.1264 0.1264
Onchocerca volvulus 0.0079 0.0127 0.1003
Echinococcus granulosus biogenic amine 5HT receptor 0.0458 0.1264 0.1264
Brugia malayi Hypothetical glycine receptor like protein T20B12.9 in chromosome III 0.0042 0.0018 0.0142
Loa Loa (eye worm) hypothetical protein 0.0458 0.1264 1
Brugia malayi nicotinic acetylcholine receptor alpha subunit, putative 0.0147 0.0332 0.2629
Brugia malayi putative neuropeptide receptor 0.0458 0.1264 1
Brugia malayi hypothetical protein 0.0458 0.1264 1
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0458 0.1264 0.1264
Echinococcus granulosus nicotinic acetylcholine receptor a11 subunit 0.0147 0.0332 0.0332
Schistosoma mansoni cercarial elastase (S01 family) 0.006 0.0071 0.0071
Loa Loa (eye worm) hypothetical protein 0.0458 0.1264 1
Loa Loa (eye worm) hypothetical protein 0.0251 0.0645 0.51
Echinococcus granulosus neuropeptide s receptor 0.0458 0.1264 0.1264
Schistosoma mansoni amine GPCR 0.0458 0.1264 0.1264
Brugia malayi Hypothetical glycine receptor like protein T20B12.9 in chromosome III 0.0079 0.0127 0.1003
Loa Loa (eye worm) hypothetical protein 0.0458 0.1264 1
Echinococcus multilocularis growth hormone secretagogue receptor type 1 0.0458 0.1264 0.1264
Echinococcus multilocularis g protein coupled receptor 0.0458 0.1264 0.1264
Loa Loa (eye worm) hypothetical protein 0.0458 0.1264 1
Echinococcus granulosus rhodopsin orphan GPCR 0.0458 0.1264 0.1264
Onchocerca volvulus 0.0458 0.1264 1
Loa Loa (eye worm) hypothetical protein 0.0042 0.0018 0.0142
Loa Loa (eye worm) nicotinic acetylcholine receptor alpha subunit 0.0147 0.0332 0.2629
Loa Loa (eye worm) hypothetical protein 0.0458 0.1264 1
Echinococcus multilocularis tachykinin peptides receptor 99D 0.0458 0.1264 0.1264
Brugia malayi glutamate-gated chloride channel alpha3A subunit, putative 0.0042 0.0018 0.0142
Schistosoma mansoni protein kinase 0.0057 0.0063 0.0063
Onchocerca volvulus 0.006 0.0071 0.0563
Loa Loa (eye worm) ACC-1 protein 0.0079 0.0127 0.1003
Echinococcus multilocularis neuropeptide receptor 0.3371 1 1
Schistosoma mansoni nAChR subunit 0.0079 0.0127 0.0127
Echinococcus granulosus nicotinic acetylcholine receptor subunit alpha 8 0.0147 0.0332 0.0332
Schistosoma mansoni serine/threonine protein kinase 0.0057 0.0063 0.0063
Schistosoma mansoni adenoreceptor 0.0458 0.1264 0.1264
Brugia malayi G-protein coupled receptor 0.0458 0.1264 1
Schistosoma mansoni neuropeptide receptor 0.0458 0.1264 0.1264
Toxoplasma gondii microneme protein, putative 0.0085 0.0146 0.0476
Loa Loa (eye worm) hypothetical protein 0.0079 0.0127 0.1003
Echinococcus multilocularis rhodopsin orphan GPCR 0.0458 0.1264 0.1264
Schistosoma mansoni nAChR subunit 0.0079 0.0127 0.0127
Echinococcus multilocularis neuronal acetylcholine receptor subunit alpha 4 0.0079 0.0127 0.0127
Loa Loa (eye worm) hypothetical protein 0.0079 0.0127 0.1003
Echinococcus multilocularis thyrotropin releasing hormone receptor 0.0458 0.1264 0.1264
Schistosoma mansoni hypothetical protein 0.006 0.0071 0.0071
Echinococcus granulosus Mastin 0.006 0.0071 0.0071
Plasmodium vivax serine/threonine protein kinase 6, putative 0.0057 0.0063 1
Loa Loa (eye worm) hypothetical protein 0.0458 0.1264 1
Schistosoma mansoni Cys-loop ligand gated ion channel subunit 0.0079 0.0127 0.0127
Onchocerca volvulus 0.0085 0.0146 0.1152
Loa Loa (eye worm) hypothetical protein 0.0458 0.1264 1
Loa Loa (eye worm) hypothetical protein 0.0458 0.1264 1
Loa Loa (eye worm) neuropeptide F receptor 0.0458 0.1264 1
Brugia malayi neuropeptide F receptor 0.0458 0.1264 1
Echinococcus multilocularis biogenic amine (5HT) receptor 0.0458 0.1264 0.1264
Schistosoma mansoni myosin xvIII 0.0458 0.1264 0.1264
Echinococcus granulosus sex peptide receptor 0.0458 0.1264 0.1264
Schistosoma mansoni alpha-1 adrenergic receptor 0.0458 0.1264 0.1264
Echinococcus granulosus g protein coupled receptor 0.0458 0.1264 0.1264
Schistosoma mansoni subfamily S1A unassigned peptidase (S01 family) 0.006 0.0071 0.0071
Brugia malayi G protein-coupled receptor F59B2.13 0.0458 0.1264 1
Toxoplasma gondii microneme protein MIC17C 0.0085 0.0146 0.0476
Giardia lamblia Aurora kinase 0.0057 0.0063 0.5
Toxoplasma gondii PAN domain-containing protein 0.0085 0.0146 0.0476
Echinococcus granulosus neuropeptide FF receptor 2 0.0458 0.1264 0.1264
Schistosoma mansoni cercarial elastase (S01 family) 0.006 0.0071 0.0071
Schistosoma mansoni Cys-loop ligand gated ion channel subunit 0.0042 0.0018 0.0018
Echinococcus multilocularis g protein linked acetylcholine receptor gar 2a 0.0458 0.1264 0.1264
Brugia malayi hypothetical protein 0.0458 0.1264 1
Echinococcus granulosus tachykinin peptides receptor 99D 0.0458 0.1264 0.1264
Echinococcus granulosus nicotinic acetylcholine receptor alpha subunit 0.0147 0.0332 0.0332
Echinococcus multilocularis rhodopsin orphan GPCR 0.0458 0.1264 0.1264
Onchocerca volvulus 0.0085 0.0146 0.1152
Loa Loa (eye worm) follicle stimulating hormone receptor 0.0458 0.1264 1
Echinococcus multilocularis sex peptide receptor 0.0458 0.1264 0.1264
Brugia malayi Tachykinin-like peptides receptor 99D 0.0458 0.1264 1
Echinococcus multilocularis rhodopsin orphan GPCR 0.0458 0.1264 0.1264
Onchocerca volvulus 0.0458 0.1264 1
Schistosoma mansoni cercarial elastase (S01 family) 0.006 0.0071 0.0071
Schistosoma mansoni cercarial elastase (S01 family) 0.006 0.0071 0.0071
Loa Loa (eye worm) hypothetical protein 0.0458 0.1264 1
Echinococcus granulosus hypothetical protein 0.0458 0.1264 0.1264
Onchocerca volvulus 0.0044 0.0022 0.0177
Loa Loa (eye worm) hypothetical protein 0.0458 0.1264 1
Loa Loa (eye worm) hypothetical protein 0.0458 0.1264 1
Brugia malayi serine/threonine-protein kinase 6 0.0057 0.0063 0.0497
Echinococcus multilocularis nAChR subunit 0.0079 0.0127 0.0127
Schistosoma mansoni biogenic amine (octopamine/dopamine) receptor 0.0458 0.1264 0.1264
Echinococcus multilocularis rhodopsin orphan GPCR 0.0458 0.1264 0.1264
Brugia malayi hypothetical protein 0.0458 0.1264 1
Onchocerca volvulus 0.0251 0.0645 0.51
Loa Loa (eye worm) hypothetical protein 0.0042 0.0018 0.0142
Echinococcus granulosus rhodopsin orphan GPCR 0.0458 0.1264 0.1264
Loa Loa (eye worm) hypothetical protein 0.0079 0.0127 0.1003
Echinococcus granulosus nicotinic acetylcholine receptor beta 1 subunit 0.0079 0.0127 0.0127
Schistosoma mansoni histamine-responsive GPCR (AAF21638) 0.0458 0.1264 0.1264
Brugia malayi Serotonin receptor 0.0458 0.1264 1
Toxoplasma gondii PAN domain-containing protein 0.0085 0.0146 0.0476
Brugia malayi Trypsin family protein 0.0316 0.0838 0.6628
Brugia malayi Dopamine receptor protein 2 0.0458 0.1264 1
Entamoeba histolytica serine/threonine- protein kinase 6, putative 0.0057 0.0063 1
Schistosoma mansoni neuropeptide F-like receptor 0.0458 0.1264 0.1264
Echinococcus granulosus acetylcholine receptor subunit beta 1 0.0079 0.0127 0.0127
Schistosoma mansoni neuropeptide receptor 0.0458 0.1264 0.1264
Schistosoma mansoni amine GPCR 0.0458 0.1264 0.1264
Loa Loa (eye worm) hypothetical protein 0.0042 0.0018 0.0142
Brugia malayi Neurotransmitter-gated ion-channel transmembrane region family protein 0.0079 0.0127 0.1003
Toxoplasma gondii 1,3(4)-beta-glucanase 0.0085 0.0146 0.0476
Echinococcus granulosus g protein coupled receptor 0.0458 0.1264 0.1264
Echinococcus granulosus aurora kinase A 0.0057 0.0063 0.0063
Brugia malayi serine/threonine kinase 12 0.0057 0.0063 0.0497
Schistosoma mansoni peptide (FMRFamide/somatostatin)-like receptor 0.0458 0.1264 0.1264
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0458 0.1264 0.1264
Onchocerca volvulus 0.0251 0.0645 0.51
Brugia malayi Dopamine receptor protein 1 0.0458 0.1264 1
Echinococcus multilocularis fmrfamide receptor 0.0458 0.1264 0.1264
Loa Loa (eye worm) hypothetical protein 0.0458 0.1264 1
Loa Loa (eye worm) ligand-Gated ion Channel family member 0.0079 0.0127 0.1003
Loa Loa (eye worm) PAN domain-containing protein 0.0085 0.0146 0.1152
Brugia malayi PAN domain containing protein 0.0085 0.0146 0.1152
Brugia malayi follicle stimulating hormone receptor 0.0458 0.1264 1
Echinococcus granulosus neuropeptides capa receptor 0.0458 0.1264 0.1264
Echinococcus granulosus 7TM GPCR rhodopsin 0.0458 0.1264 0.1264
Echinococcus granulosus tm gpcr rhodopsin 0.1989 0.5856 0.5856
Schistosoma mansoni nAChR subunit 0.0079 0.0127 0.0127
Echinococcus granulosus g protein linked acetylcholine receptor gar 2a 0.0458 0.1264 0.1264
Schistosoma mansoni nAChR subunit 0.0079 0.0127 0.0127
Toxoplasma gondii PAN domain-containing protein 0.0085 0.0146 0.0476
Brugia malayi G protein-coupled receptor 0.0458 0.1264 1
Schistosoma mansoni amine GPCR 0.0458 0.1264 0.1264
Echinococcus granulosus allatostatin A receptor 0.0458 0.1264 0.1264
Schistosoma mansoni opsin-like receptor 0.0458 0.1264 0.1264
Loa Loa (eye worm) hypothetical protein 0.0458 0.1264 1
Onchocerca volvulus 0.006 0.0071 0.0563
Onchocerca volvulus 0.0458 0.1264 1
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0458 0.1264 0.1264
Brugia malayi Trypsin family protein 0.006 0.0071 0.0563
Echinococcus granulosus nAChR subunit 0.0079 0.0127 0.0127
Loa Loa (eye worm) excitatory GABA receptor EXP-1A 0.0079 0.0127 0.1003
Loa Loa (eye worm) hypothetical protein 0.0079 0.0127 0.1003
Echinococcus granulosus G protein coupled receptor 139 0.0458 0.1264 0.1264
Loa Loa (eye worm) hypothetical protein 0.0458 0.1264 1
Echinococcus multilocularis somatostatin receptor 0.0458 0.1264 0.1264
Onchocerca volvulus Neuropeptide F receptor homolog 0.0458 0.1264 1
Loa Loa (eye worm) hypothetical protein 0.0458 0.1264 1
Loa Loa (eye worm) hypothetical protein 0.0042 0.0018 0.0142
Echinococcus granulosus rhodopsin orphan GPCR 0.0458 0.1264 0.1264
Brugia malayi ORL1-like opioid receptor 0.0458 0.1264 1
Schistosoma mansoni neuropeptide F-like receptor 0.0458 0.1264 0.1264
Echinococcus multilocularis g protein linked acetylcholine receptor gar 2a 0.0458 0.1264 0.1264
Onchocerca volvulus 0.0458 0.1264 1
Toxoplasma gondii hypothetical protein 0.0085 0.0146 0.0476
Loa Loa (eye worm) hypothetical protein 0.0042 0.0018 0.0142
Loa Loa (eye worm) unidentified vitellogenin-linked transcript protein 6 0.0458 0.1264 1
Echinococcus granulosus peptide allatostatin:somatostatin 0.0458 0.1264 0.1264
Brugia malayi Protein kinase domain containing protein 0.0044 0.0024 0.0193
Schistosoma mansoni Cys-loop ligand gated ion channel subunit 0.0079 0.0127 0.0127
Onchocerca volvulus 0.0458 0.1264 1
Loa Loa (eye worm) hypothetical protein 0.0458 0.1264 1
Entamoeba histolytica protein kinase, putative 0.0057 0.0063 1
Loa Loa (eye worm) hypothetical protein 0.0079 0.0127 0.1003
Loa Loa (eye worm) hypothetical protein 0.0458 0.1264 1
Schistosoma mansoni neurotransmitter gated ion channel 0.0042 0.0018 0.0018
Loa Loa (eye worm) hypothetical protein 0.0458 0.1264 1
Loa Loa (eye worm) nicotinic acetylcholine receptor non-alpha subunit 0.0079 0.0127 0.1003
Echinococcus granulosus dro:myosuppressin receptor 0.0458 0.1264 0.1264
Brugia malayi hypothetical protein 0.0458 0.1264 1
Echinococcus multilocularis serotonin receptor 0.0458 0.1264 0.1264
Echinococcus granulosus neuropeptide Y receptor 0.0458 0.1264 0.1264
Loa Loa (eye worm) hypothetical protein 0.0458 0.1264 1
Echinococcus multilocularis neuropeptide Y receptor 0.0458 0.1264 0.1264
Echinococcus multilocularis neuropeptide Y receptor 0.0458 0.1264 0.1264
Echinococcus multilocularis tissue type plasminogen activator 0.0044 0.0022 0.0022
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0458 0.1264 0.1264
Loa Loa (eye worm) TYRA-2 protein 0.0458 0.1264 1
Echinococcus granulosus fmrfamide receptor 0.0458 0.1264 0.1264
Brugia malayi G-protein coupled receptor 0.0458 0.1264 1
Brugia malayi serine/threonine protein kinase 6 0.0057 0.0063 0.0497
Onchocerca volvulus Putative nachr subunit 0.0147 0.0332 0.2629
Brugia malayi Neurotransmitter-gated ion-channel ligand binding domain containing protein 0.0079 0.0127 0.1003
Brugia malayi PAN domain containing protein 0.0085 0.0146 0.1152
Loa Loa (eye worm) hypothetical protein 0.0085 0.0146 0.1152
Echinococcus granulosus tm gpcr rhodopsin 0.0458 0.1264 0.1264
Brugia malayi PAN domain containing protein 0.0085 0.0146 0.1152
Brugia malayi PAN domain containing protein 0.0085 0.0146 0.1152
Echinococcus granulosus Cys loop ligand gated ion channel subunit 0.0079 0.0127 0.0127
Trypanosoma cruzi aurora B kinase, putative 0.0057 0.0063 1
Echinococcus multilocularis pyroglutamylated rfamide peptide receptor 0.0458 0.1264 0.1264
Echinococcus granulosus Peptidase S1 S6 chymotrypsin Hap 0.006 0.0071 0.0071
Schistosoma mansoni subfamily S1A unassigned peptidase (S01 family) 0.0316 0.0838 0.0838
Schistosoma mansoni opsin-like receptor 0.0458 0.1264 0.1264
Trichomonas vaginalis AGC family protein kinase 0.0057 0.0063 0.5
Echinococcus multilocularis glycoprotein Antigen 5 0.006 0.0071 0.0071
Schistosoma mansoni Cys-loop ligand gated ion channel subunit 0.0079 0.0127 0.0127
Loa Loa (eye worm) hypothetical protein 0.0079 0.0127 0.1003
Onchocerca volvulus 0.0458 0.1264 1
Echinococcus granulosus neuropeptides capa receptor 0.0458 0.1264 0.1264
Loa Loa (eye worm) hypothetical protein 0.0458 0.1264 1
Echinococcus multilocularis neuropeptides capa receptor 0.0458 0.1264 0.1264
Schistosoma mansoni aminopeptidase PILS (M01 family) 0.006 0.0071 0.0071
Brugia malayi hypothetical protein 0.0458 0.1264 1
Toxoplasma gondii PAN/Apple domain-containing protein 0.0085 0.0146 0.0476
Entamoeba histolytica serine/threonine protein kinase 6, putative 0.0057 0.0063 1
Brugia malayi GnHR receptor homolog 0.0458 0.1264 1
Brugia malayi putative neuropeptide receptor NPR1 0.0458 0.1264 1
Schistosoma mansoni nAChR subunit 0.0079 0.0127 0.0127
Brugia malayi PAN domain containing protein 0.0085 0.0146 0.1152
Echinococcus granulosus glycine receptor subunit beta 0.0079 0.0127 0.0127
Brugia malayi Cation transporter family protein 0.0079 0.0127 0.1003
Echinococcus multilocularis nicotinic acetylcholine receptor beta 1 subunit 0.0079 0.0127 0.0127
Loa Loa (eye worm) hypothetical protein 0.0079 0.0127 0.1003
Mycobacterium ulcerans hypothetical protein 0.006 0.0071 0.5
Echinococcus granulosus rhodopsin orphan GPCR 0.0458 0.1264 0.1264
Brugia malayi PAN domain containing protein 0.0085 0.0146 0.1152
Echinococcus multilocularis neuropeptide s receptor 0.0458 0.1264 0.1264
Echinococcus multilocularis glycine receptor subunit alpha 1 0.0079 0.0127 0.0127
Echinococcus granulosus tissue type plasminogen activator 0.0044 0.0022 0.0022
Toxoplasma gondii hypothetical protein 0.0085 0.0146 0.0476
Echinococcus multilocularis transmembrane protease serine 3 0.006 0.0071 0.0071
Echinococcus granulosus growth hormone secretagogue receptor type 1 0.0458 0.1264 0.1264
Loa Loa (eye worm) hypothetical protein 0.0044 0.0022 0.0177
Loa Loa (eye worm) hypothetical protein 0.0316 0.0838 0.6628
Loa Loa (eye worm) trypsin family protein 0.006 0.0071 0.0563
Brugia malayi Chymotrypsin-like protease CTRL-1 precursor 0.006 0.0071 0.0563
Onchocerca volvulus 0.0085 0.0146 0.1152
Brugia malayi Trypsin family protein 0.006 0.0071 0.0563
Brugia malayi Neurotransmitter-gated ion-channel transmembrane region family protein 0.0042 0.0018 0.0142
Loa Loa (eye worm) hypothetical protein 0.0079 0.0127 0.1003
Brugia malayi acetylcholine receptor alpha subunit precursor, putative 0.0079 0.0127 0.1003
Brugia malayi larval opioid receptor 0.0458 0.1264 1
Echinococcus multilocularis Cys loop ligand gated ion channel subunit 0.0079 0.0127 0.0127
Brugia malayi Cation transporter family protein 0.0251 0.0645 0.51
Loa Loa (eye worm) hypothetical protein 0.0316 0.0838 0.6628
Schistosoma mansoni amine GPCR 0.0458 0.1264 0.1264
Schistosoma mansoni nicotinic acetylcholine receptor alpha 0.0042 0.0018 0.0018
Echinococcus multilocularis rhodopsin orphan GPCR 0.0458 0.1264 0.1264
Echinococcus multilocularis Mastin 0.006 0.0071 0.0071
Toxoplasma gondii aurora kinase 0.0057 0.0063 0.0156
Schistosoma mansoni amine GPCR 0.0458 0.1264 0.1264
Loa Loa (eye worm) hypothetical protein 0.0458 0.1264 1
Loa Loa (eye worm) PAN domain-containing protein 0.0085 0.0146 0.1152
Echinococcus granulosus rhodopsin orphan GPCR 0.0458 0.1264 0.1264
Schistosoma mansoni muscarinic acetylcholine (GAR) receptor 0.0458 0.1264 0.1264
Brugia malayi acetylcholine receptor protein, alpha-like chain, putative 0.0079 0.0127 0.1003
Echinococcus granulosus serine:threonine protein kinase 12 B 0.0057 0.0063 0.0063
Toxoplasma gondii microneme protein MIC17B 0.0085 0.0146 0.0476
Onchocerca volvulus Dopamine\/Ecdysteroid receptor homolog 0.0458 0.1264 1
Brugia malayi excitatory GABA receptor EXP-1A 0.0079 0.0127 0.1003
Loa Loa (eye worm) hypothetical protein 0.0458 0.1264 1
Loa Loa (eye worm) hypothetical protein 0.0042 0.0018 0.0142
Echinococcus granulosus g protein linked acetylcholine receptor gar 2a 0.0458 0.1264 0.1264
Loa Loa (eye worm) AUR protein kinase 0.0057 0.0063 0.0497
Echinococcus multilocularis serine:threonine protein kinase 12 B 0.0057 0.0063 0.0063
Schistosoma mansoni subfamily S1A unassigned peptidase (S01 family) 0.006 0.0071 0.0071
Schistosoma mansoni nAChR subunit 0.0079 0.0127 0.0127
Echinococcus granulosus G protein coupled 5 hydroxytryptamine receptor 0.0458 0.1264 0.1264
Echinococcus multilocularis G protein coupled 5 hydroxytryptamine receptor 0.0458 0.1264 0.1264
Schistosoma mansoni cercarial elastase (S01 family) 0.006 0.0071 0.0071
Schistosoma mansoni peptide (allatostatin/somatostatin)-like receptor 0.0458 0.1264 0.1264
Loa Loa (eye worm) hypothetical protein 0.0085 0.0146 0.1152
Echinococcus multilocularis G protein coupled receptor 139 0.3371 1 1
Onchocerca volvulus 0.0458 0.1264 1
Echinococcus multilocularis allatostatin A receptor 0.0458 0.1264 0.1264
Onchocerca volvulus 0.0079 0.0127 0.1003
Onchocerca volvulus 0.0085 0.0146 0.1152
Brugia malayi acetylcholine receptor, alpha-type subunit unc-38 precursor 0.0079 0.0127 0.1003
Echinococcus multilocularis nicotinic acetylcholine receptor subunit alpha 8 0.0147 0.0332 0.0332
Onchocerca volvulus 0.0316 0.0838 0.6628
Brugia malayi G-protein-linked acetylcholine receptor protein 2, putative 0.0458 0.1264 1
Loa Loa (eye worm) hypothetical protein 0.0458 0.1264 1
Echinococcus multilocularis alpha 1A adrenergic receptor 0.0458 0.1264 0.1264
Echinococcus granulosus neuropeptide Y receptor 0.0458 0.1264 0.1264
Schistosoma mansoni ancient conserved domain protein 2 (cyclin m2) 0.0458 0.1264 0.1264
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0458 0.1264 0.1264
Echinococcus multilocularis glycine receptor subunit beta 0.0079 0.0127 0.0127
Onchocerca volvulus 0.0256 0.0658 0.5203
Schistosoma mansoni cercarial elastase (S01 family) 0.006 0.0071 0.0071
Onchocerca volvulus 0.0042 0.0018 0.0142
Loa Loa (eye worm) hypothetical protein 0.0085 0.0146 0.1152
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0458 0.1264 0.1264
Schistosoma mansoni subfamily S1A unassigned peptidase (S01 family) 0.032 0.0852 0.0852
Echinococcus multilocularis g protein coupled receptor 0.0458 0.1264 0.1264
Loa Loa (eye worm) hypothetical protein 0.0458 0.1264 1
Echinococcus granulosus biogenic amine 5HT receptor 0.0458 0.1264 0.1264
Schistosoma mansoni ephrin receptor 0.0063 0.008 0.008
Loa Loa (eye worm) hypothetical protein 0.0042 0.0018 0.0142
Plasmodium falciparum serine/threonine protein kinase, putative 0.0057 0.0063 1
Loa Loa (eye worm) hypothetical protein 0.006 0.0071 0.0563
Brugia malayi gamma-aminobutyric-acid receptor beta subunit precursor 0.0079 0.0127 0.1003
Loa Loa (eye worm) hypothetical protein 0.0458 0.1264 1
Onchocerca volvulus 0.0458 0.1264 1
Onchocerca volvulus 0.0085 0.0146 0.1152
Schistosoma mansoni subfamily S1A unassigned peptidase (S01 family) 0.006 0.0071 0.0071
Echinococcus multilocularis tm gpcr rhodopsin gpcr rhodopsin superfamily 0.1989 0.5856 0.5856
Schistosoma mansoni growth hormone secretagogue receptor 0.0458 0.1264 0.1264
Entamoeba histolytica protein kinase, putative 0.0057 0.0063 1
Loa Loa (eye worm) TK/EPH protein kinase 0.008 0.0131 0.1038
Onchocerca volvulus 0.0458 0.1264 1
Schistosoma mansoni hypothetical protein 0.0458 0.1264 0.1264
Loa Loa (eye worm) hypothetical protein 0.0458 0.1264 1
Brugia malayi PAN domain containing protein 0.0085 0.0146 0.1152
Schistosoma mansoni cercarial elastase (S01 family) 0.006 0.0071 0.0071
Loa Loa (eye worm) hypothetical protein 0.0079 0.0127 0.1003
Loa Loa (eye worm) hypothetical protein 0.0458 0.1264 1
Brugia malayi Melatonin receptor type 1A 0.0458 0.1264 1
Entamoeba histolytica serine/threonine- protein kinase 6 , putative 0.0057 0.0063 1
Loa Loa (eye worm) hypothetical protein 0.0079 0.0127 0.1003
Onchocerca volvulus 0.0458 0.1264 1
Loa Loa (eye worm) hypothetical protein 0.0062 0.0078 0.0617
Toxoplasma gondii PAN domain-containing protein 0.0907 0.2613 1
Echinococcus multilocularis tm gpcr rhodopsin gpcr rhodopsin superfamily 0.0458 0.1264 0.1264
Echinococcus multilocularis enteropeptidase 0.006 0.0071 0.0071
Loa Loa (eye worm) hypothetical protein 0.0458 0.1264 1
Trypanosoma brucei aurora B kinase 0.0057 0.0063 0.5
Echinococcus granulosus pyroglutamylated rfamide peptide receptor 0.0458 0.1264 0.1264
Onchocerca volvulus 0.0062 0.0078 0.0617
Schistosoma mansoni nAChR subunit 0.0079 0.0127 0.0127
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0458 0.1264 0.1264
Brugia malayi Neurotransmitter-gated ion-channel ligand binding domain containing protein 0.0079 0.0127 0.1003
Brugia malayi Trypsin family protein 0.006 0.0071 0.0563
Entamoeba histolytica protein kinase domain containing protein 0.0057 0.0063 1
Loa Loa (eye worm) hypothetical protein 0.0147 0.0332 0.2629
Schistosoma mansoni biogenic amine receptor 0.0458 0.1264 0.1264
Loa Loa (eye worm) hypothetical protein 0.0085 0.0146 0.1152
Schistosoma mansoni biogenic amine receptor 0.0458 0.1264 0.1264
Loa Loa (eye worm) hypothetical protein 0.0458 0.1264 1
Echinococcus multilocularis 7TM GPCR, rhodopsin 0.0458 0.1264 0.1264
Schistosoma mansoni subfamily S1A unassigned peptidase (S01 family) 0.006 0.0071 0.0071
Loa Loa (eye worm) acetylcholine receptor alpha subunit 0.0079 0.0127 0.1003
Schistosoma mansoni cercarial elastase (S01 family) 0.006 0.0071 0.0071
Brugia malayi hypothetical protein 0.0458 0.1264 1
Echinococcus granulosus thyrotropin releasing hormone receptor 0.0458 0.1264 0.1264
Brugia malayi hypothetical protein 0.0458 0.1264 1
Onchocerca volvulus 0.0085 0.0146 0.1152
Echinococcus granulosus serotonin receptor 0.0458 0.1264 0.1264
Echinococcus multilocularis neuropeptide FF receptor 2 0.0458 0.1264 0.1264
Schistosoma mansoni peptide (FMRFamide/somatostatin)-like receptor 0.0458 0.1264 0.1264
Onchocerca volvulus 0.0085 0.0146 0.1152
Echinococcus multilocularis glycine receptor subunit alpha 1 0.0079 0.0127 0.0127
Echinococcus granulosus neuronal acetylcholine receptor subunit alpha 4 0.0079 0.0127 0.0127
Onchocerca volvulus 0.0458 0.1264 1
Echinococcus multilocularis glycine receptor subunit alpha 1 0.0079 0.0127 0.0127
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0458 0.1264 0.1264
Brugia malayi neuropeptide F receptor 0.0458 0.1264 1
Brugia malayi hypothetical protein 0.006 0.0071 0.0563
Brugia malayi Neurotransmitter-gated ion-channel transmembrane region family protein 0.0079 0.0127 0.1003
Loa Loa (eye worm) hypothetical protein 0.0458 0.1264 1
Brugia malayi Neurotransmitter-gated ion-channel ligand binding domain containing protein 0.0079 0.0127 0.1003
Onchocerca volvulus 0.0458 0.1264 1
Loa Loa (eye worm) hypothetical protein 0.006 0.0071 0.0563
Loa Loa (eye worm) AUR protein kinase 0.0057 0.0063 0.0497
Echinococcus multilocularis nAChR subunit 0.0042 0.0018 0.0018
Echinococcus multilocularis glycine receptor subunit beta 0.0079 0.0127 0.0127
Loa Loa (eye worm) hypothetical protein 0.0079 0.0127 0.1003
Loa Loa (eye worm) GABA receptor subunit 0.0042 0.0018 0.0142
Brugia malayi hypothetical protein 0.0458 0.1264 1
Loa Loa (eye worm) hypothetical protein 0.0085 0.0146 0.1152
Trichomonas vaginalis AGC family protein kinase 0.0057 0.0063 0.5
Brugia malayi Neurotransmitter-gated ion-channel transmembrane region family protein 0.0042 0.0018 0.0142
Echinococcus multilocularis g-protein coupled receptor 0.0458 0.1264 0.1264
Echinococcus granulosus neuropeptide receptor 0.0458 0.1264 0.1264
Schistosoma mansoni nAChR subunit (ShAR1-beta2-like) 0.0079 0.0127 0.0127
Echinococcus multilocularis fmrfamide receptor 0.0458 0.1264 0.1264
Schistosoma mansoni neuropeptide receptor 0.0458 0.1264 0.1264
Loa Loa (eye worm) hypothetical protein 0.0458 0.1264 1
Echinococcus granulosus glycoprotein Antigen 5 0.006 0.0071 0.0071

Activities

Activity type Activity value Assay description Source Reference
IC50 (binding) = 21 uM Anti-thrombin activity by competitive enzyme assay using the fluorogenic substrate Tos-Gly-Pro-Arg-AMC at pH 8.3. ChEMBL. 9873411

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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