Detailed information for compound 1520540

Basic information

Technical information
  • TDR Targets ID: 1520540
  • Name: UPCMLD16BSDN001103:001
  • MW: 503.589 | Formula: C29H33N3O5
  • H donors: 0 H acceptors: 4 LogP: 2.75 Rotable bonds: 8
    Rule of 5 violations (Lipinski): 2
  • SMILES: CCCCN1CC(=O)N2[C@](C1=O)(Cc1ccccc1)[C@H]1C(=O)N(C(=O)[C@H]1[C@H]2c1ccc(cc1)OC)CC
  • InChi: 1S/C29H33N3O5/c1-4-6-16-30-18-22(33)32-25(20-12-14-21(37-3)15-13-20)23-24(27(35)31(5-2)26(23)34)29(32,28(30)36)17-19-10-8-7-9-11-19/h7-15,23-25H,4-6,16-18H2,1-3H3/t23-,24-,25-,29-/m1/s1
  • InChiKey: FMKFVWDWQSYDFG-DOUCHOMGSA-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 ATPase family, AAA domain containing 5 Starlite/ChEMBL No references

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Echinococcus multilocularis atpase aaa+ type core atpase aaa type core Get druggable targets OG5_139225 All targets in OG5_139225
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
Brugia malayi hypothetical protein 0.0008 0.002 0.0023
Schistosoma mansoni hypothetical protein 0.0008 0.002 0.0023
Entamoeba histolytica Ras guanine nucleotide exchange factor, putative 0.0006 0 0.5
Echinococcus multilocularis neuropeptide s receptor 0.0008 0.002 0.002
Echinococcus multilocularis neuropeptide Y receptor 0.0008 0.002 0.002
Brugia malayi Smad1 0.0008 0.0018 0.0021
Schistosoma mansoni biogenic amine (octopamine/dopamine) receptor 0.0008 0.002 0.0023
Brugia malayi Serotonin receptor 0.0008 0.002 0.0023
Echinococcus multilocularis neuropeptide receptor A26 0.0008 0.002 0.002
Echinococcus granulosus rhodopsin orphan GPCR 0.0008 0.002 0.0023
Loa Loa (eye worm) hypothetical protein 0.0008 0.002 0.0023
Loa Loa (eye worm) hypothetical protein 0.0008 0.002 0.0023
Loa Loa (eye worm) hypothetical protein 0.0008 0.002 0.0023
Loa Loa (eye worm) hypothetical protein 0.0008 0.002 0.0023
Onchocerca volvulus 0.0008 0.002 0.0088
Loa Loa (eye worm) hypothetical protein 0.0482 0.4889 0.5652
Schistosoma mansoni histamine-responsive GPCR (AAF21638) 0.0008 0.002 0.0023
Schistosoma mansoni neuropeptide receptor 0.0008 0.002 0.0023
Echinococcus granulosus regulator of G protein signaling 7 0.0009 0.0026 0.003
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0008 0.002 0.0023
Brugia malayi hypothetical protein 0.0008 0.002 0.0023
Echinococcus granulosus g protein coupled receptor 0.0008 0.002 0.0023
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0029 0.0236 0.0273
Echinococcus granulosus rhodopsin orphan GPCR 0.0008 0.002 0.0023
Entamoeba histolytica Ras guanine nucleotide exchange factor, putative 0.0006 0 0.5
Brugia malayi hypothetical protein 0.0008 0.002 0.0023
Mycobacterium ulcerans fusion of enoyl-CoA hydratase, EchA21 and lipase, LipE 0.0035 0.0298 0.5
Echinococcus multilocularis alpha 1A adrenergic receptor 0.0008 0.002 0.002
Schistosoma mansoni neuropeptide f receptor 76f 0.0008 0.002 0.0023
Loa Loa (eye worm) hypothetical protein 0.0008 0.002 0.0023
Onchocerca volvulus Segment polarity protein dishevelled homolog 0.0009 0.0026 0.0111
Echinococcus granulosus mothers against decapentaplegic 5 0.0008 0.0018 0.0021
Schistosoma mansoni smad1 5 8 and 0.0008 0.0018 0.0021
Brugia malayi Pre-SET motif family protein 0.0029 0.0236 0.0273
Plasmodium vivax cytochrome b 0.0848 0.8651 1
Brugia malayi GnHR receptor homolog 0.0008 0.002 0.0023
Trypanosoma brucei hypothetical protein, conserved 0.0035 0.0298 0.5
Schistosoma mansoni neuropeptide F-like receptor 0.0008 0.002 0.0023
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0055 0.0504 0.0583
Onchocerca volvulus 0.0008 0.002 0.0088
Brugia malayi G-protein-linked acetylcholine receptor protein 2, putative 0.0008 0.002 0.0023
Loa Loa (eye worm) gonadotropin-releasing hormone receptor 2 0.0008 0.002 0.0023
Schistosoma mansoni biogenic amine (5HT) receptor 0.0008 0.002 0.0023
Schistosoma mansoni amine GPCR 0.0008 0.002 0.0023
Schistosoma mansoni biogenic amine (dopamine) receptor 0.0008 0.002 0.0023
Toxoplasma gondii cytochrome b 0.0848 0.8651 1
Toxoplasma gondii apocytochrome b, putative 0.0848 0.8651 1
Echinococcus multilocularis TGF beta signal transducer SmadC 0.0008 0.0018 0.0018
Schistosoma mansoni peptide (FMRFamide/somatostatin)-like receptor 0.0008 0.002 0.0023
Echinococcus multilocularis peptide (allatostatin:somatostatin) 0.0008 0.002 0.002
Loa Loa (eye worm) hypothetical protein 0.0035 0.0298 0.0344
Schistosoma mansoni dishevelled 0.0009 0.0026 0.003
Loa Loa (eye worm) G-protein coupled receptor 0.0008 0.002 0.0023
Onchocerca volvulus 0.0035 0.0298 0.1287
Echinococcus multilocularis smad 0.0008 0.0018 0.0018
Brugia malayi G protein-coupled receptor 0.0008 0.002 0.0023
Echinococcus multilocularis rhodopsin orphan GPCR 0.0008 0.002 0.002
Loa Loa (eye worm) TYRA-2 protein 0.0008 0.002 0.0023
Entamoeba histolytica Ras guanine nucleotide exchange factor, putative 0.0006 0 0.5
Onchocerca volvulus 0.0008 0.002 0.0088
Echinococcus granulosus g-protein coupled receptor 0.0008 0.002 0.0023
Onchocerca volvulus 0.0008 0.002 0.0088
Echinococcus granulosus neuropeptides capa receptor 0.0008 0.002 0.0023
Brugia malayi hypothetical protein 0.0009 0.0026 0.003
Echinococcus granulosus neuropeptide receptor 0.0008 0.002 0.0023
Onchocerca volvulus 0.0035 0.0298 0.1287
Echinococcus multilocularis G protein coupled receptor 139 0.0008 0.002 0.002
Onchocerca volvulus 0.0008 0.002 0.0088
Loa Loa (eye worm) unidentified vitellogenin-linked transcript protein 6 0.0008 0.002 0.0023
Mycobacterium leprae conserved hypothetical protein 0.0035 0.0298 0.5
Loa Loa (eye worm) hypothetical protein 0.0035 0.0298 0.0344
Echinococcus multilocularis tm gpcr rhodopsin gpcr rhodopsin superfamily 0.0008 0.002 0.002
Loa Loa (eye worm) hypothetical protein 0.0008 0.002 0.0023
Echinococcus multilocularis g protein linked acetylcholine receptor gar 2a 0.0008 0.002 0.002
Schistosoma mansoni smad1 5 8 and 0.0008 0.0018 0.0021
Brugia malayi sulfakinin receptor protein 0.0008 0.002 0.0023
Brugia malayi Melatonin receptor type 1A 0.0008 0.002 0.0023
Loa Loa (eye worm) hypothetical protein 0.0008 0.002 0.0023
Echinococcus multilocularis g-protein coupled receptor 0.0008 0.002 0.002
Schistosoma mansoni biogenic amine receptor 0.0008 0.002 0.0023
Plasmodium vivax hypothetical protein, conserved 0.0035 0.0298 0.0073
Brugia malayi DIX domain containing protein 0.0009 0.0026 0.003
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0008 0.002 0.0023
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0055 0.0504 0.0504
Schistosoma mansoni peptide (allatostatin/somatostatin)-like receptor 0.0008 0.002 0.0023
Echinococcus multilocularis tachykinin peptides receptor 99D 0.0008 0.002 0.002
Echinococcus granulosus growth hormone secretagogue receptor type 1 0.0008 0.002 0.0023
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0055 0.0504 0.0583
Echinococcus granulosus rhodopsin orphan GPCR 0.0008 0.002 0.0023
Loa Loa (eye worm) hypothetical protein 0.0008 0.002 0.0023
Onchocerca volvulus 0.0029 0.0236 0.102
Echinococcus multilocularis neuropeptide receptor 0.0008 0.002 0.002
Trichomonas vaginalis esterase, putative 0.0035 0.0298 0.1287
Brugia malayi ORL1-like opioid receptor 0.0008 0.002 0.0023
Echinococcus multilocularis tm gpcr rhodopsin gpcr rhodopsin superfamily 0.0008 0.002 0.002
Onchocerca volvulus 0.0008 0.002 0.0088
Echinococcus granulosus regulator of G protein signaling 7 0.0009 0.0026 0.003
Loa Loa (eye worm) Smad1 0.0008 0.0018 0.0021
Mycobacterium ulcerans hypothetical protein 0.0035 0.0298 0.5
Loa Loa (eye worm) hypothetical protein 0.0008 0.002 0.0023
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0008 0.002 0.0023
Schistosoma mansoni neuropeptide F-like receptor 0.0008 0.002 0.0023
Brugia malayi Unidentified vitellogenin-linked transcript protein 6, putative 0.0008 0.002 0.0023
Brugia malayi Dopamine receptor protein 1 0.0008 0.002 0.0023
Schistosoma mansoni myosin xvIII 0.0008 0.002 0.0023
Schistosoma mansoni alpha-1 adrenergic receptor 0.0008 0.002 0.0023
Schistosoma mansoni z-protein (S1r protein) 0.0009 0.0026 0.003
Loa Loa (eye worm) hypothetical protein 0.0008 0.002 0.0023
Echinococcus granulosus pyroglutamylated rfamide peptide receptor 0.0008 0.002 0.0023
Loa Loa (eye worm) neuropeptide F receptor 0.0008 0.002 0.0023
Loa Loa (eye worm) hypothetical protein 0.0008 0.002 0.0023
Schistosoma mansoni dep domain containing protein 0.0009 0.0026 0.003
Entamoeba histolytica Ras guanine nucleotide exchange factor, putative 0.0006 0 0.5
Brugia malayi regulator of G-protein signaling egl-10 0.0009 0.0026 0.003
Loa Loa (eye worm) hypothetical protein 0.0008 0.002 0.0023
Echinococcus granulosus neuropeptide receptor 0.0008 0.002 0.0023
Echinococcus multilocularis segment polarity protein dishevelled 0.0009 0.0026 0.0026
Brugia malayi hypothetical protein 0.0008 0.002 0.0023
Schistosoma mansoni histone-lysine n-methyltransferase suv9 0.0029 0.0236 0.0273
Echinococcus multilocularis rhodopsin orphan GPCR 0.0008 0.002 0.002
Echinococcus multilocularis fmrfamide receptor 0.0008 0.002 0.002
Echinococcus multilocularis rhodopsin orphan GPCR 0.0008 0.002 0.002
Loa Loa (eye worm) hypothetical protein 0.0008 0.002 0.0023
Toxoplasma gondii ABC1 family protein 0.0035 0.0298 0.0315
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0029 0.0236 0.0273
Brugia malayi neuropeptide F receptor 0.0008 0.002 0.0023
Echinococcus multilocularis geminin 0.0205 0.2039 0.2039
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0008 0.002 0.0023
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0055 0.0504 0.0504
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0008 0.002 0.0023
Echinococcus granulosus somatostatin receptor 0.0008 0.002 0.0023
Brugia malayi hypothetical protein 0.0008 0.002 0.0023
Loa Loa (eye worm) hypothetical protein 0.0008 0.002 0.0023
Schistosoma mansoni neuropeptide receptor 0.0008 0.002 0.0023
Loa Loa (eye worm) hypothetical protein 0.0008 0.002 0.0023
Echinococcus granulosus alpha 1A adrenergic receptor 0.0008 0.002 0.0023
Brugia malayi gonadotropin-releasing hormone receptor 2 0.0008 0.002 0.0023
Loa Loa (eye worm) hypothetical protein 0.0035 0.0298 0.0344
Entamoeba histolytica Ras guanine nucleotide exchange factor, putative 0.0006 0 0.5
Mycobacterium ulcerans beta-lactamase 0.0035 0.0298 0.5
Schistosoma mansoni muscarinic acetylcholine (GAR) receptor 0.0008 0.002 0.0023
Loa Loa (eye worm) hypothetical protein 0.0008 0.002 0.0023
Schistosoma mansoni opsin-like receptor 0.0008 0.002 0.0023
Loa Loa (eye worm) hypothetical protein 0.0008 0.002 0.0023
Brugia malayi MH2 domain containing protein 0.0008 0.0018 0.0021
Echinococcus multilocularis neuropeptide FF receptor 2 0.0008 0.002 0.002
Mycobacterium ulcerans esterase/lipase LipP 0.0035 0.0298 0.5
Echinococcus multilocularis serotonin receptor 0.0008 0.002 0.002
Brugia malayi hypothetical protein 0.0008 0.002 0.0023
Loa Loa (eye worm) hypothetical protein 0.0008 0.002 0.0023
Echinococcus granulosus 7TM GPCR rhodopsin 0.0008 0.002 0.0023
Loa Loa (eye worm) hypothetical protein 0.0008 0.002 0.0023
Brugia malayi Serotonin/octopamine receptor family protein 7 0.0008 0.002 0.0023
Brugia malayi MH2 domain containing protein 0.0117 0.1134 0.1311
Echinococcus granulosus hypothetical protein 0.0008 0.002 0.0023
Onchocerca volvulus 0.0008 0.002 0.0088
Schistosoma mansoni hypothetical protein 0.0008 0.002 0.0023
Loa Loa (eye worm) hypothetical protein 0.0008 0.002 0.0023
Loa Loa (eye worm) hypothetical protein 0.0008 0.002 0.0023
Trichomonas vaginalis D-aminoacylase, putative 0.0035 0.0298 0.1287
Schistosoma mansoni hypothetical protein 0.0205 0.2039 0.2358
Echinococcus multilocularis regulator of G protein signaling 7 0.0009 0.0026 0.0026
Loa Loa (eye worm) beta-lactamase 0.0035 0.0298 0.0344
Echinococcus granulosus sex peptide receptor 0.0008 0.002 0.0023
Schistosoma mansoni smad 0.0008 0.0018 0.0021
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0008 0.002 0.0023
Loa Loa (eye worm) hypothetical protein 0.0008 0.002 0.0023
Entamoeba histolytica Ras guanine nucleotide exchange factor, putative 0.0006 0 0.5
Trichomonas vaginalis penicillin-binding protein, putative 0.0035 0.0298 0.1287
Echinococcus multilocularis growth hormone secretagogue receptor type 1 0.0008 0.002 0.002
Echinococcus granulosus tm gpcr rhodopsin 0.0008 0.002 0.0023
Onchocerca volvulus 0.0008 0.002 0.0088
Echinococcus multilocularis somatostatin receptor 0.0008 0.002 0.002
Brugia malayi Domain found in Dishevelled, Egl-10, and Pleckstrin family protein 0.0009 0.0026 0.003
Onchocerca volvulus 0.0008 0.002 0.0088
Schistosoma mansoni biogenic amine receptor 0.0008 0.002 0.0023
Schistosoma mansoni biogenic amine (dopamine) receptor 0.0008 0.002 0.0023
Brugia malayi hypothetical protein 0.0008 0.002 0.0023
Echinococcus granulosus TGF beta signal transducer SmadC 0.0008 0.0018 0.0021
Loa Loa (eye worm) hypothetical protein 0.0008 0.002 0.0023
Loa Loa (eye worm) hypothetical protein 0.0008 0.002 0.0023
Loa Loa (eye worm) hypothetical protein 0.0008 0.002 0.0023
Entamoeba histolytica Ras guanine nucleotide exchange factor, putative 0.0006 0 0.5
Echinococcus multilocularis neuropeptide receptor 0.0008 0.002 0.002
Schistosoma mansoni hypothetical protein 0.0008 0.002 0.0023
Brugia malayi Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative 0.0035 0.0298 0.0344
Schistosoma mansoni hypothetical protein 0.0008 0.002 0.0023
Schistosoma mansoni Smad4 0.0008 0.0018 0.0021
Onchocerca volvulus Dopamine\/Ecdysteroid receptor homolog 0.0008 0.002 0.0088
Echinococcus multilocularis histone lysine methyltransferase setb histone lysine methyltransferase eggless 0.0029 0.0236 0.0236
Echinococcus granulosus 7tm_1 domain containing protein 0.0008 0.002 0.0023
Loa Loa (eye worm) pre-SET domain-containing protein family protein 0.0203 0.2024 0.234
Echinococcus multilocularis allatostatin A receptor 0.0008 0.002 0.002
Onchocerca volvulus 0.0009 0.0026 0.0111
Echinococcus multilocularis neuropeptides capa receptor 0.0008 0.002 0.002
Echinococcus multilocularis dro:myosuppressin receptor 0.0008 0.002 0.002
Brugia malayi putative neuropeptide receptor NPR1 0.0008 0.002 0.0023
Wolbachia endosymbiont of Brugia malayi cytochrome b subunit of the bc complex 0.0848 0.8651 0.5
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0055 0.0504 0.0583
Loa Loa (eye worm) hypothetical protein 0.0008 0.002 0.0023
Toxoplasma gondii histone lysine methyltransferase SET/SUV39 0.0029 0.0236 0.0244
Echinococcus multilocularis rhodopsin orphan GPCR 0.0008 0.002 0.002
Onchocerca volvulus 0.0008 0.002 0.0088
Brugia malayi G protein-coupled receptor F59B2.13 0.0008 0.002 0.0023
Brugia malayi hypothetical protein 0.0009 0.0026 0.003
Loa Loa (eye worm) MH2 domain-containing protein 0.0117 0.1134 0.1311
Schistosoma mansoni peptide (FMRFamide/somatostatin)-like receptor 0.0008 0.002 0.0023
Brugia malayi beta-lactamase family protein 0.0035 0.0298 0.0344
Echinococcus granulosus tm gpcr rhodopsin 0.0008 0.002 0.0023
Loa Loa (eye worm) hypothetical protein 0.0035 0.0298 0.0344
Loa Loa (eye worm) hypothetical protein 0.0008 0.002 0.0023
Entamoeba histolytica Ras guanine nucleotide exchange factor, putative 0.0006 0 0.5
Schistosoma mansoni histamine h1 receptor 0.0008 0.002 0.0023
Echinococcus granulosus orexin receptor type 2 0.0008 0.002 0.0023
Schistosoma mansoni neuropeptide receptor 0.0008 0.002 0.0023
Schistosoma mansoni biogenic amine receptor 0.0008 0.002 0.0023
Loa Loa (eye worm) transcription factor SMAD2 0.0117 0.1134 0.1311
Echinococcus granulosus tm gpcr rhodopsin 0.0008 0.002 0.0023
Loa Loa (eye worm) hypothetical protein 0.0008 0.002 0.0023
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0055 0.0504 0.0583
Loa Loa (eye worm) beta-LACTamase domain containing family member 0.0035 0.0298 0.0344
Onchocerca volvulus 0.0008 0.002 0.0088
Brugia malayi neuropeptide F receptor 0.0008 0.002 0.0023
Echinococcus granulosus 5'partial|histone lysine N methyltransferase SETDB2 0.0028 0.0225 0.026
Echinococcus granulosus tachykinin peptides receptor 99D 0.0008 0.002 0.0023
Echinococcus granulosus rhodopsin orphan GPCR 0.0008 0.002 0.0023
Schistosoma mansoni ancient conserved domain protein 2 (cyclin m2) 0.0008 0.002 0.0023
Schistosoma mansoni cytochrome b 0.0848 0.8651 1
Echinococcus multilocularis Smad4 0.0008 0.0018 0.0018
Schistosoma mansoni amine GPCR 0.0008 0.002 0.0023
Echinococcus multilocularis g protein linked acetylcholine receptor gar 2a 0.0008 0.002 0.002
Loa Loa (eye worm) hypothetical protein 0.0008 0.002 0.0023
Echinococcus multilocularis g protein coupled receptor 0.0008 0.002 0.002
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0035 0.0298 0.0344
Loa Loa (eye worm) hypothetical protein 0.0008 0.002 0.0023
Echinococcus multilocularis pyroglutamylated rfamide peptide receptor 0.0008 0.002 0.002
Trypanosoma cruzi hypothetical protein, conserved 0.0035 0.0298 1
Schistosoma mansoni amine GPCR 0.0008 0.002 0.0023
Onchocerca volvulus 0.0035 0.0298 0.1287
Echinococcus granulosus biogenic amine 5HT receptor 0.0008 0.002 0.0023
Echinococcus multilocularis tm gpcr rhodopsin gpcr rhodopsin superfamily 0.0008 0.002 0.002
Mycobacterium ulcerans lipase LipD 0.0035 0.0298 0.5
Loa Loa (eye worm) hypothetical protein 0.0008 0.002 0.0023
Schistosoma mansoni cytochrome b 0.0848 0.8651 1
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0008 0.002 0.0023
Trichomonas vaginalis penicillin-binding protein, putative 0.0035 0.0298 0.1287
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0008 0.002 0.0023
Loa Loa (eye worm) hypothetical protein 0.0008 0.002 0.0023
Brugia malayi Dopamine receptor protein 2 0.0008 0.002 0.0023
Loa Loa (eye worm) DIX domain-containing protein 0.0009 0.0026 0.003
Schistosoma mansoni dishevelled 0.0009 0.0026 0.003
Brugia malayi Tachykinin-like peptides receptor 99D 0.0008 0.002 0.0023
Loa Loa (eye worm) hypothetical protein 0.0008 0.002 0.0023
Onchocerca volvulus 0.0231 0.2312 1
Entamoeba histolytica Ras guanine nucleotide exchange factor, putative 0.0006 0 0.5
Onchocerca volvulus 0.0008 0.002 0.0088
Brugia malayi Domain found in Dishevelled, Egl-10, and Pleckstrin family protein 0.0009 0.0026 0.003
Echinococcus multilocularis G protein coupled 5 hydroxytryptamine receptor 0.0008 0.002 0.002
Schistosoma mansoni growth hormone secretagogue receptor 0.0008 0.002 0.0023
Brugia malayi hypothetical protein 0.0008 0.002 0.0023
Schistosoma mansoni biogenic amine (dopamine) receptor 0.0008 0.002 0.0023
Schistosoma mansoni peptide (allatostatin)-like receptor 0.0008 0.002 0.0023
Schistosoma mansoni fyve finger-containing phosphoinositide kinase fyv1 0.0009 0.0026 0.003
Brugia malayi follicle stimulating hormone receptor 0.0008 0.002 0.0023
Echinococcus multilocularis rhodopsin orphan GPCR 0.0008 0.002 0.002
Loa Loa (eye worm) hypothetical protein 0.0008 0.002 0.0023
Loa Loa (eye worm) cytochrome b 0.0848 0.8651 1
Echinococcus granulosus neuropeptide Y receptor 0.0008 0.002 0.0023
Echinococcus granulosus segment polarity protein dishevelled 0.0009 0.0026 0.003
Echinococcus granulosus rhodopsin orphan GPCR 0.0008 0.002 0.0023
Loa Loa (eye worm) 5-hydroxytryptamine 2C receptor 0.0008 0.002 0.0023
Echinococcus multilocularis regulator of G protein signaling 7 0.0009 0.0026 0.0026
Echinococcus multilocularis beta LACTamase domain containing family member 0.0035 0.0298 0.0298
Loa Loa (eye worm) hypothetical protein 0.0029 0.0236 0.0273
Echinococcus multilocularis orexin receptor type 2 0.0008 0.002 0.002
Echinococcus granulosus histone lysine methyltransferase setb 0.0029 0.0236 0.0273
Trichomonas vaginalis set domain proteins, putative 0.0231 0.2312 1
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0055 0.0504 0.0583
Echinococcus granulosus beta LACTamase domain containing family member 0.0035 0.0298 0.0344
Brugia malayi MH2 domain containing protein 0.0008 0.0018 0.0021
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0029 0.0236 0.0273
Brugia malayi N-terminal motif family protein 0.0176 0.1747 0.202
Loa Loa (eye worm) G-protein coupled receptor 0.0008 0.002 0.0023
Brugia malayi putative neuropeptide receptor 0.0008 0.002 0.0023
Echinococcus multilocularis neuropeptide Y receptor 0.0008 0.002 0.002
Schistosoma mansoni opsin-like receptor 0.0008 0.002 0.0023
Schistosoma mansoni adenoreceptor 0.0008 0.002 0.0023
Plasmodium falciparum cytochrome b 0.0848 0.8651 0.5
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0055 0.0504 0.0583
Loa Loa (eye worm) hypothetical protein 0.0008 0.002 0.0023
Echinococcus multilocularis fmrfamide receptor 0.0008 0.002 0.002
Loa Loa (eye worm) hypothetical protein 0.0008 0.002 0.0023
Echinococcus granulosus neuropeptide Y receptor 0.0008 0.002 0.0023
Mycobacterium leprae Probable lipase LipE 0.0035 0.0298 0.5
Echinococcus granulosus Smad4 0.0008 0.0018 0.0021
Brugia malayi G-protein coupled receptor 0.0008 0.002 0.0023
Brugia malayi AKH receptor 0.0008 0.002 0.0023
Echinococcus granulosus rhodopsin orphan GPCR 0.0008 0.002 0.0023
Echinococcus granulosus G protein coupled receptor 139 0.0008 0.002 0.0023
Schistosoma mansoni smad1 5 8 and 0.0008 0.0018 0.0021
Echinococcus granulosus neuropeptide FF receptor 2 0.0008 0.002 0.0023
Echinococcus granulosus smad 0.0008 0.0018 0.0021
Echinococcus granulosus G protein coupled 5 hydroxytryptamine receptor 0.0008 0.002 0.0023
Loa Loa (eye worm) hypothetical protein 0.0008 0.002 0.0023
Echinococcus granulosus neuropeptide s receptor 0.0008 0.002 0.0023
Onchocerca volvulus 0.0008 0.002 0.0088
Brugia malayi G-protein coupled receptor 0.0008 0.002 0.0023
Brugia malayi Dopamine receptor 0.0008 0.002 0.0023
Echinococcus granulosus segment polarity protein dishevelled 0.0009 0.0026 0.003
Echinococcus multilocularis mothers against decapentaplegic 5 0.0008 0.0018 0.0018
Loa Loa (eye worm) G protein signaling regulator EGL-10 0.0009 0.0026 0.003
Loa Loa (eye worm) hypothetical protein 0.0009 0.0026 0.003
Entamoeba histolytica Ras guanine nucleotide exchange factor, putative 0.0006 0 0.5
Loa Loa (eye worm) hypothetical protein 0.0008 0.002 0.0023
Echinococcus multilocularis segment polarity protein dishevelled 0.0009 0.0026 0.0026
Brugia malayi hypothetical protein 0.0008 0.002 0.0023
Echinococcus multilocularis Pleckstrin G protein, interacting region 0.0009 0.0026 0.0026
Loa Loa (eye worm) hypothetical protein 0.0008 0.002 0.0023
Echinococcus multilocularis serotonin receptor 0.0008 0.002 0.002
Loa Loa (eye worm) hypothetical protein 0.0009 0.0026 0.003
Loa Loa (eye worm) hypothetical protein 0.0482 0.4889 0.5652
Entamoeba histolytica Ras guanine nucleotide exchange factor, putative 0.0006 0 0.5
Onchocerca volvulus 0.0008 0.002 0.0088
Echinococcus granulosus fmrfamide receptor 0.0008 0.002 0.0023
Schistosoma mansoni TGF-beta signal transducer Smad2 0.0008 0.0018 0.0021
Echinococcus multilocularis 7TM GPCR, rhodopsin 0.0008 0.002 0.002
Loa Loa (eye worm) follicle stimulating hormone receptor 0.0008 0.002 0.0023
Echinococcus granulosus allatostatin A receptor 0.0008 0.002 0.0023
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0055 0.0504 0.0583
Brugia malayi Dopamine receptor protein 1, putative (partial) 0.0008 0.002 0.0023
Schistosoma mansoni neuropeptide receptor 0.0008 0.002 0.0023
Loa Loa (eye worm) hypothetical protein 0.0176 0.1747 0.202
Schistosoma mansoni regulator of G protein signaling 0.0009 0.0026 0.003
Entamoeba histolytica hypothetical protein 0.0006 0 0.5
Leishmania major hypothetical protein, conserved 0.0035 0.0298 0.5
Entamoeba histolytica Ras guanine nucleotide exchange factor, putative 0.0006 0 0.5
Echinococcus granulosus Pleckstrin G protein interacting region 0.0009 0.0026 0.003
Brugia malayi hypothetical protein 0.0008 0.002 0.0023
Echinococcus multilocularis rhodopsin orphan GPCR 0.0008 0.002 0.002
Schistosoma mansoni hypothetical protein 0.0205 0.2039 0.2358
Loa Loa (eye worm) neuropeptide F receptor 0.0008 0.002 0.0023
Echinococcus granulosus g protein coupled receptor 0.0008 0.002 0.0023
Loa Loa (eye worm) G-protein-linked acetylcholine receptor protein 2 0.0008 0.002 0.0023
Echinococcus granulosus peptide allatostatin:somatostatin 0.0008 0.002 0.0023
Schistosoma mansoni biogenic amine (5HT) receptor 0.0008 0.002 0.0023
Loa Loa (eye worm) hypothetical protein 0.0035 0.0298 0.0344
Schistosoma mansoni amine GPCR 0.0008 0.002 0.0023
Loa Loa (eye worm) MH2 domain-containing protein 0.0008 0.0018 0.0021
Echinococcus granulosus biogenic amine 5HT receptor 0.0008 0.002 0.0023
Loa Loa (eye worm) hypothetical protein 0.0008 0.002 0.0023
Brugia malayi larval opioid receptor 0.0008 0.002 0.0023
Echinococcus granulosus geminin 0.0205 0.2039 0.2358
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0008 0.002 0.0023
Loa Loa (eye worm) hypothetical protein 0.0008 0.002 0.0023
Echinococcus multilocularis thyrotropin releasing hormone receptor 0.0008 0.002 0.002
Echinococcus granulosus rhodopsin orphan GPCR 0.0008 0.002 0.0023
Onchocerca volvulus Rap guanine nucleotide exchange factor 1 homolog 0.0176 0.1747 0.7556
Echinococcus multilocularis histone lysine N methyltransferase SETMAR 0.0029 0.0236 0.0236
Brugia malayi RE15519p 0.0008 0.002 0.0023
Echinococcus granulosus neuropeptide receptor A26 0.0008 0.002 0.0023
Echinococcus multilocularis rhodopsin orphan GPCR 0.0008 0.002 0.002
Echinococcus multilocularis neuropeptides capa receptor 0.0008 0.002 0.002
Brugia malayi Serotonin receptor 0.0008 0.002 0.0023
Schistosoma mansoni amine GPCR 0.0008 0.002 0.0023
Echinococcus granulosus serotonin receptor 0.0008 0.002 0.0023
Echinococcus multilocularis rhodopsin orphan GPCR 0.0008 0.002 0.002
Onchocerca volvulus 0.0008 0.002 0.0088
Onchocerca volvulus Neuropeptide F receptor homolog 0.0008 0.002 0.0088
Brugia malayi beta-lactamase 0.0035 0.0298 0.0344
Loa Loa (eye worm) hypothetical protein 0.0035 0.0298 0.0344
Echinococcus granulosus dro:myosuppressin receptor 0.0008 0.002 0.0023
Echinococcus multilocularis g protein coupled receptor 0.0008 0.002 0.002
Trichomonas vaginalis D-aminoacylase, putative 0.0035 0.0298 0.1287
Echinococcus granulosus g protein coupled receptor 0.0008 0.002 0.0023
Echinococcus multilocularis biogenic amine (5HT) receptor 0.0008 0.002 0.002
Brugia malayi MH1 domain containing protein 0.0008 0.0018 0.0021
Echinococcus multilocularis g protein coupled receptor 0.0008 0.002 0.002
Onchocerca volvulus 0.0008 0.002 0.0088
Echinococcus granulosus thyrotropin releasing hormone receptor 0.0008 0.002 0.0023
Echinococcus multilocularis sex peptide receptor 0.0008 0.002 0.002
Echinococcus granulosus cytochrome B 0.0848 0.8651 1
Trypanosoma cruzi hypothetical protein, conserved 0.0035 0.0298 1
Loa Loa (eye worm) MH1 domain-containing protein 0.0008 0.0018 0.0021
Brugia malayi MH1 domain containing protein 0.0008 0.0018 0.0021
Loa Loa (eye worm) hypothetical protein 0.0009 0.0026 0.003
Schistosoma mansoni peptide (FMRFamide/neurokinin-3)-like receptor 0.0008 0.002 0.0023
Echinococcus multilocularis G-protein coupled receptor, putative 0.0008 0.002 0.002
Brugia malayi cytochrome b 0.0848 0.8651 1
Echinococcus granulosus g protein linked acetylcholine receptor gar 2a 0.0008 0.002 0.0023
Schistosoma mansoni opsin-like receptor 0.0008 0.002 0.0023
Mycobacterium tuberculosis Possible penicillin-binding protein 0.0225 0.2244 1
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0035 0.0298 0.0344
Loa Loa (eye worm) melatonin receptor type 1A 0.0008 0.002 0.0023
Loa Loa (eye worm) hypothetical protein 0.0008 0.002 0.0023
Echinococcus granulosus neuropeptides capa receptor 0.0008 0.002 0.0023
Loa Loa (eye worm) hypothetical protein 0.0008 0.002 0.0023
Onchocerca volvulus 0.0008 0.002 0.0088
Schistosoma mansoni thyrotropin-releasing hormone receptor 0.0008 0.002 0.0023
Brugia malayi Pre-SET motif family protein 0.0203 0.2024 0.234
Brugia malayi beta-lactamase family protein 0.0035 0.0298 0.0344
Trichomonas vaginalis D-aminoacylase, putative 0.0035 0.0298 0.1287
Echinococcus granulosus g protein linked acetylcholine receptor gar 2a 0.0008 0.002 0.0023
Entamoeba histolytica Ras guanine nucleotide exchange factor, putative 0.0006 0 0.5

Activities

Activity type Activity value Assay description Source Reference
Potency (functional) 0.1299 uM PUBCHEM_BIOASSAY: qHTS screen for small molecules that inhibit ELG1-dependent DNA repair in human embryonic kidney (HEK293T) cells expressing luciferase-tagged ELG1. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID493107, AID493125] ChEMBL. No reference
Potency (functional) 4.1475 uM PUBCHEM_BIOASSAY: Primary qHTS for delayed death inhibitors of the malarial parasite plastid, 96 hour incubation. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488745, AID488752, AID488774, AID504848, AID504850] ChEMBL. No reference
Potency (functional) 25.1189 uM PubChem BioAssay. Inhibitors of USP1/UAF1: Primary Screen. (Class of assay: confirmatory) ChEMBL. No reference

Phenotypes

Whole-cell/tissue/organism interactions

Species name Source Reference Is orphan
Plasmodium falciparum ChEMBL23

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.
 
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External resources for this compound

Bibliographic References

No literature references available for this target.

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