Detailed information for compound 1077860

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 465.484 | Formula: C24H27F4N3O2
  • H donors: 0 H acceptors: 2 LogP: 4.53 Rotable bonds: 7
    Rule of 5 violations (Lipinski): 1
  • SMILES: FC(C(Oc1ccccc1CN1CCC2(CC1)CCN(CC2)C(=O)c1ccncc1)(F)F)F
  • InChi: 1S/C24H27F4N3O2/c25-22(26)24(27,28)33-20-4-2-1-3-19(20)17-30-13-7-23(8-14-30)9-15-31(16-10-23)21(32)18-5-11-29-12-6-18/h1-6,11-12,22H,7-10,13-17H2
  • InChiKey: ZQYTURKIACTXPU-UHFFFAOYSA-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 chemokine (C-C motif) receptor 8 Starlite/ChEMBL References
Homo sapiens potassium voltage-gated channel, subfamily H (eag-related), member 2 Starlite/ChEMBL References

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Brugia malayi Voltage-gated potassium channel, HERG (KCNH2)-related. C. elegans unc-103 ortholog Get druggable targets OG5_128858 All targets in OG5_128858
Schistosoma japonicum ko:K04910 potassium voltage-gated channel, Eag-related subfamily H, member 7, putative Get druggable targets OG5_128858 All targets in OG5_128858
Schistosoma japonicum ko:K04910 potassium voltage-gated channel, Eag-related subfamily H, member 7, putative Get druggable targets OG5_128858 All targets in OG5_128858
Trichomonas vaginalis voltage and ligand gated potassium channel, putative Get druggable targets OG5_128858 All targets in OG5_128858
Schistosoma japonicum Potassium voltage-gated channel subfamily H member 2, putative Get druggable targets OG5_128858 All targets in OG5_128858
Echinococcus granulosus potassium voltage gated channel subfamily H Get druggable targets OG5_128858 All targets in OG5_128858
Loa Loa (eye worm) voltage and ligand gated potassium channel Get druggable targets OG5_128858 All targets in OG5_128858
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_128858 All targets in OG5_128858
Schistosoma mansoni voltage-gated potassium channel Get druggable targets OG5_128858 All targets in OG5_128858
Echinococcus multilocularis potassium voltage gated channel subfamily H Get druggable targets OG5_128858 All targets in OG5_128858
Trichomonas vaginalis voltage and ligand gated potassium channel, putative Get druggable targets OG5_128858 All targets in OG5_128858
Schistosoma mansoni voltage-gated potassium channel Get druggable targets OG5_128858 All targets in OG5_128858
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
Echinococcus multilocularis smad 0.0017 0.005 0.005
Brugia malayi cytoplasmic intermediate filament protein 0.0017 0.0048 0.0167
Mycobacterium tuberculosis Probable dehydrogenase 0.0087 0.0797 0.8837
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0051 0.0411 0.143
Toxoplasma gondii thioredoxin reductase 0.0038 0.0275 1
Echinococcus granulosus short transient receptor potential channel 6 0.0074 0.0661 0.2471
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0051 0.0411 0.1535
Brugia malayi Voltage-gated potassium channel, HERG (KCNH2)-related. C. elegans unc-103 ortholog 0.0048 0.0381 0.1327
Brugia malayi MH2 domain containing protein 0.0017 0.005 0.0173
Echinococcus multilocularis potassium voltage gated channel subfamily H 0.0048 0.0381 0.0381
Schistosoma mansoni hypothetical protein 0.0189 0.1879 1
Echinococcus multilocularis NADP dependent isocitrate dehydrogenase 0.0018 0.0055 0.0055
Schistosoma mansoni hypothetical protein 0.0049 0.0393 0.2094
Echinococcus granulosus intermediate filament protein 0.0032 0.0205 0.0765
Schistosoma mansoni dihydrolipoamide dehydrogenase 0.0013 0.0009 0.0046
Echinococcus granulosus phosphatidylinositol 3 and 4 kinase 0.0018 0.0062 0.0233
Brugia malayi dihydrolipoyl dehydrogenase, mitochondrial precursor, putative 0.0013 0.0009 0.003
Echinococcus multilocularis NADP dependent isocitrate dehydrogenase 0.0018 0.0055 0.0055
Trichomonas vaginalis PIKK family atypical protein kinase 0.0018 0.0062 0.022
Echinococcus multilocularis caspase 2 0.0062 0.0533 0.0533
Mycobacterium tuberculosis Probable reductase 0.0087 0.0797 0.8837
Mycobacterium ulcerans dihydrolipoamide dehydrogenase 0.0013 0.0009 0.5
Loa Loa (eye worm) voltage and ligand gated potassium channel 0.0048 0.0381 0.1327
Trichomonas vaginalis PIKK family atypical protein kinase 0.0018 0.0062 0.022
Echinococcus multilocularis lamin dm0 0.0032 0.0205 0.0205
Echinococcus granulosus apoptotic protease activating factor 1 0.0062 0.0533 0.1992
Loa Loa (eye worm) pre-SET domain-containing protein family protein 0.0244 0.2468 0.8595
Schistosoma mansoni hypothetical protein 0.0035 0.0242 0.1288
Trichomonas vaginalis PIKK family atypical protein kinase 0.0018 0.0062 0.022
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0035 0.0241 0.128
Giardia lamblia GTOR 0.0018 0.0062 1
Trypanosoma brucei isocitrate dehydrogenase, putative 0.0018 0.0055 0.1744
Schistosoma mansoni voltage-gated potassium channel 0.0017 0.0044 0.0232
Trichomonas vaginalis mercuric reductase, putative 0.0013 0.0009 0.0031
Trichomonas vaginalis PIKK family atypical protein kinase 0.0018 0.0062 0.022
Loa Loa (eye worm) hypothetical protein 0.0031 0.0198 0.0691
Brugia malayi Isocitrate dehydrogenase 0.0018 0.0055 0.0192
Echinococcus granulosus 5'partial|histone lysine N methyltransferase SETDB2 0.0034 0.0227 0.0848
Trypanosoma cruzi Phosphatidylinositol 3-kinase tor2 0.0018 0.0062 0.2013
Echinococcus granulosus transient receptor potential gamma protein 0.0111 0.1051 0.393
Echinococcus multilocularis dihydrolipoamide dehydrogenase 0.0013 0.0009 0.0009
Loa Loa (eye worm) hypothetical protein 0.0015 0.0024 0.0084
Mycobacterium tuberculosis Probable nitrite reductase [NAD(P)H] large subunit [FAD flavoprotein] NirB 0.0087 0.0797 0.8837
Trichomonas vaginalis voltage and ligand gated potassium channel, putative 0.0042 0.0312 0.1102
Schistosoma mansoni ataxia telangiectasia mutated (atm) 0.0025 0.0135 0.0718
Trichomonas vaginalis PIKK family atypical protein kinase 0.0018 0.0062 0.022
Toxoplasma gondii target of rapamycin (TOR), putative 0.0018 0.0062 0.2013
Brugia malayi Intermediate filament tail domain containing protein 0.0032 0.0205 0.0712
Trichomonas vaginalis PIKK family atypical protein kinase 0.0018 0.0062 0.022
Onchocerca volvulus 0.0062 0.0533 0.1252
Trypanosoma brucei isocitrate dehydrogenase [NADP], mitochondrial precursor, putative 0.0018 0.0055 0.1744
Echinococcus multilocularis GPCR, family 2 0.0035 0.0242 0.0242
Schistosoma mansoni smad1 5 8 and 0.0017 0.005 0.0264
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0282 0.2871 1
Echinococcus granulosus potassium voltage gated channel subfamily H 0.0017 0.0044 0.0163
Loa Loa (eye worm) hypothetical protein 0.0037 0.0258 0.0897
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0111 0.1051 0.366
Echinococcus granulosus NADP dependent isocitrate dehydrogenase 0.0018 0.0055 0.0206
Echinococcus multilocularis serine protein kinase ATM 0.0025 0.0135 0.0135
Echinococcus multilocularis isocitrate dehydrogenase 2 (NADP+) 0.0018 0.0055 0.0055
Echinococcus multilocularis Smad4 0.0017 0.005 0.005
Trypanosoma cruzi target of rapamycin kinase 3 0.0018 0.0062 0.2013
Onchocerca volvulus 0.0054 0.044 0.0898
Schistosoma mansoni voltage-gated potassium channel 0.0017 0.0044 0.0232
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.0025 0.0135 0.047
Loa Loa (eye worm) hypothetical protein 0.0042 0.0318 0.1109
Brugia malayi Latrophilin receptor protein 2 0.0035 0.0242 0.0843
Trypanosoma cruzi phosphatidylinositol 3-related kinase, putative 0.0018 0.0062 0.2013
Trichomonas vaginalis PIKK family atypical protein kinase 0.0018 0.0062 0.022
Plasmodium falciparum ataxin-2 like protein, putative 0.0025 0.0139 0.4894
Echinococcus multilocularis short transient receptor potential channel 6 0.0074 0.0661 0.0661
Wolbachia endosymbiont of Brugia malayi dihydrolipoamide dehydrogenase E3 component 0.0013 0.0009 0.5
Mycobacterium tuberculosis Probable oxidoreductase 0.0097 0.09 1
Trichomonas vaginalis PIKK family atypical protein kinase 0.0018 0.0062 0.022
Leishmania major target of rapamycin (TOR) kinase 1, putative 0.0018 0.0062 0.2013
Echinococcus multilocularis apoptotic protease activating factor 1 0.0062 0.0533 0.0533
Trichomonas vaginalis PIKK family atypical protein kinase 0.0018 0.0062 0.022
Trypanosoma brucei target of rapamycin kinase 3, putative 0.0018 0.0062 0.2013
Echinococcus multilocularis cytoplasmic intermediate filament protein 0.0015 0.003 0.003
Echinococcus multilocularis short transient receptor potential channel 6 0.0074 0.0661 0.0661
Trichomonas vaginalis PIKK family atypical protein kinase 0.0018 0.0062 0.022
Leishmania major trypanothione reductase 0.0038 0.0275 1
Trichomonas vaginalis glutathione reductase, putative 0.0013 0.0009 0.0031
Trichomonas vaginalis PIKK family atypical protein kinase 0.0018 0.0062 0.022
Onchocerca volvulus Cell death protein 3 homolog 0.0062 0.0533 0.1252
Echinococcus multilocularis NADP dependent isocitrate dehydrogenase 0.0018 0.0055 0.0055
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0051 0.0411 0.2185
Trichomonas vaginalis PIKK family atypical protein kinase 0.0018 0.0062 0.022
Mycobacterium tuberculosis NAD(P)H quinone reductase LpdA 0.0097 0.09 1
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0051 0.0411 0.1535
Schistosoma mansoni transient receptor potential channel 0.0111 0.1051 0.5593
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0051 0.0411 0.2185
Echinococcus granulosus survival motor neuron protein 1 0.0263 0.2675 1
Trichomonas vaginalis PIKK family atypical protein kinase 0.0018 0.0062 0.022
Plasmodium falciparum ataxin-2 like protein, putative 0.0025 0.0139 0.4894
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.0206 0.2062 0.7711
Loa Loa (eye worm) hypothetical protein 0.0062 0.0533 0.1856
Echinococcus granulosus cadherin EGF LAG seven pass G type receptor 0.0035 0.0242 0.0905
Schistosoma mansoni smad 0.0017 0.005 0.0264
Trypanosoma brucei phosphatidylinositol kinase related protein, putative 0.0025 0.0135 0.4746
Trypanosoma brucei phosphatidylinositol 3-related kinase, putative 0.0018 0.0062 0.2013
Loa Loa (eye worm) cytoplasmic intermediate filament protein 0.0017 0.0048 0.0167
Plasmodium falciparum glutathione reductase 0.0038 0.0275 1
Schistosoma mansoni smad1 5 8 and 0.0017 0.005 0.0264
Loa Loa (eye worm) hypothetical protein 0.0015 0.003 0.0105
Trypanosoma cruzi Phosphatidylinositol 3-kinase tor1 0.0018 0.0062 0.2013
Plasmodium falciparum thioredoxin reductase 0.0038 0.0275 1
Trichomonas vaginalis PIKK family atypical protein kinase 0.0018 0.0062 0.022
Brugia malayi Iron-sulfur cluster assembly accessory protein 0.0054 0.044 0.1533
Trichomonas vaginalis PIKK family atypical protein kinase 0.0018 0.0062 0.022
Echinococcus granulosus lamin dm0 0.0032 0.0205 0.0765
Loa Loa (eye worm) thioredoxin reductase 0.0038 0.0275 0.0957
Chlamydia trachomatis dihydrolipoyl dehydrogenase 0.0013 0.0009 0.5
Echinococcus multilocularis voltage gated potassium channel 0.0017 0.0044 0.0044
Loa Loa (eye worm) hypothetical protein 0.0043 0.0327 0.114
Plasmodium vivax ataxin-2 like protein, putative 0.0025 0.0139 0.4894
Schistosoma mansoni voltage-gated potassium channel 0.0052 0.0425 0.2261
Echinococcus multilocularis transient receptor potential ion channel A 0.0104 0.0981 0.0981
Brugia malayi latrophilin 2 splice variant baaae 0.0076 0.0677 0.2356
Schistosoma mansoni hypothetical protein 0.0035 0.0242 0.1288
Toxoplasma gondii isocitrate dehydrogenase 0.0018 0.0055 0.1744
Brugia malayi Thioredoxin reductase 0.0038 0.0275 0.0957
Schistosoma mansoni lamin 0.0032 0.0205 0.1088
Schistosoma mansoni transient receptor potential channel 0.0074 0.0661 0.3517
Wolbachia endosymbiont of Brugia malayi dihydrolipoamide dehydrogenase E3 component 0.0013 0.0009 0.5
Echinococcus granulosus dihydrolipoamide dehydrogenase 0.0013 0.0009 0.0033
Loa Loa (eye worm) MH1 domain-containing protein 0.0017 0.005 0.0173
Echinococcus multilocularis TGF beta signal transducer SmadC 0.0017 0.005 0.005
Brugia malayi MH2 domain containing protein 0.0017 0.005 0.0173
Trypanosoma cruzi PAB1-binding protein , putative 0.0025 0.0139 0.4894
Brugia malayi hypothetical protein 0.0263 0.2675 0.9314
Echinococcus granulosus TGF beta signal transducer SmadC 0.0017 0.005 0.0186
Schistosoma mansoni Smad4 0.0017 0.005 0.0264
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.0018 0.0062 0.0217
Schistosoma mansoni lamin 0.0032 0.0205 0.1088
Echinococcus multilocularis histone lysine methyltransferase setb histone lysine methyltransferase eggless 0.0035 0.0241 0.0241
Schistosoma mansoni hypothetical protein 0.0054 0.044 0.2342
Mycobacterium tuberculosis Dihydrolipoamide dehydrogenase LpdC (lipoamide reductase (NADH)) (lipoyl dehydrogenase) (dihydrolipoyl dehydrogenase) (diaphoras 0.0097 0.09 1
Schistosoma mansoni ataxia telangiectasia mutated (atm)-related 0.0018 0.0062 0.0331
Loa Loa (eye worm) hypothetical protein 0.0263 0.2675 0.9314
Echinococcus multilocularis thioredoxin glutathione reductase 0.0039 0.028 0.028
Trypanosoma brucei phosphatidylinositol 4-kinase, putative 0.0018 0.0062 0.2013
Echinococcus multilocularis geminin 0.0189 0.1879 0.1879
Mycobacterium tuberculosis Putative ferredoxin reductase 0.0087 0.0797 0.8837
Trypanosoma brucei Phosphatidylinositol 3-kinase tor1 0.0018 0.0062 0.2013
Echinococcus multilocularis TRP (transient receptor potential) channel 0.0043 0.0327 0.0327
Trichomonas vaginalis PIKK family atypical protein kinase 0.0018 0.0062 0.022
Loa Loa (eye worm) hypothetical protein 0.0015 0.0024 0.0084
Echinococcus granulosus voltage gated potassium channel 0.0017 0.0044 0.0163
Schistosoma mansoni caspase-7 (C14 family) 0.0062 0.0533 0.2836
Trichomonas vaginalis PIKK family atypical protein kinase 0.0018 0.0062 0.022
Echinococcus granulosus smad 0.0017 0.005 0.0186
Loa Loa (eye worm) transcription factor SMAD2 0.0251 0.254 0.8847
Trichomonas vaginalis PIKK family atypical protein kinase 0.0018 0.0062 0.022
Trypanosoma cruzi phosphatidylinositol 3-related kinase, putative 0.0018 0.0062 0.2013
Echinococcus multilocularis potassium voltage gated channel subfamily H 0.0017 0.0044 0.0044
Trichomonas vaginalis PIKK family atypical protein kinase 0.0018 0.0062 0.022
Plasmodium vivax isocitrate dehydrogenase [NADP], mitochondrial, putative 0.0018 0.0055 0.1744
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0051 0.0411 0.0411
Schistosoma mansoni hypothetical protein 0.0189 0.1879 1
Echinococcus granulosus histone lysine methyltransferase setb 0.0035 0.0241 0.0899
Loa Loa (eye worm) hypothetical protein 0.0025 0.0139 0.0484
Trichomonas vaginalis PIKK family atypical protein kinase 0.0018 0.0062 0.022
Onchocerca volvulus 0.0035 0.0241 0.0137
Brugia malayi Pre-SET motif family protein 0.0035 0.0241 0.0838
Echinococcus multilocularis histone lysine N methyltransferase SETMAR 0.0035 0.0241 0.0241
Trypanosoma cruzi phosphatidylinositol kinase related protein, putative 0.0025 0.0135 0.4746
Echinococcus granulosus caspase 2 0.0062 0.0533 0.1992
Trichomonas vaginalis PIKK family atypical protein kinase 0.0025 0.0135 0.0477
Mycobacterium ulcerans flavoprotein disulfide reductase 0.0013 0.0009 0.5
Trypanosoma brucei phosphatidylinositol 3-kinase, putative 0.0018 0.0062 0.2013
Mycobacterium leprae DIHYDROLIPOAMIDE DEHYDROGENASE LPD (LIPOAMIDE REDUCTASE (NADH)) (LIPOYL DEHYDROGENASE) (DIHYDROLIPOYL DEHYDROGENASE) (DIAPHORASE 0.0097 0.09 1
Mycobacterium tuberculosis NADPH-dependent mycothiol reductase Mtr 0.0038 0.0275 0.2985
Echinococcus granulosus serine protein kinase ATM 0.0025 0.0135 0.0505
Treponema pallidum NADH oxidase 0.0013 0.0009 0.5
Leishmania major phosphatidylinositol 3-related kinase, putative 0.0018 0.0062 0.2013
Brugia malayi MH1 domain containing protein 0.0017 0.005 0.0173
Leishmania major hypothetical protein, conserved 0.0025 0.0139 0.4894
Loa Loa (eye worm) isocitrate dehydrogenase 0.0018 0.0055 0.0192
Echinococcus granulosus mothers against decapentaplegic 5 0.0017 0.005 0.0186
Trichomonas vaginalis PIKK family atypical protein kinase 0.0018 0.0062 0.022
Trichomonas vaginalis PIKK family atypical protein kinase 0.0018 0.0062 0.022
Brugia malayi Transient-receptor-potential like protein 0.0043 0.0327 0.114
Mycobacterium tuberculosis Probable isocitrate dehydrogenase [NADP] Icd1 (oxalosuccinate decarboxylase) (IDH) (NADP+-specific ICDH) (IDP) 0.0018 0.0055 0.0521
Echinococcus granulosus short transient receptor potential channel 6 0.0074 0.0661 0.2471
Loa Loa (eye worm) Smad1 0.0017 0.005 0.0173
Echinococcus multilocularis isocitrate dehydrogenase 0.0018 0.0055 0.0055
Echinococcus multilocularis survival motor neuron protein 1 0.0263 0.2675 0.2675
Echinococcus multilocularis phosphatidylinositol 3 and 4 kinase 0.0018 0.0062 0.0062
Echinococcus multilocularis cadherin EGF LAG seven pass G type receptor 0.0035 0.0242 0.0242
Brugia malayi isocitrate dehydrogenase 0.0018 0.0055 0.0192
Loa Loa (eye worm) hypothetical protein 0.0062 0.0533 0.1856
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0035 0.0241 0.128
Schistosoma mansoni TGF-beta signal transducer Smad2 0.0017 0.005 0.0264
Brugia malayi MH2 domain containing protein 0.0251 0.254 0.8847
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.0206 0.2062 0.2062
Echinococcus granulosus thioredoxin glutathione reductase 0.0039 0.028 0.1048
Schistosoma mansoni survival motor neuron protein 0.0054 0.044 0.2342
Loa Loa (eye worm) intermediate filament tail domain-containing protein 0.0032 0.0205 0.0712
Loa Loa (eye worm) hypothetical protein 0.0035 0.0242 0.0843
Echinococcus granulosus FKBP12 rapamycin complex associated protein 0.0018 0.0062 0.0233
Trypanosoma brucei trypanothione reductase 0.0038 0.0275 1
Trichomonas vaginalis set domain proteins, putative 0.0277 0.2827 1
Plasmodium vivax SET domain protein, putative 0.0035 0.0241 0.8713
Plasmodium vivax glutathione reductase, putative 0.0038 0.0275 1
Echinococcus multilocularis FKBP12 rapamycin complex associated protein 0.0018 0.0062 0.0062
Loa Loa (eye worm) hypothetical protein 0.0032 0.0205 0.0712
Trichomonas vaginalis PIKK family atypical protein kinase 0.0018 0.0062 0.022
Trypanosoma cruzi isocitrate dehydrogenase [NADP], mitochondrial precursor, putative 0.0018 0.0055 0.1744
Schistosoma mansoni intermediate filament proteins 0.0032 0.0205 0.1088
Plasmodium falciparum isocitrate dehydrogenase [NADP], mitochondrial 0.0018 0.0055 0.1744
Plasmodium vivax thioredoxin reductase, putative 0.0038 0.0275 1
Loa Loa (eye worm) glutathione reductase 0.0038 0.0275 0.0957
Loa Loa (eye worm) hypothetical protein 0.0035 0.0241 0.0838
Loa Loa (eye worm) hypothetical protein 0.0282 0.2871 1
Trichomonas vaginalis PIKK family atypical protein kinase 0.0018 0.0062 0.022
Loa Loa (eye worm) hypothetical protein 0.0017 0.0044 0.0152
Echinococcus multilocularis transient receptor potential gamma protein 0.0111 0.1051 0.1051
Brugia malayi Pre-SET motif family protein 0.0244 0.2468 0.8595
Leishmania major phosphatidylinositol 3-kinase, putative 0.0018 0.0062 0.2013
Schistosoma mansoni transient receptor potential channel 4 0.0111 0.1051 0.5593
Toxoplasma gondii FATC domain-containing protein 0.0025 0.0135 0.4746
Toxoplasma gondii isocitrate dehydrogenase 0.0018 0.0055 0.1744
Schistosoma mansoni phosphatidylinositol 3-and 4-kinase 0.0018 0.0062 0.0331
Trypanosoma cruzi isocitrate dehydrogenase, putative 0.0018 0.0055 0.1744
Schistosoma mansoni hypothetical protein 0.0062 0.0533 0.2836
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0051 0.0411 0.143
Brugia malayi hypothetical protein 0.0016 0.0043 0.0149
Loa Loa (eye worm) hypothetical protein 0.0022 0.0098 0.034
Leishmania major phosphatidylinositol kinase related protein, putative 0.0018 0.0063 0.2027
Echinococcus multilocularis musashi 0.0032 0.0205 0.0205
Loa Loa (eye worm) MH2 domain-containing protein 0.0251 0.254 0.8847
Trypanosoma cruzi phosphatidylinositol kinase related protein, putative 0.0018 0.0063 0.2027
Entamoeba histolytica hypothetical protein 0.0025 0.0135 1
Mycobacterium tuberculosis Probable membrane NADH dehydrogenase NdhA 0.0087 0.0797 0.8837
Trypanosoma brucei PAB1-binding protein , putative 0.0025 0.0139 0.4894
Schistosoma mansoni voltage-gated potassium channel 0.0052 0.0425 0.2261
Mycobacterium tuberculosis Probable NADH dehydrogenase Ndh 0.0087 0.0797 0.8837
Toxoplasma gondii histone lysine methyltransferase SET/SUV39 0.0035 0.0241 0.8713
Onchocerca volvulus 0.0277 0.2827 1
Trypanosoma cruzi PAB1-binding protein , putative 0.0025 0.0139 0.4894
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0051 0.0411 0.0411
Loa Loa (eye worm) phosphatidylinositol 3 0.0018 0.0062 0.0217
Trichomonas vaginalis PIKK family atypical protein kinase 0.0018 0.0062 0.022
Brugia malayi hypothetical protein 0.0025 0.0139 0.0484
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.0018 0.0062 0.0217
Schistosoma mansoni smad1 5 8 and 0.0017 0.005 0.0264
Loa Loa (eye worm) MH2 domain-containing protein 0.0017 0.005 0.0173
Brugia malayi Voltage-gated potassium channel, EAG (KCNH1)-related. C. elegans egl-2 ortholog 0.0017 0.0044 0.0152
Mycobacterium ulcerans dihydrolipoamide dehydrogenase, LpdB 0.0013 0.0009 0.5
Echinococcus granulosus cytoplasmic intermediate filament protein 0.0015 0.003 0.0113
Brugia malayi intermediate filament protein 0.0032 0.0205 0.0712
Leishmania major target of rapamycin kinase (TOR) kinase 3 0.0018 0.0062 0.2013
Loa Loa (eye worm) hypothetical protein 0.0111 0.1051 0.366
Brugia malayi Cell death protein 3 precursor 0.0062 0.0533 0.1856
Loa Loa (eye worm) hypothetical protein 0.0068 0.0591 0.2059
Loa Loa (eye worm) hypothetical protein 0.0076 0.0677 0.2356
Echinococcus granulosus TRP transient receptor potential channel 0.0043 0.0327 0.1224
Schistosoma mansoni hypothetical protein 0.0035 0.0242 0.1288
Echinococcus granulosus GPCR family 2 0.0035 0.0242 0.0905
Schistosoma mansoni hypothetical protein 0.0035 0.0242 0.1288
Loa Loa (eye worm) phosphatidylinositol 3 0.0018 0.0062 0.0217
Schistosoma mansoni transient receptor potential channel 0.0074 0.0661 0.3517
Brugia malayi MH1 domain containing protein 0.0017 0.005 0.0173
Trichomonas vaginalis PIKK family atypical protein kinase 0.0018 0.0062 0.022
Trypanosoma cruzi trypanothione reductase, putative 0.0038 0.0275 1
Leishmania major isocitrate dehydrogenase [NADP], mitochondrial precursor, putative 0.0018 0.0055 0.1744
Leishmania major target of rapamycin (TOR) kinase 2, putative 0.0018 0.0062 0.2013
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.0035 0.0242 0.0843
Echinococcus granulosus lamin 0.0032 0.0205 0.0765
Loa Loa (eye worm) latrophilin receptor protein 2 0.0035 0.0242 0.0843
Trichomonas vaginalis voltage and ligand gated potassium channel, putative 0.0042 0.0312 0.1102
Trichomonas vaginalis PIKK family atypical protein kinase 0.0018 0.0062 0.022
Trichomonas vaginalis PIKK family atypical protein kinase 0.0018 0.0062 0.022
Brugia malayi Smad1 0.0017 0.005 0.0173
Brugia malayi Calcitonin receptor-like protein seb-1 0.0111 0.1051 0.366
Echinococcus multilocularis mothers against decapentaplegic 5 0.0017 0.005 0.005
Echinococcus granulosus transient receptor potential ion channel A 0.0104 0.0981 0.3669
Trichomonas vaginalis PIKK family atypical protein kinase 0.0018 0.0062 0.022
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0051 0.0411 0.2185
Schistosoma mansoni histone-lysine n-methyltransferase suv9 0.0035 0.0241 0.128
Echinococcus multilocularis lamin 0.0032 0.0205 0.0205
Schistosoma mansoni hypothetical protein 0.0076 0.0677 0.3601
Brugia malayi hypothetical protein 0.0062 0.0533 0.1856
Schistosoma mansoni NADP-specific isocitrate dehydrogenase 0.0018 0.0055 0.0293
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0035 0.0241 0.128
Echinococcus granulosus Smad4 0.0017 0.005 0.0186
Toxoplasma gondii LsmAD domain-containing protein 0.0025 0.0139 0.4894
Trypanosoma cruzi phosphatidylinositol kinase related protein, putative 0.0022 0.0098 0.3338
Brugia malayi glutathione reductase 0.0038 0.0275 0.0957
Echinococcus granulosus geminin 0.0189 0.1879 0.7026
Loa Loa (eye worm) intermediate filament protein 0.0032 0.0205 0.0712
Echinococcus granulosus potassium voltage gated channel subfamily H 0.0048 0.0381 0.1425

Activities

Activity type Activity value Assay description Source Reference
IC50 (binding) = 4.77 Displacement of [3H]dofetilide from human recombinant ERG expressed in HEK293 cells by patch clamp method ChEMBL. 19954248
IC50 (binding) = 5.29 Inhibition of wild type human ERG expressed in CHOK1 cells by whole-cell plate-based electrophysiology ChEMBL. 19954248
IC50 (functional) = 6.28 Antagonist activity at human CCR8 ChEMBL. 19954248

Phenotypes

Whole-cell/tissue/organism interactions

We have no records of whole-cell/tissue assays done with this compound What does this mean?

Many chemical entities in TDR Targets come from high-throughput screenings with whole cells or tissue samples, and not all assayed compounds have been tested against a single a single target protein, probably because they get ruled out during screening process. Even if these compounds may have not been of interest in the original screening, they may come as interesting leads for other screening assays. Furthermore, we may be able to propose drug-target associations using chemical similarities and network patterns.

Annotated phenotypes:

We have no manually annotated phenotypes for this drug. What does this mean? / Care to help?
In TDR Targets, information about phenotypes that are caused by drugs, or by genetic manipulation of cells (e.g. gene knockouts or knockdowns) is manually curated from the literature. These descriptions help to describe the potential of the target for drug development. If no information is available for this gene or if the information is incomplete, this may mean that i) the papers containing this information either appeared after the curation effort for this organism was carried out or they were inadvertently missed by curators; or that ii) the curation effort for this organism has not yet started.
 
In any case, if you have information about papers containing relevant validation data for this target, please log in using your TDR Targets username and password and send them to us using the corresponding form in this page (only visible to registered users) or contact us.

External resources for this compound

Bibliographic References

1 literature reference was collected for this gene.

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