Detailed information for compound 1587584

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 359.421 | Formula: C22H21N3O2
  • H donors: 1 H acceptors: 2 LogP: 4.26 Rotable bonds: 5
    Rule of 5 violations (Lipinski): 1
  • SMILES: O=C(c1ccc(c2c1occ2)c1ccnn1C)Nc1ccc(cc1)C(C)C
  • InChi: 1S/C22H21N3O2/c1-14(2)15-4-6-16(7-5-15)24-22(26)19-9-8-17(18-11-13-27-21(18)19)20-10-12-23-25(20)3/h4-14H,1-3H3,(H,24,26)
  • InChiKey: WRFZNQKAASNPNK-UHFFFAOYSA-N  

Network

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Synonyms

No synonyms found for this compound

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens glucagon-like peptide 1 receptor Starlite/ChEMBL No references
Homo sapiens isocitrate dehydrogenase 1 (NADP+), soluble Starlite/ChEMBL No references

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Toxoplasma gondii isocitrate dehydrogenase Get druggable targets OG5_127057 All targets in OG5_127057
Candida albicans Mitochondrial NADP-specific isocitrate dehydrogenase Get druggable targets OG5_127057 All targets in OG5_127057
Trypanosoma cruzi isocitrate dehydrogenase, putative Get druggable targets OG5_127057 All targets in OG5_127057
Babesia bovis isocitrate dehydrogenase, NADP-dependent family protein Get druggable targets OG5_127057 All targets in OG5_127057
Leishmania mexicana isocitrate dehydrogenase [NADP], mitochondrial precursor, putative Get druggable targets OG5_127057 All targets in OG5_127057
Trypanosoma congolense isocitrate dehydrogenase, putative Get druggable targets OG5_127057 All targets in OG5_127057
Mycobacterium tuberculosis Probable isocitrate dehydrogenase [NADP] Icd1 (oxalosuccinate decarboxylase) (IDH) (NADP+-specific ICDH) (IDP) Get druggable targets OG5_127057 All targets in OG5_127057
Loa Loa (eye worm) isocitrate dehydrogenase Get druggable targets OG5_127057 All targets in OG5_127057
Candida albicans C terminus of cytosolic NADP-specific isocitrate dehydrogenase. Get druggable targets OG5_127057 All targets in OG5_127057
Plasmodium vivax isocitrate dehydrogenase [NADP], mitochondrial, putative Get druggable targets OG5_127057 All targets in OG5_127057
Trypanosoma brucei gambiense isocitrate dehydrogenase, putative Get druggable targets OG5_127057 All targets in OG5_127057
Candida albicans cytosolic NADP-specific isocitrate dehydrogenase. Get druggable targets OG5_127057 All targets in OG5_127057
Trypanosoma brucei gambiense isocitrate dehydrogenase [NADP], mitochondrial precursor, putative Get druggable targets OG5_127057 All targets in OG5_127057
Neospora caninum Isocitrate dehydrogenase-like protein, related Get druggable targets OG5_127057 All targets in OG5_127057
Schistosoma mansoni NADP-specific isocitrate dehydrogenase Get druggable targets OG5_127057 All targets in OG5_127057
Candida albicans Mitochondrial NADP-specific isocitrate dehydrogenase Get druggable targets OG5_127057 All targets in OG5_127057
Leishmania major isocitrate dehydrogenase [NADP], mitochondrial precursor, putative Get druggable targets OG5_127057 All targets in OG5_127057
Leishmania infantum isocitrate dehydrogenase [NADP], mitochondrial precursor, putative Get druggable targets OG5_127057 All targets in OG5_127057
Echinococcus multilocularis isocitrate dehydrogenase 2 (NADP+) Get druggable targets OG5_127057 All targets in OG5_127057
Plasmodium knowlesi isocitrate dehydrogenase [NADP], mitochondrial, putative Get druggable targets OG5_127057 All targets in OG5_127057
Brugia malayi isocitrate dehydrogenase Get druggable targets OG5_127057 All targets in OG5_127057
Brugia malayi Isocitrate dehydrogenase Get druggable targets OG5_127057 All targets in OG5_127057
Candida albicans N terminus of cytosolic NADP-specific isocitrate dehydrogenase. Get druggable targets OG5_127057 All targets in OG5_127057
Plasmodium yoelii isocitrate dehydrogenase, NADP-dependent, putative Get druggable targets OG5_127057 All targets in OG5_127057
Echinococcus granulosus NADP dependent isocitrate dehydrogenase Get druggable targets OG5_127057 All targets in OG5_127057
Leishmania donovani isocitrate dehydrogenase [NADP], mitochondrial precursor, putative Get druggable targets OG5_127057 All targets in OG5_127057
Echinococcus multilocularis isocitrate dehydrogenase Get druggable targets OG5_127057 All targets in OG5_127057
Echinococcus multilocularis NADP dependent isocitrate dehydrogenase Get druggable targets OG5_127057 All targets in OG5_127057
Schistosoma japonicum ko:K00031 isocitrate dehydrogenase [EC1.1.1.42], putative Get druggable targets OG5_127057 All targets in OG5_127057
Plasmodium yoelii isocitrate dehydrogenase, NADP-dependent Get druggable targets OG5_127057 All targets in OG5_127057
Theileria parva isocitrate dehydrogenase (NADP+), putative Get druggable targets OG5_127057 All targets in OG5_127057
Trypanosoma congolense isocitrate dehydrogenase, putative Get druggable targets OG5_127057 All targets in OG5_127057
Echinococcus multilocularis NADP dependent isocitrate dehydrogenase Get druggable targets OG5_127057 All targets in OG5_127057
Leishmania braziliensis isocitrate dehydrogenase [NADP], mitochondrial precursor, putative Get druggable targets OG5_127057 All targets in OG5_127057
Trypanosoma cruzi isocitrate dehydrogenase [NADP], mitochondrial precursor, putative Get druggable targets OG5_127057 All targets in OG5_127057
Toxoplasma gondii isocitrate dehydrogenase Get druggable targets OG5_127057 All targets in OG5_127057
Neospora caninum hypothetical protein Get druggable targets OG5_127057 All targets in OG5_127057
Trypanosoma brucei isocitrate dehydrogenase, putative Get druggable targets OG5_127057 All targets in OG5_127057
Plasmodium berghei isocitrate dehydrogenase [NADP], mitochondrial, putative Get druggable targets OG5_127057 All targets in OG5_127057
Echinococcus multilocularis NADP dependent isocitrate dehydrogenase Get druggable targets OG5_127057 All targets in OG5_127057
Plasmodium falciparum isocitrate dehydrogenase [NADP], mitochondrial Get druggable targets OG5_127057 All targets in OG5_127057
Trypanosoma brucei isocitrate dehydrogenase [NADP], mitochondrial precursor, putative Get druggable targets OG5_127057 All targets in OG5_127057

By sequence similarity to non orthologous known druggable targets
Species Potential target Known druggable target Length Alignment span Identity
Loa Loa (eye worm) pigment dispersing factor receptor c glucagon-like peptide 1 receptor 463 aa 388 aa 25.8 %

Obtained from network model

Ranking Plot


Putative Targets List


Species Potential target Raw Global Species
Mycobacterium ulcerans cytochrome P450 140A5 Cyp140A5 0.0121 1 1
Plasmodium falciparum AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.0019 0.0921 0.9537
Echinococcus multilocularis neuropeptide receptor 0.0012 0.0298 0.0167
Mycobacterium ulcerans cytochrome P450 125A7 Cyp125A7 0.0121 1 1
Echinococcus multilocularis pyroglutamylated rfamide peptide receptor 0.0012 0.0298 0.0167
Onchocerca volvulus 0.0012 0.0298 0.5
Mycobacterium tuberculosis Probable cytochrome P450 123 Cyp123 0.0121 1 1
Schistosoma mansoni hypothetical protein 0.0019 0.0956 0.0956
Trypanosoma brucei isocitrate dehydrogenase, putative 0.0019 0.0959 0.0838
Echinococcus multilocularis neuropeptide receptor A26 0.0012 0.0298 0.0167
Loa Loa (eye worm) hypothetical protein 0.0012 0.0298 0.0298
Mycobacterium tuberculosis Probable aldehyde dehydrogenase 0.006 0.4619 0.4074
Schistosoma mansoni opsin-like receptor 0.0012 0.0298 0.0298
Loa Loa (eye worm) hypothetical protein 0.0012 0.0298 0.0298
Loa Loa (eye worm) hypothetical protein 0.006 0.4618 0.4618
Echinococcus multilocularis NADP dependent isocitrate dehydrogenase 0.0019 0.0959 0.0838
Mycobacterium tuberculosis Probable cytochrome P450 140 Cyp140 0.0121 1 1
Brugia malayi larval opioid receptor 0.0012 0.0298 0.0298
Echinococcus multilocularis neuropeptide FF receptor 2 0.0012 0.0298 0.0167
Toxoplasma gondii exonuclease III APE 0.0019 0.0921 0.0799
Toxoplasma gondii isocitrate dehydrogenase 0.0019 0.0959 0.0838
Mycobacterium ulcerans cytochrome P450 136A2 Cyp136A2 0.0121 1 1
Toxoplasma gondii isocitrate dehydrogenase 0.0019 0.0959 0.0838
Echinococcus granulosus rhodopsin orphan GPCR 0.0012 0.0298 0.0167
Loa Loa (eye worm) hypothetical protein 0.0012 0.0298 0.0298
Echinococcus multilocularis tachykinin peptides receptor 99D 0.0012 0.0298 0.0167
Schistosoma mansoni alpha-1 adrenergic receptor 0.0012 0.0298 0.0298
Mycobacterium tuberculosis Cytochrome P450 121 Cyp121 0.0121 1 1
Loa Loa (eye worm) TYRA-2 protein 0.0012 0.0298 0.0298
Leishmania major cytochrome p450-like protein 0.0121 1 1
Onchocerca volvulus 0.0012 0.0298 0.5
Echinococcus granulosus rhodopsin orphan GPCR 0.0012 0.0298 0.0167
Brugia malayi Cytochrome P450 family protein 0.0121 1 1
Loa Loa (eye worm) hypothetical protein 0.0012 0.0298 0.0298
Mycobacterium tuberculosis Probable cytochrome P450 monooxygenase 142 Cyp142 0.0121 1 1
Schistosoma mansoni biogenic amine receptor 0.0012 0.0298 0.0298
Echinococcus multilocularis isocitrate dehydrogenase 0.0019 0.0959 0.0838
Leishmania major lanosterol 14-alpha-demethylase, putative 0.0121 1 1
Echinococcus multilocularis cadherin EGF LAG seven pass G type receptor 0.0019 0.0956 0.0835
Schistosoma mansoni neuropeptide F-like receptor 0.0012 0.0298 0.0298
Echinococcus multilocularis growth hormone secretagogue receptor type 1 0.0012 0.0298 0.0167
Mycobacterium ulcerans cytochrome P450 124A1, Cyp124A1 0.0121 1 1
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0012 0.0298 0.0298
Schistosoma mansoni ap endonuclease 0.0019 0.0921 0.0921
Echinococcus multilocularis g protein coupled receptor 0.0012 0.0298 0.0167
Mycobacterium tuberculosis Probable cytochrome P450 125 Cyp125 0.0121 1 1
Brugia malayi G-protein coupled receptor 0.0012 0.0298 0.0298
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0045 0.3298 0.3208
Schistosoma mansoni histamine h1 receptor 0.0012 0.0298 0.0298
Echinococcus granulosus NADP dependent isocitrate dehydrogenase 0.0019 0.0959 0.0838
Brugia malayi Serotonin/octopamine receptor family protein 7 0.0012 0.0298 0.0298
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0012 0.0298 0.0298
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.0019 0.0956 0.0835
Loa Loa (eye worm) hypothetical protein 0.0012 0.0298 0.0298
Entamoeba histolytica exodeoxyribonuclease III, putative 0.0019 0.0921 1
Loa Loa (eye worm) hypothetical protein 0.0012 0.0298 0.0298
Onchocerca volvulus 0.0012 0.0298 0.5
Mycobacterium tuberculosis Probable isocitrate dehydrogenase [NADP] Icd1 (oxalosuccinate decarboxylase) (IDH) (NADP+-specific ICDH) (IDP) 0.0019 0.0959 0.0042
Echinococcus granulosus tm gpcr rhodopsin 0.0012 0.0298 0.0167
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0045 0.3298 0.3298
Wolbachia endosymbiont of Brugia malayi exonuclease III 0.0019 0.0921 0.5
Brugia malayi G-protein coupled receptor 0.0012 0.0298 0.0298
Brugia malayi hypothetical protein 0.0012 0.0298 0.0298
Schistosoma mansoni peptide (FMRFamide/somatostatin)-like receptor 0.0012 0.0298 0.0298
Loa Loa (eye worm) hypothetical protein 0.0019 0.0956 0.0956
Schistosoma mansoni amine GPCR 0.0012 0.0298 0.0298
Echinococcus granulosus biogenic amine 5HT receptor 0.0012 0.0298 0.0167
Brugia malayi Serotonin receptor 0.0012 0.0298 0.0298
Schistosoma mansoni neuropeptide f receptor 76f 0.0012 0.0298 0.0298
Echinococcus multilocularis g-protein coupled receptor 0.0012 0.0298 0.0167
Loa Loa (eye worm) hypothetical protein 0.0012 0.0298 0.0298
Loa Loa (eye worm) exodeoxyribonuclease III family protein 0.0019 0.0921 0.0921
Schistosoma mansoni peptide (allatostatin)-like receptor 0.0012 0.0298 0.0298
Leishmania major isocitrate dehydrogenase [NADP], mitochondrial precursor, putative 0.0019 0.0959 0.0838
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0045 0.3298 0.3298
Loa Loa (eye worm) hypothetical protein 0.0012 0.0298 0.0298
Echinococcus granulosus rhodopsin orphan GPCR 0.0012 0.0298 0.0167
Echinococcus multilocularis rhodopsin orphan GPCR 0.0012 0.0298 0.0167
Echinococcus multilocularis sex peptide receptor 0.0012 0.0298 0.0167
Schistosoma mansoni aldehyde dehydrogenase 0.006 0.4619 0.4619
Loa Loa (eye worm) hypothetical protein 0.0012 0.0298 0.0298
Echinococcus granulosus orexin receptor type 2 0.0012 0.0298 0.0167
Mycobacterium ulcerans cytochrome P450 123A3 Cyp123A3 0.0121 1 1
Loa Loa (eye worm) 5-hydroxytryptamine 2C receptor 0.0012 0.0298 0.0298
Brugia malayi putative neuropeptide receptor NPR1 0.0012 0.0298 0.0298
Loa Loa (eye worm) hypothetical protein 0.0012 0.0298 0.0298
Brugia malayi hypothetical protein 0.0012 0.0298 0.0298
Loa Loa (eye worm) hypothetical protein 0.0012 0.0298 0.0298
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.0019 0.0956 0.0956
Mycobacterium ulcerans cytochrome P450 189A7 Cyp189A7 0.0121 1 1
Schistosoma mansoni amine GPCR 0.0012 0.0298 0.0298
Echinococcus granulosus g protein linked acetylcholine receptor gar 2a 0.0012 0.0298 0.0167
Echinococcus granulosus g-protein coupled receptor 0.0012 0.0298 0.0167
Echinococcus multilocularis rhodopsin orphan GPCR 0.0012 0.0298 0.0167
Schistosoma mansoni myosin xvIII 0.0012 0.0298 0.0298
Loa Loa (eye worm) G-protein coupled receptor 0.0012 0.0298 0.0298
Mycobacterium tuberculosis Probable cytochrome P450 137 Cyp137 0.0121 1 1
Mycobacterium tuberculosis Probable cytochrome P450 136 Cyp136 0.0121 1 1
Mycobacterium leprae Conserved hypothetical protein 0.0121 1 0.5
Echinococcus multilocularis tm gpcr rhodopsin gpcr rhodopsin superfamily 0.0012 0.0298 0.0167
Echinococcus granulosus neuropeptide receptor A26 0.0012 0.0298 0.0167
Brugia malayi Dopamine receptor 0.0012 0.0298 0.0298
Loa Loa (eye worm) hypothetical protein 0.0012 0.0298 0.0298
Echinococcus granulosus 7TM GPCR rhodopsin 0.0012 0.0298 0.0167
Schistosoma mansoni peptide (FMRFamide/somatostatin)-like receptor 0.0012 0.0298 0.0298
Echinococcus multilocularis GPCR, family 2 0.0019 0.0956 0.0835
Echinococcus multilocularis rhodopsin orphan GPCR 0.0012 0.0298 0.0167
Loa Loa (eye worm) hypothetical protein 0.0012 0.0298 0.0298
Loa Loa (eye worm) hypothetical protein 0.0012 0.0298 0.0298
Echinococcus multilocularis G-protein coupled receptor, putative 0.0012 0.0298 0.0167
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0012 0.0298 0.0298
Schistosoma mansoni biogenic amine (dopamine) receptor 0.0012 0.0298 0.0298
Schistosoma mansoni biogenic amine (dopamine) receptor 0.0012 0.0298 0.0298
Toxoplasma gondii aldehyde dehydrogenase 0.006 0.4619 0.4547
Echinococcus multilocularis 0.0121 1 1
Echinococcus multilocularis G protein coupled receptor 139 0.0012 0.0298 0.0167
Echinococcus multilocularis NADP dependent isocitrate dehydrogenase 0.0019 0.0959 0.0838
Schistosoma mansoni peptide (FMRFamide/neurokinin-3)-like receptor 0.0012 0.0298 0.0298
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0045 0.3298 0.3298
Loa Loa (eye worm) hypothetical protein 0.0012 0.0298 0.0298
Echinococcus multilocularis neuropeptide Y receptor 0.0012 0.0298 0.0167
Schistosoma mansoni ancient conserved domain protein 2 (cyclin m2) 0.0012 0.0298 0.0298
Schistosoma mansoni neuropeptide receptor 0.0012 0.0298 0.0298
Loa Loa (eye worm) hypothetical protein 0.0012 0.0298 0.0298
Echinococcus granulosus g protein linked acetylcholine receptor gar 2a 0.0012 0.0298 0.0167
Echinococcus granulosus rhodopsin orphan GPCR 0.0012 0.0298 0.0167
Brugia malayi hypothetical protein 0.0012 0.0298 0.0298
Brugia malayi Calcitonin receptor-like protein seb-1 0.006 0.4618 0.4618
Echinococcus multilocularis aldehyde dehydrogenase, mitochondrial 0.006 0.4619 0.4547
Loa Loa (eye worm) hypothetical protein 0.0012 0.0298 0.0298
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0012 0.0298 0.0298
Echinococcus multilocularis dro:myosuppressin receptor 0.0012 0.0298 0.0167
Onchocerca volvulus 0.0012 0.0298 0.5
Brugia malayi neuropeptide F receptor 0.0012 0.0298 0.0298
Mycobacterium ulcerans cytochrome P450 187A5 Cyp187A5 0.0121 1 1
Loa Loa (eye worm) hypothetical protein 0.0012 0.0298 0.0298
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.0019 0.0956 0.0835
Schistosoma mansoni neuropeptide receptor 0.0012 0.0298 0.0298
Brugia malayi G protein-coupled receptor 0.0012 0.0298 0.0298
Trypanosoma brucei apurinic/apyrimidinic endonuclease, putative 0.0019 0.0921 0.0799
Loa Loa (eye worm) hypothetical protein 0.0012 0.0298 0.0298
Trypanosoma brucei isocitrate dehydrogenase [NADP], mitochondrial precursor, putative 0.0019 0.0959 0.0838
Echinococcus multilocularis tm gpcr rhodopsin gpcr rhodopsin superfamily 0.0012 0.0298 0.0167
Echinococcus multilocularis rhodopsin orphan GPCR 0.0012 0.0298 0.0167
Echinococcus multilocularis peptide (allatostatin:somatostatin) 0.0012 0.0298 0.0167
Echinococcus multilocularis fmrfamide receptor 0.0012 0.0298 0.0167
Mycobacterium ulcerans cytochrome P450 150A6 Cyp150A6 0.0121 1 1
Brugia malayi hypothetical protein 0.0012 0.0298 0.0298
Onchocerca volvulus 0.0012 0.0298 0.5
Echinococcus granulosus g protein coupled receptor 0.0012 0.0298 0.0167
Loa Loa (eye worm) hypothetical protein 0.0012 0.0298 0.0298
Loa Loa (eye worm) hypothetical protein 0.0012 0.0298 0.0298
Brugia malayi putative neuropeptide receptor 0.0012 0.0298 0.0298
Schistosoma mansoni hypothetical protein 0.0019 0.0956 0.0956
Trypanosoma cruzi cytochrome p450-like protein, putative 0.0121 1 1
Toxoplasma gondii cytochrome p450 superfamily protein 0.0121 1 1
Onchocerca volvulus 0.0012 0.0298 0.5
Brugia malayi hypothetical protein 0.0012 0.0298 0.0298
Loa Loa (eye worm) cytochrome P450 family protein 0.0121 1 1
Brugia malayi follicle stimulating hormone receptor 0.0012 0.0298 0.0298
Echinococcus granulosus sex peptide receptor 0.0012 0.0298 0.0167
Mycobacterium ulcerans cytochrome P450 126A3 Cyp126A3 0.0121 1 1
Mycobacterium ulcerans cytochrome P450 142A3 Cyp142A3 0.0121 1 1
Schistosoma mansoni hypothetical protein 0.0019 0.0956 0.0956
Echinococcus multilocularis neuropeptides capa receptor 0.0012 0.0298 0.0167
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0012 0.0298 0.0298
Echinococcus granulosus neuropeptide s receptor 0.0012 0.0298 0.0167
Mycobacterium ulcerans cytochrome P450 191A3 Cyp191A3 0.0121 1 1
Schistosoma mansoni NADP-specific isocitrate dehydrogenase 0.0019 0.0959 0.0959
Brugia malayi AKH receptor 0.0012 0.0298 0.0298
Schistosoma mansoni hypothetical protein 0.0019 0.0956 0.0956
Echinococcus granulosus tm gpcr rhodopsin 0.0012 0.0298 0.0167
Mycobacterium tuberculosis Cytochrome P450 51 Cyp51 (CYPL1) (P450-L1A1) (sterol 14-alpha demethylase) (lanosterol 14-alpha demethylase) (P450-14DM) 0.0121 1 1
Brugia malayi RE15519p 0.0012 0.0298 0.0298
Echinococcus multilocularis orexin receptor type 2 0.0012 0.0298 0.0167
Trypanosoma cruzi Lanosterol 14-alpha demethylase 0.0121 1 1
Loa Loa (eye worm) hypothetical protein 0.0012 0.0298 0.0298
Mycobacterium ulcerans cytochrome P450 108B4 Cyp108B4 0.0121 1 1
Loa Loa (eye worm) cytochrome P450 family protein 0.0121 1 1
Echinococcus granulosus neuropeptides capa receptor 0.0012 0.0298 0.0167
Schistosoma mansoni histamine-responsive GPCR (AAF21638) 0.0012 0.0298 0.0298
Mycobacterium ulcerans cytochrome P450 187A4 Cyp187A4 0.0121 1 1
Echinococcus granulosus g protein coupled receptor 0.0012 0.0298 0.0167
Echinococcus granulosus fmrfamide receptor 0.0012 0.0298 0.0167
Schistosoma mansoni hypothetical protein 0.0012 0.0298 0.0298
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0012 0.0298 0.0298
Mycobacterium tuberculosis Probable cytochrome P450 143 Cyp143 0.0121 1 1
Loa Loa (eye worm) hypothetical protein 0.0012 0.0298 0.0298
Schistosoma mansoni biogenic amine receptor 0.0012 0.0298 0.0298
Brugia malayi sulfakinin receptor protein 0.0012 0.0298 0.0298
Mycobacterium ulcerans cytochrome P450 144A4 Cyp144A4 0.0121 1 1
Echinococcus multilocularis serotonin receptor 0.0012 0.0298 0.0167
Echinococcus granulosus rhodopsin orphan GPCR 0.0012 0.0298 0.0167
Loa Loa (eye worm) hypothetical protein 0.0012 0.0298 0.0298
Brugia malayi ORL1-like opioid receptor 0.0012 0.0298 0.0298
Schistosoma mansoni biogenic amine (octopamine/dopamine) receptor 0.0012 0.0298 0.0298
Schistosoma mansoni amine GPCR 0.0012 0.0298 0.0298
Mycobacterium ulcerans cytochrome P450 143A3 Cyp143A3 0.0121 1 1
Echinococcus granulosus rhodopsin orphan GPCR 0.0012 0.0298 0.0167
Schistosoma mansoni neuropeptide receptor 0.0012 0.0298 0.0298
Mycobacterium tuberculosis Probable cytochrome P450 141 Cyp141 0.0121 1 1
Echinococcus multilocularis somatostatin receptor 0.0012 0.0298 0.0167
Loa Loa (eye worm) hypothetical protein 0.0012 0.0298 0.0298
Echinococcus multilocularis biogenic amine (5HT) receptor 0.0012 0.0298 0.0167
Loa Loa (eye worm) hypothetical protein 0.0012 0.0298 0.0298
Brugia malayi G-protein-linked acetylcholine receptor protein 2, putative 0.0012 0.0298 0.0298
Echinococcus multilocularis DNA (apurinic or apyrimidinic site) lyase 0.0019 0.0921 0.0799
Echinococcus multilocularis allatostatin A receptor 0.0012 0.0298 0.0167
Brugia malayi hypothetical protein 0.0012 0.0298 0.0298
Loa Loa (eye worm) melatonin receptor type 1A 0.0012 0.0298 0.0298
Schistosoma mansoni hypothetical protein 0.0012 0.0298 0.0298
Echinococcus multilocularis rhodopsin orphan GPCR 0.0012 0.0298 0.0167
Echinococcus granulosus neuropeptide receptor 0.0012 0.0298 0.0167
Leishmania major apurinic/apyrimidinic endonuclease-redox protein 0.0019 0.0921 0.0799
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0045 0.3298 0.3208
Echinococcus granulosus 7tm_1 domain containing protein 0.0012 0.0298 0.0167
Loa Loa (eye worm) hypothetical protein 0.0012 0.0298 0.0298
Schistosoma mansoni biogenic amine (5HT) receptor 0.0012 0.0298 0.0298
Mycobacterium tuberculosis Probable cytochrome P450 139 Cyp139 0.0121 1 1
Echinococcus multilocularis tm gpcr rhodopsin gpcr rhodopsin superfamily 0.0012 0.0298 0.0167
Brugia malayi hypothetical protein 0.0012 0.0298 0.0298
Echinococcus multilocularis rhodopsin orphan GPCR 0.0012 0.0298 0.0167
Echinococcus multilocularis 7TM GPCR, rhodopsin 0.0012 0.0298 0.0167
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.006 0.4618 0.4618
Loa Loa (eye worm) hypothetical protein 0.0012 0.0298 0.0298
Echinococcus granulosus neuropeptide FF receptor 2 0.0012 0.0298 0.0167
Loa Loa (eye worm) hypothetical protein 0.0012 0.0298 0.0298
Mycobacterium ulcerans aldehyde dehydrogenase 0.006 0.4619 0.4547
Schistosoma mansoni hypothetical protein 0.0012 0.0298 0.0298
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0012 0.0298 0.0298
Brugia malayi Dopamine receptor protein 1, putative (partial) 0.0012 0.0298 0.0298
Brugia malayi G protein-coupled receptor F59B2.13 0.0012 0.0298 0.0298
Onchocerca volvulus 0.0012 0.0298 0.5
Brugia malayi latrophilin 2 splice variant baaae 0.0041 0.2923 0.2923
Echinococcus multilocularis G protein coupled 5 hydroxytryptamine receptor 0.0012 0.0298 0.0167
Loa Loa (eye worm) isocitrate dehydrogenase 0.0019 0.0959 0.0959
Mycobacterium ulcerans cytochrome P450 143A4 Cyp143A4 0.0121 1 1
Loa Loa (eye worm) hypothetical protein 0.0012 0.0298 0.0298
Echinococcus granulosus tachykinin peptides receptor 99D 0.0012 0.0298 0.0167
Mycobacterium ulcerans cytochrome P450 188A3 Cyp188A3 0.0121 1 1
Leishmania major cytochrome p450-like protein 0.0121 1 1
Echinococcus granulosus g protein coupled receptor 0.0012 0.0298 0.0167
Loa Loa (eye worm) cytochrome P450 family protein 0.0121 1 1
Onchocerca volvulus 0.0012 0.0298 0.5
Loa Loa (eye worm) hypothetical protein 0.0012 0.0298 0.0298
Brugia malayi Unidentified vitellogenin-linked transcript protein 6, putative 0.0012 0.0298 0.0298
Schistosoma mansoni amine GPCR 0.0012 0.0298 0.0298
Loa Loa (eye worm) hypothetical protein 0.0012 0.0298 0.0298
Onchocerca volvulus 0.0012 0.0298 0.5
Loa Loa (eye worm) G-protein coupled receptor 0.0012 0.0298 0.0298
Echinococcus multilocularis neuropeptides capa receptor 0.0012 0.0298 0.0167
Schistosoma mansoni neuropeptide F-like receptor 0.0012 0.0298 0.0298
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0012 0.0298 0.0298
Brugia malayi Cytochrome P450 family protein 0.0121 1 1
Trypanosoma cruzi cytochrome P450, putative 0.0121 1 1
Echinococcus granulosus thyrotropin releasing hormone receptor 0.0012 0.0298 0.0167
Loa Loa (eye worm) cytochrome P450 0.0121 1 1
Echinococcus multilocularis rhodopsin orphan GPCR 0.0012 0.0298 0.0167
Schistosoma mansoni hypothetical protein 0.0012 0.0298 0.0298
Schistosoma mansoni ap endonuclease 0.0019 0.0921 0.0921
Mycobacterium tuberculosis Possible cytochrome P450 135A1 Cyp135A1 0.0121 1 1
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0045 0.3298 0.3208
Onchocerca volvulus 0.0012 0.0298 0.5
Echinococcus granulosus DNA apurinic or apyrimidinic site lyase 0.0019 0.0921 0.0799
Schistosoma mansoni opsin-like receptor 0.0012 0.0298 0.0298
Loa Loa (eye worm) neuropeptide F receptor 0.0012 0.0298 0.0298
Loa Loa (eye worm) neuropeptide F receptor 0.0012 0.0298 0.0298
Trichomonas vaginalis ap endonuclease, putative 0.0019 0.0921 0.5
Echinococcus granulosus aldehyde dehydrogenase mitochondrial 0.006 0.4619 0.4547
Mycobacterium tuberculosis Possible cytochrome P450 126 Cyp126 0.0121 1 1
Echinococcus granulosus somatostatin receptor 0.0012 0.0298 0.0167
Plasmodium vivax AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.0019 0.0921 0.9537
Echinococcus multilocularis g protein coupled receptor 0.0012 0.0298 0.0167
Schistosoma mansoni amine GPCR 0.0012 0.0298 0.0298
Onchocerca volvulus 0.0012 0.0298 0.5
Brugia malayi Serotonin receptor 0.0012 0.0298 0.0298
Mycobacterium ulcerans aldehyde dehydrogenase 0.006 0.4619 0.4547
Onchocerca volvulus 0.0012 0.0298 0.5
Loa Loa (eye worm) pigment dispersing factor receptor c 0.006 0.4618 0.4618
Brugia malayi GnHR receptor homolog 0.0012 0.0298 0.0298
Echinococcus multilocularis isocitrate dehydrogenase 2 (NADP+) 0.0019 0.0959 0.0838
Loa Loa (eye worm) unidentified vitellogenin-linked transcript protein 6 0.0012 0.0298 0.0298
Mycobacterium ulcerans aldehyde dehydrogenase 0.006 0.4619 0.4547
Loa Loa (eye worm) hypothetical protein 0.0012 0.0298 0.0298
Echinococcus granulosus cadherin EGF LAG seven pass G type receptor 0.0019 0.0956 0.0835
Onchocerca volvulus Dopamine\/Ecdysteroid receptor homolog 0.0012 0.0298 0.5
Trypanosoma cruzi apurinic/apyrimidinic endonuclease 0.0019 0.0921 0.0799
Trichomonas vaginalis ap endonuclease, putative 0.0019 0.0921 0.5
Brugia malayi neuropeptide F receptor 0.0012 0.0298 0.0298
Mycobacterium tuberculosis Probable cytochrome P450 132 Cyp132 0.0121 1 1
Giardia lamblia Endonuclease/Exonuclease/phosphatase 0.0019 0.0921 1
Treponema pallidum exodeoxyribonuclease (exoA) 0.0019 0.0921 0.5
Brugia malayi hypothetical protein 0.0012 0.0298 0.0298
Trypanosoma cruzi Lanosterol 14-alpha demethylase 0.0121 1 1
Brugia malayi Cytochrome P450 family protein 0.0121 1 1
Onchocerca volvulus 0.0012 0.0298 0.5
Echinococcus granulosus dro:myosuppressin receptor 0.0012 0.0298 0.0167
Loa Loa (eye worm) hypothetical protein 0.0041 0.2923 0.2923
Mycobacterium leprae putative cytochrome p450 0.0121 1 0.5
Loa Loa (eye worm) hypothetical protein 0.0012 0.0298 0.0298
Schistosoma mansoni thyrotropin-releasing hormone receptor 0.0012 0.0298 0.0298
Schistosoma mansoni muscarinic acetylcholine (GAR) receptor 0.0012 0.0298 0.0298
Loa Loa (eye worm) latrophilin receptor protein 2 0.0019 0.0956 0.0956
Echinococcus granulosus neuropeptide Y receptor 0.0012 0.0298 0.0167
Echinococcus granulosus pyroglutamylated rfamide peptide receptor 0.0012 0.0298 0.0167
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0045 0.3298 0.3208
Mycobacterium ulcerans cytochrome P450 105Q4 Cyp105Q4 0.0121 1 1
Brugia malayi Isocitrate dehydrogenase 0.0019 0.0959 0.0959
Trypanosoma brucei cytochrome P450, putative 0.0121 1 1
Echinococcus multilocularis neuropeptide receptor 0.0012 0.0298 0.0167
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0012 0.0298 0.0298
Onchocerca volvulus 0.0012 0.0298 0.5
Loa Loa (eye worm) hypothetical protein 0.0012 0.0298 0.0298
Mycobacterium ulcerans cytochrome P450 185A4 Cyp185A4 0.0121 1 1
Mycobacterium tuberculosis Probable cytochrome P450 124 Cyp124 0.0121 1 1
Schistosoma mansoni ATP-binding cassette sub-family g2 (white protein) (abcg2) 0.001 0.0132 0.0132
Mycobacterium ulcerans exodeoxyribonuclease III protein XthA 0.0019 0.0921 0.0799
Echinococcus granulosus G protein coupled receptor 139 0.0012 0.0298 0.0167
Brugia malayi Melatonin receptor type 1A 0.0012 0.0298 0.0298
Echinococcus granulosus biogenic amine 5HT receptor 0.0012 0.0298 0.0167
Echinococcus granulosus serotonin receptor 0.0012 0.0298 0.0167
Loa Loa (eye worm) hypothetical protein 0.0012 0.0298 0.0298
Echinococcus granulosus growth hormone secretagogue receptor type 1 0.0012 0.0298 0.0167
Loa Loa (eye worm) follicle stimulating hormone receptor 0.0012 0.0298 0.0298
Loa Loa (eye worm) gonadotropin-releasing hormone receptor 2 0.0012 0.0298 0.0298
Schistosoma mansoni hypothetical protein 0.0121 1 1
Mycobacterium tuberculosis Probable cytochrome P450 144 Cyp144 0.0121 1 1
Schistosoma mansoni biogenic amine (dopamine) receptor 0.0012 0.0298 0.0298
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0045 0.3298 0.3298
Echinococcus multilocularis fmrfamide receptor 0.0012 0.0298 0.0167
Trypanosoma cruzi cytochrome P450, putative 0.0121 1 1
Echinococcus granulosus hypothetical protein 0.0012 0.0298 0.0167
Trypanosoma cruzi apurinic/apyrimidinic endonuclease, putative 0.0019 0.0921 0.0799
Mycobacterium ulcerans cytochrome P450 51B1 Cyp51B1 0.0121 1 1
Echinococcus granulosus G protein coupled 5 hydroxytryptamine receptor 0.0012 0.0298 0.0167
Trypanosoma cruzi isocitrate dehydrogenase, putative 0.0019 0.0959 0.0838
Mycobacterium ulcerans cytochrome p450 150 cyp150 0.0121 1 1
Loa Loa (eye worm) hypothetical protein 0.0012 0.0298 0.0298
Schistosoma mansoni adenoreceptor 0.0012 0.0298 0.0298
Echinococcus multilocularis g protein linked acetylcholine receptor gar 2a 0.0012 0.0298 0.0167
Schistosoma mansoni cytochrome P450 0.0121 1 1
Brugia malayi hypothetical protein 0.0012 0.0298 0.0298
Echinococcus multilocularis NADP dependent isocitrate dehydrogenase 0.0019 0.0959 0.0838
Echinococcus multilocularis rhodopsin orphan GPCR 0.0012 0.0298 0.0167
Loa Loa (eye worm) CYP4Cod1 0.0121 1 1
Echinococcus granulosus neuropeptides capa receptor 0.0012 0.0298 0.0167
Echinococcus multilocularis g protein linked acetylcholine receptor gar 2a 0.0012 0.0298 0.0167
Echinococcus multilocularis g protein coupled receptor 0.0012 0.0298 0.0167
Onchocerca volvulus Neuropeptide F receptor homolog 0.0012 0.0298 0.5
Schistosoma mansoni aldehyde dehydrogenase 0.006 0.4619 0.4619
Echinococcus granulosus tm gpcr rhodopsin 0.0012 0.0298 0.0167
Loa Loa (eye worm) hypothetical protein 0.0012 0.0298 0.0298
Brugia malayi Dopamine receptor protein 2 0.0012 0.0298 0.0298
Echinococcus multilocularis alpha 1A adrenergic receptor 0.0012 0.0298 0.0167
Echinococcus multilocularis neuropeptide s receptor 0.0012 0.0298 0.0167
Schistosoma mansoni hypothetical protein 0.0041 0.2923 0.2923
Loa Loa (eye worm) hypothetical protein 0.0012 0.0298 0.0298
Brugia malayi hypothetical protein 0.0012 0.0298 0.0298
Plasmodium vivax isocitrate dehydrogenase [NADP], mitochondrial, putative 0.0019 0.0959 1
Brugia malayi cytochrome P450 0.0121 1 1
Echinococcus granulosus cytochrome P450 2K1 0.0121 1 1
Echinococcus multilocularis thyrotropin releasing hormone receptor 0.0012 0.0298 0.0167
Echinococcus granulosus allatostatin A receptor 0.0012 0.0298 0.0167
Loa Loa (eye worm) hypothetical protein 0.0012 0.0298 0.0298
Schistosoma mansoni opsin-like receptor 0.0012 0.0298 0.0298
Echinococcus granulosus peptide allatostatin:somatostatin 0.0012 0.0298 0.0167
Schistosoma mansoni peptide (allatostatin/somatostatin)-like receptor 0.0012 0.0298 0.0298
Leishmania major cytochrome p450-like protein 0.0121 1 1
Brugia malayi Latrophilin receptor protein 2 0.0019 0.0956 0.0956
Mycobacterium tuberculosis Probable cytochrome P450 138 Cyp138 0.0121 1 1
Loa Loa (eye worm) hypothetical protein 0.0012 0.0298 0.0298
Echinococcus granulosus neuropeptide receptor 0.0012 0.0298 0.0167
Loa Loa (eye worm) hypothetical protein 0.0012 0.0298 0.0298
Loa Loa (eye worm) hypothetical protein 0.0012 0.0298 0.0298
Brugia malayi isocitrate dehydrogenase 0.0019 0.0959 0.0959
Mycobacterium tuberculosis Probable cytochrome P450 130 Cyp130 0.0121 1 1
Onchocerca volvulus 0.0012 0.0298 0.5
Schistosoma mansoni biogenic amine receptor 0.0012 0.0298 0.0298
Mycobacterium tuberculosis Possible cytochrome P450 135B1 Cyp135B1 0.0121 1 1
Trypanosoma cruzi isocitrate dehydrogenase [NADP], mitochondrial precursor, putative 0.0019 0.0959 0.0838
Echinococcus multilocularis serotonin receptor 0.0012 0.0298 0.0167
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0045 0.3298 0.3298
Onchocerca volvulus 0.0012 0.0298 0.5
Onchocerca volvulus 0.0012 0.0298 0.5
Mycobacterium tuberculosis Probable cytochrome P450 128 Cyp128 0.0121 1 1
Brugia malayi exodeoxyribonuclease III family protein 0.0019 0.0921 0.0921
Plasmodium falciparum isocitrate dehydrogenase [NADP], mitochondrial 0.0019 0.0959 1
Echinococcus multilocularis neuropeptide Y receptor 0.0012 0.0298 0.0167
Echinococcus granulosus alpha 1A adrenergic receptor 0.0012 0.0298 0.0167
Loa Loa (eye worm) G-protein-linked acetylcholine receptor protein 2 0.0012 0.0298 0.0298
Brugia malayi Dopamine receptor protein 1 0.0012 0.0298 0.0298
Brugia malayi gonadotropin-releasing hormone receptor 2 0.0012 0.0298 0.0298
Echinococcus granulosus neuropeptide Y receptor 0.0012 0.0298 0.0167
Brugia malayi Tachykinin-like peptides receptor 99D 0.0012 0.0298 0.0298
Schistosoma mansoni biogenic amine (5HT) receptor 0.0012 0.0298 0.0298
Loa Loa (eye worm) hypothetical protein 0.0012 0.0298 0.0298
Leishmania major aldehyde dehydrogenase, mitochondrial precursor 0.006 0.4619 0.4547
Schistosoma mansoni neuropeptide receptor 0.0012 0.0298 0.0298
Echinococcus granulosus rhodopsin orphan GPCR 0.0012 0.0298 0.0167
Schistosoma mansoni growth hormone secretagogue receptor 0.0012 0.0298 0.0298
Echinococcus granulosus GPCR family 2 0.0019 0.0956 0.0835
Trypanosoma brucei Lanosterol 14-alpha demethylase 0.0121 1 1
Loa Loa (eye worm) hypothetical protein 0.0012 0.0298 0.0298

Activities

Activity type Activity value Assay description Source Reference
Potency (functional) 3.5481 uM PubChem BioAssay. qHTS of GLP-1 Receptor Inverse Agonists (Inhibition Mode). (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 11.2202 uM PUBCHEM_BIOASSAY: qHTS for Inhibitors of TGF-b: Cytotox Counterscreen. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID588855, AID588860] ChEMBL. No reference
Potency (functional) 14.581 uM PubChem BioAssay. qHTS for induction of synthetic lethality in tumor cells producing 2HG: qHTS for the HT-1080-NT fibrosarcoma cell line. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 31.6228 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
Homo sapiens 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.
 
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

No literature references available for this target.

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