Detailed information for compound 1390133

Basic information

Technical information
  • TDR Targets ID: 1390133
  • Name: N'-(adamantane-1-carbonyl)pyrazine-2-carbohyd razide
  • MW: 300.356 | Formula: C16H20N4O2
  • H donors: 2 H acceptors: 4 LogP: 1.48 Rotable bonds: 5
    Rule of 5 violations (Lipinski): 1
  • SMILES: O=C(c1nccnc1)NNC(=O)C12CC3CC(C2)CC(C1)C3
  • InChi: 1S/C16H20N4O2/c21-14(13-9-17-1-2-18-13)19-20-15(22)16-6-10-3-11(7-16)5-12(4-10)8-16/h1-2,9-12H,3-8H2,(H,19,21)(H,20,22)
  • InChiKey: MRLKXHSOWPMBFD-UHFFFAOYSA-N  

Network

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Synonyms

  • N'-(1-adamantyl-oxomethyl)-2-pyrazinecarbohydrazide
  • N'-(adamantane-1-carbonyl)pyrazinohydrazide
  • N'-(1-adamantylcarbonyl)pyrazine-2-carbohydrazide
  • Adamantane-1-carboxylic acid N'-(pyrazine-2-carbonyl)-hydrazide
  • MLS000564012
  • SMR000176643
  • BAS 01206986
  • ZINC04893467

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Mus musculus RAR-related orphan receptor gamma Starlite/ChEMBL No references
Homo sapiens euchromatic histone-lysine N-methyltransferase 2 Starlite/ChEMBL No references
Homo sapiens lamin A/C Starlite/ChEMBL No references
Homo sapiens GNAS complex locus Starlite/ChEMBL No references
Human immunodeficiency virus 1 Aberrant vpr protein Starlite/ChEMBL No references
Homo sapiens huntingtin Starlite/ChEMBL No references

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Loa Loa (eye worm) pre-SET domain-containing protein family protein Get druggable targets OG5_131470 All targets in OG5_131470
Schistosoma japonicum expressed protein Get druggable targets OG5_128723 All targets in OG5_128723
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_128723 All targets in OG5_128723
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_128723 All targets in OG5_128723
Brugia malayi Pre-SET motif family protein Get druggable targets OG5_131470 All targets in OG5_131470
Echinococcus multilocularis cytoplasmic intermediate filament protein Get druggable targets OG5_128723 All targets in OG5_128723
Echinococcus granulosus guanine nucleotide binding protein Gs subunit Get druggable targets OG5_131088 All targets in OG5_131088
Schistosoma mansoni intermediate filament proteins Get druggable targets OG5_128723 All targets in OG5_128723
Schistosoma japonicum expressed protein Get druggable targets OG5_128723 All targets in OG5_128723
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_128723 All targets in OG5_128723
Echinococcus granulosus lamin dm0 Get druggable targets OG5_128723 All targets in OG5_128723
Onchocerca volvulus Get druggable targets OG5_128723 All targets in OG5_128723
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative Get druggable targets OG5_131088 All targets in OG5_131088
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_132837 All targets in OG5_132837
Brugia malayi hypothetical protein Get druggable targets OG5_132837 All targets in OG5_132837
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) Get druggable targets OG5_131088 All targets in OG5_131088
Echinococcus granulosus guanine nucleotide binding protein Gs subunit Get druggable targets OG5_131088 All targets in OG5_131088
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_132837 All targets in OG5_132837
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit Get druggable targets OG5_131088 All targets in OG5_131088
Schistosoma mansoni lamin Get druggable targets OG5_128723 All targets in OG5_128723
Echinococcus granulosus lamin Get druggable targets OG5_128723 All targets in OG5_128723
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) Get druggable targets OG5_131088 All targets in OG5_131088
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit Get druggable targets OG5_131088 All targets in OG5_131088
Schistosoma japonicum ko:K07611 lamin, putative Get druggable targets OG5_128723 All targets in OG5_128723
Schistosoma japonicum ko:K04632 guanine nucleotide binding protein (G protein), alpha stimulating, putative Get druggable targets OG5_131088 All targets in OG5_131088
Schistosoma japonicum Intermediate filament protein ifa-1, putative Get druggable targets OG5_128723 All targets in OG5_128723
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) Get druggable targets OG5_131088 All targets in OG5_131088
Brugia malayi Intermediate filament tail domain containing protein Get druggable targets OG5_128723 All targets in OG5_128723
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_128723 All targets in OG5_128723
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain Get druggable targets OG5_131088 All targets in OG5_131088
Schistosoma japonicum Lamin-C, putative Get druggable targets OG5_128723 All targets in OG5_128723
Schistosoma mansoni lamin Get druggable targets OG5_128723 All targets in OG5_128723
Echinococcus granulosus intermediate filament protein Get druggable targets OG5_128723 All targets in OG5_128723
Onchocerca volvulus Get druggable targets OG5_131470 All targets in OG5_131470
Loa Loa (eye worm) intermediate filament tail domain-containing protein Get druggable targets OG5_128723 All targets in OG5_128723
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_128723 All targets in OG5_128723
Echinococcus multilocularis lamin dm0 Get druggable targets OG5_128723 All targets in OG5_128723
Onchocerca volvulus Huntingtin homolog Get druggable targets OG5_132837 All targets in OG5_132837
Loa Loa (eye worm) intermediate filament protein Get druggable targets OG5_128723 All targets in OG5_128723
Echinococcus granulosus cytoplasmic intermediate filament protein Get druggable targets OG5_128723 All targets in OG5_128723
Onchocerca volvulus Get druggable targets OG5_128723 All targets in OG5_128723
Trichomonas vaginalis set domain proteins, putative Get druggable targets OG5_131470 All targets in OG5_131470
Brugia malayi intermediate filament protein Get druggable targets OG5_128723 All targets in OG5_128723
Echinococcus multilocularis lamin Get druggable targets OG5_128723 All targets in OG5_128723
Onchocerca volvulus Huntingtin homolog Get druggable targets OG5_132837 All targets in OG5_132837
Echinococcus multilocularis musashi Get druggable targets OG5_128723 All targets in OG5_128723

By sequence similarity to non orthologous known druggable targets
Species Potential target Known druggable target Length Alignment span Identity
Schistosoma mansoni GTP-binding protein alpha subunit gna GNAS complex locus 394 aa 450 aa 28.7 %

Obtained from network model

Ranking Plot


Putative Targets List


Species Potential target Raw Global Species
Brugia malayi hypothetical protein 0.003 0.0145 0.0131
Loa Loa (eye worm) G-protein coupled receptor 0.003 0.0145 0.0131
Loa Loa (eye worm) hypothetical protein 0.003 0.0145 0.0131
Onchocerca volvulus 0.0286 0.3276 1
Plasmodium falciparum phd finger protein, putative 0.0035 0.0205 1
Echinococcus multilocularis geminin 0.0205 0.2279 0.2269
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0036 0.0215 0.0216
Brugia malayi hypothetical protein 0.002 0.0014 0.0001
Echinococcus multilocularis jumonji domain containing protein 0.0049 0.0374 0.0361
Echinococcus granulosus dro:myosuppressin receptor 0.003 0.0145 0.0131
Onchocerca volvulus Huntingtin homolog 0.0148 0.1585 0.46
Brugia malayi neuropeptide F receptor 0.003 0.0145 0.0131
Schistosoma mansoni peptide (FMRFamide/neurokinin-3)-like receptor 0.003 0.0145 0.0145
Echinococcus granulosus tm gpcr rhodopsin 0.003 0.0145 0.0131
Brugia malayi Pre-SET motif family protein 0.0251 0.2851 0.2842
Schistosoma mansoni thyrotropin-releasing hormone receptor 0.003 0.0145 0.0145
Loa Loa (eye worm) hypothetical protein 0.003 0.0145 0.0131
Schistosoma mansoni opsin-like receptor 0.003 0.0145 0.0145
Echinococcus granulosus rhodopsin orphan GPCR 0.003 0.0145 0.0131
Echinococcus granulosus neuropeptide Y receptor 0.003 0.0145 0.0131
Loa Loa (eye worm) hypothetical protein 0.003 0.0145 0.0131
Echinococcus granulosus g protein coupled receptor 0.003 0.0145 0.0131
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0055 0.045 0.0437
Schistosoma mansoni methyl-cpg binding protein mbd 0.0021 0.0026 0.0026
Loa Loa (eye worm) hypothetical protein 0.003 0.0145 0.0131
Echinococcus granulosus rhodopsin orphan GPCR 0.003 0.0145 0.0131
Echinococcus multilocularis alpha 1A adrenergic receptor 0.003 0.0145 0.0131
Onchocerca volvulus Alhambra homolog 0.0035 0.0205 0.0192
Loa Loa (eye worm) bromodomain containing protein 0.0021 0.0035 0.0022
Loa Loa (eye worm) TYRA-2 protein 0.003 0.0145 0.0131
Echinococcus multilocularis tm gpcr rhodopsin gpcr rhodopsin superfamily 0.003 0.0145 0.0131
Brugia malayi hypothetical protein 0.003 0.0145 0.0131
Echinococcus granulosus G protein coupled receptor 139 0.003 0.0145 0.0131
Onchocerca volvulus 0.0036 0.0215 0.0225
Echinococcus granulosus neuropeptide receptor 0.003 0.0145 0.0131
Schistosoma mansoni amine GPCR 0.003 0.0145 0.0145
Echinococcus multilocularis zinc finger protein 0.0024 0.0063 0.005
Echinococcus multilocularis neuropeptide FF receptor 2 0.003 0.0145 0.0131
Schistosoma mansoni rhodopsin-like orphan GPCR 0.003 0.0145 0.0145
Echinococcus multilocularis G-protein coupled receptor, putative 0.003 0.0145 0.0131
Loa Loa (eye worm) hypothetical protein 0.003 0.0145 0.0131
Echinococcus multilocularis dro:myosuppressin receptor 0.003 0.0145 0.0131
Onchocerca volvulus 0.0033 0.0173 0.0089
Trypanosoma brucei mitochondrial DNA polymerase beta 0.0294 0.3375 0.8904
Treponema pallidum exodeoxyribonuclease (exoA) 0.002 0.0014 0.5
Schistosoma mansoni histone-lysine n-methyltransferase suv9 0.0036 0.0215 0.0216
Echinococcus granulosus lamin 0.0033 0.0173 0.0159
Plasmodium vivax hypothetical protein, conserved 0.0035 0.0205 0.9489
Loa Loa (eye worm) hypothetical protein 0.003 0.0145 0.0131
Brugia malayi putative neuropeptide receptor 0.003 0.0145 0.0131
Toxoplasma gondii PHD-finger domain-containing protein 0.0035 0.0205 0.3951
Trypanosoma cruzi mitochondrial DNA polymerase beta, putative 0.0294 0.3375 0.8904
Echinococcus multilocularis histone lysine methyltransferase setb histone lysine methyltransferase eggless 0.0057 0.0467 0.0454
Schistosoma mansoni microtubule-associated protein tau 0.0833 0.9978 1
Loa Loa (eye worm) hypothetical protein 0.003 0.0145 0.0131
Schistosoma mansoni biogenic amine (dopamine) receptor 0.003 0.0145 0.0145
Brugia malayi Unidentified vitellogenin-linked transcript protein 6, putative 0.003 0.0145 0.0131
Schistosoma mansoni growth hormone secretagogue receptor 0.003 0.0145 0.0145
Leishmania major malonyl-coa decarboxylase-like protein 0.0328 0.3791 1
Toxoplasma gondii hypothetical protein 0.0047 0.0355 0.7043
Trypanosoma cruzi DNA polymerase beta thumb, putative 0.0041 0.028 0.0739
Loa Loa (eye worm) hypothetical protein 0.003 0.0145 0.0131
Brugia malayi hypothetical protein 0.003 0.0146 0.0133
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0055 0.045 0.0437
Schistosoma mansoni bromodomain containing protein 0.0076 0.0709 0.0711
Trypanosoma cruzi apurinic/apyrimidinic endonuclease 0.002 0.0014 0.0036
Schistosoma mansoni methyl-cpg binding protein mbd 0.0021 0.0026 0.0026
Brugia malayi Intermediate filament tail domain containing protein 0.0033 0.0173 0.0159
Echinococcus multilocularis g protein coupled receptor 0.003 0.0145 0.0131
Echinococcus granulosus geminin 0.0205 0.2279 0.2269
Brugia malayi hypothetical protein 0.003 0.0145 0.0131
Echinococcus granulosus g protein coupled receptor 0.003 0.0145 0.0131
Onchocerca volvulus 0.0033 0.0173 0.0089
Loa Loa (eye worm) intermediate filament tail domain-containing protein 0.0033 0.0173 0.0159
Echinococcus granulosus fmrfamide receptor 0.003 0.0145 0.0131
Schistosoma mansoni acetyl-CoA C-acetyltransferase 0.0027 0.0107 0.0107
Schistosoma mansoni rhodopsin-like orphan GPCR 0.003 0.0145 0.0145
Schistosoma mansoni rhodopsin-like orphan GPCR 0.003 0.0145 0.0145
Echinococcus multilocularis fmrfamide receptor 0.003 0.0145 0.0131
Echinococcus multilocularis fmrfamide receptor 0.003 0.0145 0.0131
Mycobacterium tuberculosis Conserved hypothetical protein 0.0155 0.1671 1
Echinococcus granulosus bromodomain adjacent to zinc finger domain 0.0043 0.0305 0.0292
Brugia malayi G-protein-linked acetylcholine receptor protein 2, putative 0.003 0.0145 0.0131
Schistosoma mansoni biogenic amine (5HT) receptor 0.003 0.0145 0.0145
Loa Loa (eye worm) hypothetical protein 0.003 0.0145 0.0131
Loa Loa (eye worm) hypothetical protein 0.003 0.0145 0.0131
Schistosoma mansoni biogenic amine (dopamine) receptor 0.003 0.0145 0.0145
Echinococcus multilocularis allatostatin A receptor 0.003 0.0145 0.0131
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0055 0.045 0.0437
Echinococcus granulosus serotonin receptor 0.003 0.0145 0.0131
Echinococcus multilocularis g protein linked acetylcholine receptor gar 2a 0.003 0.0145 0.0131
Echinococcus multilocularis rhodopsin orphan GPCR 0.003 0.0145 0.0131
Schistosoma mansoni muscarinic acetylcholine (GAR) receptor 0.003 0.0145 0.0145
Schistosoma mansoni jumonji domain containing protein 0.0092 0.0895 0.0898
Echinococcus granulosus rhodopsin orphan GPCR 0.003 0.0145 0.0131
Echinococcus multilocularis rhodopsin orphan GPCR 0.003 0.0145 0.0131
Loa Loa (eye worm) hypothetical protein 0.003 0.0145 0.0131
Echinococcus multilocularis rhodopsin orphan GPCR 0.003 0.0145 0.0131
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0057 0.0467 0.0468
Echinococcus multilocularis G protein coupled 5 hydroxytryptamine receptor 0.003 0.0145 0.0131
Trypanosoma cruzi DNA polymerase beta thumb, putative 0.0041 0.028 0.0739
Loa Loa (eye worm) PHD-finger family protein 0.0025 0.0079 0.0065
Echinococcus multilocularis fetal alzheimer antigen, falz 0.0027 0.0107 0.0094
Brugia malayi Serotonin receptor 0.003 0.0145 0.0131
Schistosoma mansoni aldehyde dehydrogenase 0.0059 0.0498 0.0499
Onchocerca volvulus Huntingtin homolog 0.0148 0.1585 0.46
Echinococcus multilocularis rhodopsin orphan GPCR 0.003 0.0145 0.0131
Trypanosoma brucei PAB1-binding protein , putative 0.003 0.0146 0.0386
Echinococcus granulosus growth hormone secretagogue receptor type 1 0.003 0.0145 0.0131
Loa Loa (eye worm) hypothetical protein 0.0033 0.0173 0.0159
Echinococcus granulosus thyrotropin releasing hormone receptor 0.003 0.0145 0.0131
Schistosoma mansoni histamine-responsive GPCR (AAF21638) 0.003 0.0145 0.0145
Schistosoma mansoni amine GPCR 0.003 0.0145 0.0145
Loa Loa (eye worm) hypothetical protein 0.0148 0.1585 0.1574
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0055 0.045 0.0437
Loa Loa (eye worm) unidentified vitellogenin-linked transcript protein 6 0.003 0.0145 0.0131
Loa Loa (eye worm) hypothetical protein 0.003 0.0145 0.0131
Echinococcus multilocularis aldehyde dehydrogenase, mitochondrial 0.0059 0.0498 0.0485
Echinococcus granulosus neuropeptide Y receptor 0.003 0.0145 0.0131
Mycobacterium ulcerans aldehyde dehydrogenase 0.0059 0.0498 0.2923
Brugia malayi intermediate filament protein 0.0033 0.0173 0.0159
Echinococcus multilocularis g-protein coupled receptor 0.003 0.0145 0.0131
Schistosoma mansoni rhodopsin-like orphan GPCR 0.003 0.0145 0.0145
Loa Loa (eye worm) hypothetical protein 0.0049 0.0376 0.0363
Schistosoma mansoni biogenic amine receptor 0.003 0.0145 0.0145
Loa Loa (eye worm) neuropeptide F receptor 0.003 0.0145 0.0131
Echinococcus multilocularis neuropeptide receptor 0.003 0.0145 0.0131
Loa Loa (eye worm) hypothetical protein 0.003 0.0145 0.0131
Echinococcus multilocularis rhodopsin orphan GPCR 0.003 0.0145 0.0131
Echinococcus multilocularis microtubule associated protein 2 0.0833 0.9978 0.9978
Loa Loa (eye worm) hypothetical protein 0.003 0.0145 0.0131
Brugia malayi follicle stimulating hormone receptor 0.003 0.0145 0.0131
Loa Loa (eye worm) hypothetical protein 0.0148 0.1585 0.1574
Trypanosoma cruzi malonyl-CoA decarboxylase, mitochondrial precursor, putative 0.0328 0.3791 1
Loa Loa (eye worm) follicle stimulating hormone receptor 0.003 0.0145 0.0131
Echinococcus granulosus PHD finger protein rhinoceros 0.0035 0.0205 0.0192
Loa Loa (eye worm) hypothetical protein 0.003 0.0145 0.0131
Echinococcus granulosus methyl CpG binding domain protein 2 0.0021 0.0026 0.0012
Schistosoma mansoni hypothetical protein 0.0205 0.2279 0.2284
Echinococcus granulosus somatostatin receptor 0.003 0.0145 0.0131
Trypanosoma cruzi apurinic/apyrimidinic endonuclease, putative 0.002 0.0014 0.0036
Schistosoma mansoni amine GPCR 0.003 0.0145 0.0145
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0055 0.045 0.0437
Echinococcus granulosus hypothetical protein 0.003 0.0145 0.0131
Echinococcus granulosus aldehyde dehydrogenase mitochondrial 0.0059 0.0498 0.0485
Echinococcus multilocularis histone lysine N methyltransferase SETMAR 0.0036 0.0215 0.0202
Mycobacterium ulcerans hypothetical protein 0.0155 0.1671 1
Brugia malayi hypothetical protein 0.003 0.0145 0.0131
Loa Loa (eye worm) hypothetical protein 0.003 0.0145 0.0131
Echinococcus multilocularis neuropeptides capa receptor 0.003 0.0145 0.0131
Echinococcus multilocularis serotonin receptor 0.003 0.0145 0.0131
Brugia malayi jmjC domain containing protein 0.0045 0.0324 0.0311
Trypanosoma cruzi PAB1-binding protein , putative 0.003 0.0146 0.0386
Echinococcus granulosus microtubule associated protein 2 0.0833 0.9978 0.9978
Leishmania major mitochondrial DNA polymerase beta-PAK, putative 0.0139 0.1478 0.39
Echinococcus granulosus neuropeptides capa receptor 0.003 0.0145 0.0131
Loa Loa (eye worm) hypothetical protein 0.003 0.0145 0.0131
Loa Loa (eye worm) hypothetical protein 0.003 0.0145 0.0131
Brugia malayi ORL1-like opioid receptor 0.003 0.0145 0.0131
Loa Loa (eye worm) hypothetical protein 0.003 0.0145 0.0131
Brugia malayi AKH receptor 0.003 0.0145 0.0131
Echinococcus granulosus neuropeptides capa receptor 0.003 0.0145 0.0131
Loa Loa (eye worm) hypothetical protein 0.0057 0.0467 0.0455
Echinococcus granulosus lysine specific demethylase 5A 0.0045 0.0324 0.0311
Leishmania major mitochondrial DNA polymerase beta 0.0294 0.3375 0.8904
Echinococcus granulosus G protein coupled 5 hydroxytryptamine receptor 0.003 0.0145 0.0131
Trypanosoma brucei mitochondrial DNA polymerase beta-PAK 0.0139 0.1478 0.39
Schistosoma mansoni neuropeptide receptor 0.003 0.0145 0.0145
Schistosoma mansoni hypothetical protein 0.0205 0.2279 0.2284
Loa Loa (eye worm) gonadotropin-releasing hormone receptor 2 0.003 0.0145 0.0131
Trypanosoma cruzi mitochondrial DNA polymerase beta-PAK, putative 0.0041 0.028 0.0739
Schistosoma mansoni neuropeptide receptor 0.003 0.0145 0.0145
Echinococcus granulosus neuropeptide s receptor 0.003 0.0145 0.0131
Schistosoma mansoni rhodopsin-like orphan GPCR 0.003 0.0145 0.0145
Echinococcus granulosus g protein linked acetylcholine receptor gar 2a 0.003 0.0145 0.0131
Brugia malayi PHD-finger family protein 0.003 0.0142 0.0129
Loa Loa (eye worm) hypothetical protein 0.0085 0.082 0.0807
Echinococcus granulosus neuropeptide receptor A26 0.003 0.0145 0.0131
Brugia malayi Tachykinin-like peptides receptor 99D 0.003 0.0145 0.0131
Echinococcus granulosus alpha 1A adrenergic receptor 0.003 0.0145 0.0131
Echinococcus multilocularis PHD finger protein rhinoceros 0.0035 0.0205 0.0192
Loa Loa (eye worm) hypothetical protein 0.003 0.0145 0.0131
Schistosoma mansoni rhodopsin-like orphan GPCR 0.003 0.0145 0.0145
Echinococcus multilocularis peregrin 0.0038 0.024 0.0227
Brugia malayi PHD-finger family protein 0.0035 0.0205 0.0192
Loa Loa (eye worm) intermediate filament protein 0.0033 0.0173 0.0159
Echinococcus granulosus pyroglutamylated rfamide peptide receptor 0.003 0.0145 0.0131
Trypanosoma cruzi mitochondrial DNA polymerase beta, putative 0.0294 0.3375 0.8904
Echinococcus multilocularis orexin receptor type 2 0.003 0.0145 0.0131
Schistosoma mansoni amine GPCR 0.003 0.0145 0.0145
Loa Loa (eye worm) hypothetical protein 0.003 0.0145 0.0131
Echinococcus granulosus rhodopsin orphan GPCR 0.003 0.0145 0.0131
Trypanosoma brucei malonyl-CoA decarboxylase, mitochondrial precursor, putative 0.0328 0.3791 1
Schistosoma mansoni ancient conserved domain protein 2 (cyclin m2) 0.003 0.0145 0.0145
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0055 0.045 0.0437
Echinococcus granulosus jumonji domain containing protein 0.0049 0.0374 0.0361
Loa Loa (eye worm) hypothetical protein 0.0046 0.0341 0.0328
Brugia malayi putative malonyl-CoA decarboxylase 0.0835 0.9997 1
Schistosoma mansoni opsin-like receptor 0.003 0.0145 0.0145
Trypanosoma brucei DNA polymerase beta thumb, putative 0.0041 0.028 0.0739
Trypanosoma brucei apurinic/apyrimidinic endonuclease, putative 0.002 0.0014 0.0036
Echinococcus granulosus neuropeptide FF receptor 2 0.003 0.0145 0.0131
Echinococcus granulosus peregrin 0.0038 0.024 0.0227
Toxoplasma gondii PHD-finger domain-containing protein 0.0035 0.0205 0.3951
Brugia malayi hypothetical protein 0.003 0.0145 0.0131
Echinococcus multilocularis neuropeptide receptor 0.003 0.0145 0.0131
Loa Loa (eye worm) hypothetical protein 0.003 0.0145 0.0131
Echinococcus granulosus orexin receptor type 2 0.003 0.0145 0.0131
Echinococcus granulosus 7tm_1 domain containing protein 0.003 0.0145 0.0131
Schistosoma mansoni hypothetical protein 0.003 0.0145 0.0145
Echinococcus multilocularis growth hormone secretagogue receptor type 1 0.003 0.0145 0.0131
Echinococcus multilocularis rhodopsin orphan GPCR 0.003 0.0145 0.0131
Brugia malayi Dopamine receptor protein 2 0.003 0.0145 0.0131
Echinococcus multilocularis lysine specific demethylase 5A 0.0043 0.0296 0.0282
Echinococcus granulosus rhodopsin orphan GPCR 0.003 0.0145 0.0131
Brugia malayi Pre-SET motif family protein 0.0036 0.0215 0.0202
Loa Loa (eye worm) hypothetical protein 0.003 0.0145 0.0131
Toxoplasma gondii histone lysine methyltransferase SET/SUV39 0.0036 0.0215 0.4164
Brugia malayi Bromodomain containing protein 0.0038 0.024 0.0227
Schistosoma mansoni lamin 0.0033 0.0173 0.0173
Schistosoma mansoni biogenic amine (5HT) receptor 0.003 0.0145 0.0145
Echinococcus granulosus g protein coupled receptor 0.003 0.0145 0.0131
Brugia malayi larval opioid receptor 0.003 0.0145 0.0131
Toxoplasma gondii aldehyde dehydrogenase 0.0059 0.0498 1
Schistosoma mansoni ap endonuclease 0.002 0.0014 0.0014
Mycobacterium ulcerans aldehyde dehydrogenase 0.0059 0.0498 0.2923
Plasmodium falciparum ataxin-2 like protein, putative 0.003 0.0146 0.6949
Brugia malayi G-protein coupled receptor 0.003 0.0145 0.0131
Schistosoma mansoni alpha-1 adrenergic receptor 0.003 0.0145 0.0145
Echinococcus granulosus peptide allatostatin:somatostatin 0.003 0.0145 0.0131
Trichomonas vaginalis set domain proteins, putative 0.0286 0.3276 1
Schistosoma mansoni rhodopsin-like orphan GPCR 0.003 0.0145 0.0145
Echinococcus granulosus Transcription factor JmjC domain containing protein 0.0115 0.1186 0.1174
Brugia malayi Melatonin receptor type 1A 0.003 0.0145 0.0131
Echinococcus granulosus rhodopsin orphan GPCR 0.003 0.0145 0.0131
Echinococcus multilocularis somatostatin receptor 0.003 0.0145 0.0131
Schistosoma mansoni biogenic amine (dopamine) receptor 0.003 0.0145 0.0145
Echinococcus multilocularis bromodomain adjacent to zinc finger domain 0.0072 0.0657 0.0644
Schistosoma mansoni jumonji/arid domain-containing protein 0.0045 0.0324 0.0325
Echinococcus multilocularis lamin dm0 0.0033 0.0173 0.0159
Echinococcus multilocularis 7TM GPCR, rhodopsin 0.003 0.0145 0.0131
Echinococcus granulosus 5'partial|histone lysine N methyltransferase SETDB2 0.0035 0.0199 0.0186
Loa Loa (eye worm) G-protein coupled receptor 0.003 0.0145 0.0131
Echinococcus multilocularis neuropeptide Y receptor 0.003 0.0145 0.0131
Leishmania major aldehyde dehydrogenase, mitochondrial precursor 0.0059 0.0498 0.1313
Loa Loa (eye worm) hypothetical protein 0.003 0.0145 0.0131
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0057 0.0467 0.0468
Brugia malayi Dopamine receptor 0.003 0.0145 0.0131
Trypanosoma cruzi mitochondrial DNA polymerase beta-PAK, putative 0.0139 0.1478 0.39
Echinococcus granulosus 7TM GPCR rhodopsin 0.003 0.0145 0.0131
Loa Loa (eye worm) 5-hydroxytryptamine 2C receptor 0.003 0.0145 0.0131
Echinococcus multilocularis bromodomain adjacent to zinc finger domain 0.0043 0.0305 0.0292
Leishmania major apurinic/apyrimidinic endonuclease-redox protein 0.002 0.0014 0.0036
Loa Loa (eye worm) hypothetical protein 0.003 0.0145 0.0131
Loa Loa (eye worm) hypothetical protein 0.003 0.0145 0.0131
Toxoplasma gondii LsmAD domain-containing protein 0.003 0.0146 0.2746
Brugia malayi hypothetical protein 0.003 0.0145 0.0131
Schistosoma mansoni amine GPCR 0.003 0.0145 0.0145
Plasmodium vivax SET domain protein, putative 0.0036 0.0215 1
Brugia malayi hypothetical protein 0.003 0.0145 0.0131
Brugia malayi G protein-coupled receptor 0.003 0.0145 0.0131
Brugia malayi hypothetical protein 0.003 0.0145 0.0131
Loa Loa (eye worm) hypothetical protein 0.003 0.0145 0.0131
Brugia malayi neuropeptide F receptor 0.003 0.0145 0.0131
Schistosoma mansoni neuropeptide receptor 0.003 0.0145 0.0145
Schistosoma mansoni hypothetical protein 0.0025 0.0079 0.0079
Echinococcus granulosus tachykinin peptides receptor 99D 0.003 0.0145 0.0131
Loa Loa (eye worm) neuropeptide F receptor 0.003 0.0145 0.0131
Schistosoma mansoni hypothetical protein 0.0035 0.0205 0.0205
Echinococcus multilocularis serotonin receptor 0.003 0.0145 0.0131
Echinococcus granulosus fetal alzheimer antigen falz 0.0027 0.0107 0.0094
Echinococcus multilocularis g protein coupled receptor 0.003 0.0145 0.0131
Loa Loa (eye worm) hypothetical protein 0.003 0.0145 0.0131
Brugia malayi Bromodomain containing protein 0.0046 0.034 0.0327
Loa Loa (eye worm) jmjC domain-containing protein 0.0073 0.0664 0.0651
Schistosoma mansoni neuropeptide f receptor 76f 0.003 0.0145 0.0145
Schistosoma mansoni neuropeptide F-like receptor 0.003 0.0145 0.0145
Echinococcus multilocularis rhodopsin orphan GPCR 0.003 0.0145 0.0131
Brugia malayi hypothetical protein 0.003 0.0145 0.0131
Loa Loa (eye worm) melatonin receptor type 1A 0.003 0.0145 0.0131
Echinococcus multilocularis G protein coupled receptor 139 0.003 0.0145 0.0131
Brugia malayi RE15519p 0.003 0.0145 0.0131
Echinococcus granulosus neuropeptide receptor 0.003 0.0145 0.0131
Loa Loa (eye worm) hypothetical protein 0.003 0.0145 0.0131
Echinococcus multilocularis methyl CpG binding domain protein 2 0.0021 0.0026 0.0012
Echinococcus granulosus biogenic amine 5HT receptor 0.003 0.0145 0.0131
Schistosoma mansoni intermediate filament proteins 0.0033 0.0173 0.0173
Schistosoma mansoni aldehyde dehydrogenase 0.0059 0.0498 0.0499
Loa Loa (eye worm) hypothetical protein 0.003 0.0145 0.0131
Echinococcus multilocularis neuropeptide s receptor 0.003 0.0145 0.0131
Schistosoma mansoni peptide (allatostatin/somatostatin)-like receptor 0.003 0.0145 0.0145
Schistosoma mansoni histamine h1 receptor 0.003 0.0145 0.0145
Loa Loa (eye worm) hypothetical protein 0.003 0.0145 0.0131
Echinococcus granulosus g protein linked acetylcholine receptor gar 2a 0.003 0.0145 0.0131
Brugia malayi putative neuropeptide receptor NPR1 0.003 0.0145 0.0131
Loa Loa (eye worm) hypothetical protein 0.003 0.0145 0.0131
Loa Loa (eye worm) G-protein-linked acetylcholine receptor protein 2 0.003 0.0145 0.0131
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0055 0.045 0.0451
Schistosoma mansoni lamin 0.0033 0.0173 0.0173
Echinococcus granulosus histone lysine methyltransferase setb 0.0057 0.0467 0.0454
Schistosoma mansoni hypothetical protein 0.003 0.0145 0.0145
Echinococcus multilocularis sex peptide receptor 0.003 0.0145 0.0131
Schistosoma mansoni adenoreceptor 0.003 0.0145 0.0145
Schistosoma mansoni rhodopsin-like orphan GPCR 0.003 0.0145 0.0145
Loa Loa (eye worm) pre-SET domain-containing protein family protein 0.0251 0.2851 0.2842
Loa Loa (eye worm) hypothetical protein 0.0032 0.0165 0.0152
Echinococcus granulosus intermediate filament protein 0.0033 0.0173 0.0159
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0055 0.045 0.0451
Trypanosoma cruzi PAB1-binding protein , putative 0.003 0.0146 0.0386
Brugia malayi hypothetical protein 0.0148 0.1585 0.1574
Schistosoma mansoni zinc finger protein 0.0024 0.0063 0.0063
Schistosoma mansoni jumonji/arid domain-containing protein 0.0045 0.0324 0.0325
Echinococcus granulosus zinc finger protein 0.0024 0.0063 0.005
Schistosoma mansoni myosin xvIII 0.003 0.0145 0.0145
Brugia malayi sulfakinin receptor protein 0.003 0.0145 0.0131
Schistosoma mansoni neuropeptide receptor 0.003 0.0145 0.0145
Echinococcus multilocularis Transcription factor, JmjC domain containing protein 0.0115 0.1186 0.1174
Echinococcus multilocularis g protein coupled receptor 0.003 0.0145 0.0131
Brugia malayi Dopamine receptor protein 1 0.003 0.0145 0.0131
Schistosoma mansoni biogenic amine (octopamine/dopamine) receptor 0.003 0.0145 0.0145
Loa Loa (eye worm) jmjC domain-containing protein 0.0045 0.0324 0.0311
Schistosoma mansoni biogenic amine receptor 0.003 0.0145 0.0145
Wolbachia endosymbiont of Brugia malayi malonyl-CoA decarboxylase 0.0835 0.9997 1
Trypanosoma cruzi mitochondrial DNA polymerase beta-PAK, putative 0.005 0.0391 0.1031
Plasmodium vivax ataxin-2 like protein, putative 0.003 0.0146 0.6594
Schistosoma mansoni bromodomain-containing nuclear protein 1 brd1 0.0035 0.0205 0.0205
Loa Loa (eye worm) hypothetical protein 0.003 0.0145 0.0131
Echinococcus granulosus biogenic amine 5HT receptor 0.003 0.0145 0.0131
Brugia malayi G-protein coupled receptor 0.003 0.0145 0.0131
Mycobacterium ulcerans aldehyde dehydrogenase 0.0059 0.0498 0.2923
Loa Loa (eye worm) hypothetical protein 0.003 0.0146 0.0133
Brugia malayi GnHR receptor homolog 0.003 0.0145 0.0131
Brugia malayi Serotonin receptor 0.003 0.0145 0.0131
Echinococcus multilocularis neuropeptide Y receptor 0.003 0.0145 0.0131
Loa Loa (eye worm) hypothetical protein 0.003 0.0145 0.0131
Entamoeba histolytica exodeoxyribonuclease III, putative 0.002 0.0014 0.5
Brugia malayi G protein-coupled receptor F59B2.13 0.003 0.0145 0.0131
Schistosoma mansoni rhodopsin-like orphan GPCR 0.003 0.0145 0.0145
Trypanosoma cruzi malonyl-CoA decarboxylase, mitochondrial precursor, putative 0.0328 0.3791 1
Brugia malayi Dopamine receptor protein 1, putative (partial) 0.003 0.0145 0.0131
Brugia malayi hypothetical protein 0.003 0.0145 0.0131
Echinococcus multilocularis lamin 0.0033 0.0173 0.0159
Echinococcus multilocularis neuropeptide receptor A26 0.003 0.0145 0.0131
Loa Loa (eye worm) hypothetical protein 0.003 0.0145 0.0131
Echinococcus granulosus lamin dm0 0.0033 0.0173 0.0159
Loa Loa (eye worm) hypothetical protein 0.003 0.0145 0.0131
Plasmodium falciparum ataxin-2 like protein, putative 0.003 0.0146 0.6949
Loa Loa (eye worm) hypothetical protein 0.003 0.0145 0.0131
Echinococcus granulosus allatostatin A receptor 0.003 0.0145 0.0131
Echinococcus multilocularis musashi 0.0033 0.0173 0.0159
Loa Loa (eye worm) hypothetical protein 0.003 0.0145 0.0131
Echinococcus multilocularis pyroglutamylated rfamide peptide receptor 0.003 0.0145 0.0131
Leishmania major hypothetical protein, conserved 0.003 0.0146 0.0386
Brugia malayi Serotonin/octopamine receptor family protein 7 0.003 0.0145 0.0131
Echinococcus multilocularis neuropeptides capa receptor 0.003 0.0145 0.0131
Schistosoma mansoni peptide (FMRFamide/somatostatin)-like receptor 0.003 0.0145 0.0145
Loa Loa (eye worm) hypothetical protein 0.003 0.0145 0.0131
Echinococcus multilocularis rhodopsin orphan GPCR 0.003 0.0145 0.0131
Echinococcus granulosus tm gpcr rhodopsin 0.003 0.0145 0.0131
Loa Loa (eye worm) hypothetical protein 0.003 0.0145 0.0131
Schistosoma mansoni peptide (FMRFamide/somatostatin)-like receptor 0.003 0.0145 0.0145
Brugia malayi jmjC domain containing protein 0.0115 0.1186 0.1174
Schistosoma mansoni neuropeptide F-like receptor 0.003 0.0145 0.0145
Loa Loa (eye worm) hypothetical protein 0.006 0.0513 0.05
Schistosoma mansoni hypothetical protein 0.003 0.0145 0.0145
Loa Loa (eye worm) hypothetical protein 0.0035 0.0205 0.0192
Echinococcus multilocularis g protein linked acetylcholine receptor gar 2a 0.003 0.0145 0.0131
Loa Loa (eye worm) hypothetical protein 0.003 0.0145 0.0131
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0055 0.045 0.0451
Echinococcus multilocularis tm gpcr rhodopsin gpcr rhodopsin superfamily 0.0835 1 1
Schistosoma mansoni peptide (allatostatin)-like receptor 0.003 0.0145 0.0145
Loa Loa (eye worm) hypothetical protein 0.003 0.0145 0.0131
Mycobacterium tuberculosis Probable aldehyde dehydrogenase 0.0059 0.0498 0.2923
Echinococcus multilocularis thyrotropin releasing hormone receptor 0.003 0.0145 0.0131
Loa Loa (eye worm) PHD-finger family protein 0.0035 0.0205 0.0192
Echinococcus granulosus rhodopsin orphan GPCR 0.003 0.0145 0.0131
Echinococcus granulosus sex peptide receptor 0.003 0.0145 0.0131
Schistosoma mansoni biogenic amine receptor 0.003 0.0145 0.0145
Schistosoma mansoni hypothetical protein 0.003 0.0145 0.0145
Loa Loa (eye worm) hypothetical protein 0.0835 0.9997 1
Echinococcus multilocularis biogenic amine (5HT) receptor 0.003 0.0145 0.0131
Loa Loa (eye worm) hypothetical protein 0.003 0.0145 0.0131
Echinococcus granulosus bromodomain adjacent to zinc finger domain 0.0072 0.0657 0.0644
Brugia malayi Bromodomain containing protein 0.0091 0.0883 0.0871
Schistosoma mansoni ap endonuclease 0.002 0.0014 0.0014
Loa Loa (eye worm) hypothetical protein 0.0052 0.0404 0.0392
Echinococcus multilocularis tm gpcr rhodopsin gpcr rhodopsin superfamily 0.003 0.0145 0.0131
Echinococcus granulosus g-protein coupled receptor 0.003 0.0145 0.0131
Echinococcus multilocularis peptide (allatostatin:somatostatin) 0.003 0.0145 0.0131
Schistosoma mansoni opsin-like receptor 0.003 0.0145 0.0145
Giardia lamblia PHD finger protein 15 0.0035 0.0205 1
Loa Loa (eye worm) hypothetical protein 0.003 0.0145 0.0131
Brugia malayi gonadotropin-releasing hormone receptor 2 0.003 0.0145 0.0131
Loa Loa (eye worm) hypothetical protein 0.003 0.0145 0.0131
Echinococcus multilocularis tachykinin peptides receptor 99D 0.003 0.0145 0.0131

Activities

Activity type Activity value Assay description Source Reference
EC50 (functional) = 24.758 uM PUBCHEM_BIOASSAY: Fluorescence Cell-Based Secondary Assay to Identify Inhibitors of Resistant C. albicans Growth in the Presence of Fluconazole. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID1979, AID2007] ChEMBL. No reference
Potency (functional) = 1.122 um PUBCHEM_BIOASSAY: qHTS for inhibitors of ROR gamma transcriptional activity. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) = 1.5849 um PUBCHEM_BIOASSAY: VP16 counterscreen qHTS for inhibitors of ROR gamma transcriptional activity. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 3.1623 uM PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Histone Lysine Methyltransferase G9a. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID504404] ChEMBL. No reference
Potency (functional) 4.4668 uM PubChem BioAssay. qHTS for Agonist of gsp, the Etiologic Mutation Responsible for Fibrous Dysplasia/McCune-Albright Syndrome: qHTS. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 4.4668 uM PubChem BioAssay. qHTS Assay for Inhibitors of the HIV-1 protein Vpr. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) = 8.9125 um PUBCHEM_BIOASSAY: qHTS Multiplex Assay to Identify Dual Action Probes in a Cell Model of Huntington: Aggregate Formation (GFP). (Class of assay: confirmatory) [Related pubchem assays: 1482, 1471 ] ChEMBL. No reference
Potency (functional) 10.4179 uM PUBCHEM_BIOASSAY: Primary qHTS for delayed death inhibitors of the malarial parasite plastid, 48 hour incubation. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488752, AID488774, AID504848, AID504850] ChEMBL. No reference
Potency (functional) = 12.5893 um PUBCHEM_BIOASSAY: qHTS Assay for Modulators of Lamin A Splicing. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 18.526 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: qHTS Assay for Enhancers of SMN2 Splice Variant Expression. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 39.8107 uM PubChem BioAssay. qHTS for Inhibitors of ATXN expression. (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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