Detailed information for compound 140856

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 371.356 | Formula: C20H16F3N3O
  • H donors: 2 H acceptors: 2 LogP: 4.05 Rotable bonds: 5
    Rule of 5 violations (Lipinski): 1
  • SMILES: O=C(Nc1ccc2c(c1)c(N)cc(n2)C)/C=C/c1ccc(cc1)C(F)(F)F
  • InChi: 1S/C20H16F3N3O/c1-12-10-17(24)16-11-15(7-8-18(16)25-12)26-19(27)9-4-13-2-5-14(6-3-13)20(21,22)23/h2-11H,1H3,(H2,24,25)(H,26,27)/b9-4+
  • InChiKey: DOZGFBDFGIPWCL-RUDMXATFSA-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 complement component 5a receptor 1 Starlite/ChEMBL References
Homo sapiens melanin-concentrating hormone receptor 1 Starlite/ChEMBL References

Predicted pathogen targets for this compound

By orthology
No druggable targets predicted by orthology data
By sequence similarity to non orthologous known druggable targets
Species Potential target Known druggable target Length Alignment span Identity
Echinococcus multilocularis G-protein coupled receptor, putative complement component 5a receptor 1 350 aa 293 aa 22.2 %
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Schistosoma mansoni hypothetical protein 0.0182 0.1401 0.2469
Echinococcus multilocularis muscleblind protein 1 0.0609 0.5098 0.8981
Echinococcus multilocularis GPCR, family 2 0.0049 0.0248 0.0421
Onchocerca volvulus 0.0041 0.0181 0.0586
Echinococcus granulosus transient receptor potential ion channel A 0.0101 0.0698 0.1215
Plasmodium falciparum ataxin-2 like protein, putative 0.0026 0.0053 0.2246
Brugia malayi Pre-SET motif family protein 0.0204 0.1589 0.3105
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.0049 0.0248 0.0469
Brugia malayi Nuclear hormone receptor family member nhr-3 0.004 0.0174 0.0323
Loa Loa (eye worm) hypothetical protein 0.0021 0.0009 0.0018
Schistosoma mansoni tar DNA-binding protein 0.0124 0.09 0.1586
Brugia malayi ecdysteroid receptor 0.004 0.0174 0.0323
Brugia malayi Muscleblind-like protein 0.0609 0.5098 1
Schistosoma mansoni transient receptor potential channel 0.0104 0.0728 0.1283
Echinococcus multilocularis FTZ F1 nuclear receptor protein 0.004 0.0174 0.029
Brugia malayi hypothetical protein 0.0041 0.0181 0.0337
Mycobacterium tuberculosis Conserved hypothetical membrane protein 0.005 0.0257 0.0129
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0045 0.0214 0.0402
Plasmodium falciparum ataxin-2 like protein, putative 0.0026 0.0053 0.2246
Onchocerca volvulus 0.0035 0.013 0.0297
Loa Loa (eye worm) nucleolar RNA-associated protein alpha 0.033 0.2688 0.5273
Echinococcus multilocularis beta LACTamase domain containing family member 0.0035 0.013 0.0214
Mycobacterium ulcerans exodeoxyribonuclease III protein XthA 0.0038 0.0156 0.0027
Leishmania major alpha glucosidase II subunit, putative 0.0035 0.0132 0.1261
Onchocerca volvulus 0.0081 0.0526 0.2553
Echinococcus multilocularis lamin 0.0081 0.0526 0.0912
Echinococcus multilocularis short transient receptor potential channel 6 0.0069 0.0422 0.0729
Echinococcus granulosus S formylglutathione hydrolase 0.005 0.0257 0.0438
Schistosoma mansoni hypothetical protein 0.0049 0.0248 0.0437
Brugia malayi Nuclear hormone receptor family member nhr-1 0.004 0.0174 0.0323
Loa Loa (eye worm) hypothetical protein 0.0039 0.0163 0.0321
Trichomonas vaginalis alpha-glucosidase, putative 0.0035 0.0132 0.0602
Loa Loa (eye worm) hypothetical protein 0.0035 0.013 0.0256
Brugia malayi LBP / BPI / CETP family, N-terminal domain containing protein 0.0096 0.0659 0.1277
Loa Loa (eye worm) nuclear hormone receptor family member nhr-49 0.004 0.0174 0.0341
Echinococcus multilocularis short transient receptor potential channel 6 0.0069 0.0422 0.0729
Schistosoma mansoni retinoid-x-receptor (RXR) 0.0021 0.0009 0.0016
Loa Loa (eye worm) hypothetical protein 0.004 0.0174 0.0341
Loa Loa (eye worm) hypothetical protein 0.0154 0.1161 0.2278
Loa Loa (eye worm) hypothetical protein 0.0055 0.0303 0.0595
Brugia malayi Glycosyl hydrolases family 31 protein 0.0159 0.1206 0.2352
Brugia malayi hypothetical protein 0.0055 0.0303 0.0578
Loa Loa (eye worm) hypothetical protein 0.0055 0.0303 0.0595
Trichomonas vaginalis alpha-glucosidase, putative 0.0035 0.0132 0.0602
Wolbachia endosymbiont of Brugia malayi exonuclease III 0.0038 0.0156 0.5
Echinococcus multilocularis lysosomal alpha glucosidase 0.0159 0.1206 0.2113
Onchocerca volvulus 0.0096 0.0659 0.3309
Schistosoma mansoni nuclear hormone receptor nor-1/nor-2 0.004 0.0174 0.0306
Schistosoma mansoni aldehyde dehydrogenase 0.0123 0.0888 0.1564
Onchocerca volvulus 0.0096 0.0659 0.3309
Echinococcus multilocularis TRP (transient receptor potential) channel 0.0039 0.0161 0.0268
Loa Loa (eye worm) hypothetical protein 0.0055 0.0303 0.0595
Loa Loa (eye worm) hypothetical protein 0.0026 0.0053 0.0103
Echinococcus granulosus histone lysine methyltransferase setb 0.0046 0.0223 0.0377
Schistosoma mansoni hypothetical protein 0.0049 0.0248 0.0437
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0046 0.0223 0.0392
Loa Loa (eye worm) hypothetical protein 0.0038 0.0151 0.0295
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0045 0.0214 0.0376
Trichomonas vaginalis D-aminoacylase, putative 0.0035 0.013 0.0596
Echinococcus granulosus microtubule associated protein 2 0.0675 0.5675 1
Loa Loa (eye worm) LBP/BPI/CETP family domain-containing protein 0.0055 0.0303 0.0595
Schistosoma mansoni hypothetical protein 0.0047 0.0235 0.0414
Echinococcus multilocularis histone lysine methyltransferase setb histone lysine methyltransferase eggless 0.0046 0.0223 0.0377
Loa Loa (eye worm) hypothetical protein 0.0105 0.0738 0.1449
Schistosoma mansoni hypothetical protein 0.0049 0.0248 0.0437
Schistosoma mansoni transcription factor LCR-F1 0.0035 0.0131 0.023
Schistosoma mansoni intermediate filament proteins 0.0081 0.0526 0.0927
Entamoeba histolytica hypothetical protein 0.0025 0.0043 0.0855
Echinococcus multilocularis Nuclear hormone receptor family member nhr 41 0.004 0.0174 0.029
Echinococcus granulosus geminin 0.0182 0.1401 0.2457
Schistosoma mansoni histone-lysine n-methyltransferase suv9 0.0029 0.0078 0.0138
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0045 0.0214 0.0376
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0046 0.0223 0.0392
Echinococcus multilocularis ecdysone induced protein 78C 0.004 0.0174 0.029
Echinococcus granulosus retinoic acid receptor rxr beta a 0.004 0.0174 0.029
Echinococcus multilocularis neutral alpha glucosidase AB 0.0035 0.0132 0.0216
Brugia malayi Calcitonin receptor-like protein seb-1 0.0154 0.1161 0.2264
Onchocerca volvulus 0.0047 0.0235 0.0893
Schistosoma mansoni transient receptor potential channel 0.0069 0.0422 0.0744
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.0049 0.0248 0.0421
Trichomonas vaginalis ap endonuclease, putative 0.0038 0.0156 0.074
Schistosoma mansoni Tr4/Tr2 (homologue) 0.004 0.0174 0.0306
Loa Loa (eye worm) hypothetical protein 0.0069 0.0425 0.0833
Trypanosoma cruzi PAB1-binding protein , putative 0.0026 0.0053 0.2246
Loa Loa (eye worm) hypothetical protein 0.0104 0.0728 0.1428
Brugia malayi exodeoxyribonuclease III family protein 0.0038 0.0156 0.0289
Brugia malayi MH2 domain containing protein 0.0118 0.0851 0.1655
Trichomonas vaginalis penicillin-binding protein, putative 0.0035 0.013 0.0596
Schistosoma mansoni cathepsin D (A01 family) 0.0053 0.0281 0.0495
Echinococcus granulosus survival motor neuron protein 1 0.0232 0.1834 0.322
Brugia malayi LBP/BPI 0.0041 0.0181 0.0337
Plasmodium vivax ataxin-2 like protein, putative 0.0026 0.0053 0.2246
Schistosoma mansoni ran 0.0023 0.0022 0.004
Trypanosoma brucei apurinic/apyrimidinic endonuclease, putative 0.0038 0.0156 1
Loa Loa (eye worm) glycosyl hydrolase family 31 protein 0.0159 0.1206 0.2366
Brugia malayi hypothetical protein 0.0055 0.0303 0.0578
Echinococcus multilocularis bromodomain adjacent to zinc finger domain 0.0058 0.0331 0.0568
Brugia malayi Bromodomain containing protein 0.0073 0.0461 0.0888
Leishmania major apurinic/apyrimidinic endonuclease-redox protein 0.0038 0.0156 0.1548
Trichomonas vaginalis esterase, putative 0.0035 0.013 0.0596
Echinococcus granulosus Nuclear hormone receptor family member nhr 41 0.004 0.0174 0.029
Loa Loa (eye worm) hypothetical protein 0.004 0.0174 0.0341
Loa Loa (eye worm) hypothetical protein 0.0038 0.0151 0.0295
Echinococcus granulosus hepatocyte nuclear factor 4 alpha 0.004 0.0174 0.029
Mycobacterium leprae SECRETED ANTIGEN 85-B FBPB (85B) (ANTIGEN 85 COMPLEX B) (MYCOLYL TRANSFERASE 85B) (FIBRONECTIN-BINDING PROTEIN B) (EXTRACELLULAR 0.005 0.0257 0.0129
Brugia malayi LBP / BPI / CETP family, C-terminal domain containing protein 0.0055 0.0303 0.0578
Treponema pallidum exodeoxyribonuclease (exoA) 0.0038 0.0156 0.5
Loa Loa (eye worm) hypothetical protein 0.0079 0.0513 0.1007
Toxoplasma gondii glycosyl hydrolase, family 31 protein 0.0035 0.0132 0.1261
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0045 0.0214 0.0361
Trypanosoma cruzi hypothetical protein, conserved 0.0035 0.013 0.8047
Loa Loa (eye worm) nuclear hormone receptor family member nhr-40 0.004 0.0174 0.0341
Trichomonas vaginalis set domain proteins, putative 0.0232 0.1833 1
Plasmodium vivax importin-beta 2, putative 0.0031 0.0093 0.5285
Trichomonas vaginalis Importin beta-1 subunit, putative 0.0025 0.0043 0.0111
Onchocerca volvulus 0.0035 0.013 0.0297
Schistosoma mansoni nuclear receptor 2DBD-gamma 0.004 0.0174 0.0306
Loa Loa (eye worm) hypothetical protein 0.0065 0.0392 0.0769
Brugia malayi Nuclear hormone receptor family member nhr-49 0.004 0.0174 0.0323
Loa Loa (eye worm) nuclear hormone receptor family member nhr-1 0.004 0.0174 0.0341
Mycobacterium tuberculosis Secreted antigen 85-C FbpC (85C) (antigen 85 complex C) (AG58C) (mycolyl transferase 85C) (fibronectin-binding protein C) 0.1174 1 1
Echinococcus granulosus 5'partial|histone lysine N methyltransferase SETDB2 0.0028 0.0069 0.0105
Onchocerca volvulus 0.0232 0.1833 1
Echinococcus multilocularis muscleblind protein 0.0609 0.5098 0.8981
Mycobacterium ulcerans aldehyde dehydrogenase 0.0123 0.0888 0.0767
Schistosoma mansoni thyroid hormone receptor 0.004 0.0174 0.0306
Schistosoma mansoni hypothetical protein 0.0049 0.0248 0.0437
Entamoeba histolytica exodeoxyribonuclease III, putative 0.0038 0.0156 0.5705
Schistosoma mansoni tar DNA-binding protein 0.0124 0.09 0.1586
Mycobacterium tuberculosis Secreted antigen 85-a FbpA (mycolyl transferase 85A) (fibronectin-binding protein A) (antigen 85 complex A) 0.005 0.0257 0.0129
Loa Loa (eye worm) hypothetical protein 0.004 0.0174 0.0341
Entamoeba histolytica hypothetical protein 0.0035 0.0131 0.4607
Mycobacterium tuberculosis Secreted antigen 85-B FbpB (85B) (antigen 85 complex B) (mycolyl transferase 85B) (fibronectin-binding protein B) (extracellular 0.005 0.0257 0.0129
Echinococcus granulosus snurportin 1 0.033 0.2688 0.4728
Echinococcus granulosus intermediate filament protein 0.0081 0.0526 0.0912
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0045 0.0214 0.0376
Schistosoma mansoni thyroid hormone receptor 0.004 0.0174 0.0306
Echinococcus multilocularis importin subunit beta 1 0.0031 0.0093 0.0148
Mycobacterium ulcerans secreted Mpt51/Mpb51 antigen protein FbpD 0.005 0.0257 0.0129
Brugia malayi Importin beta-1 subunit 0.0031 0.0093 0.0165
Loa Loa (eye worm) intermediate filament protein 0.0081 0.0526 0.1032
Echinococcus multilocularis GTP binding nuclear protein Ran 0.0023 0.0022 0.0023
Brugia malayi Transient-receptor-potential like protein 0.0039 0.0161 0.0298
Leishmania major hypothetical protein, conserved 0.0026 0.0053 0.0348
Brugia malayi Latrophilin receptor protein 2 0.0049 0.0248 0.0469
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.004 0.0174 0.029
Echinococcus multilocularis geminin 0.0182 0.1401 0.2457
Schistosoma mansoni RAR-like nuclear receptor 0.004 0.0174 0.0306
Entamoeba histolytica glycosyl hydrolase, family 31 protein 0.0035 0.0132 0.4644
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.0049 0.0248 0.0421
Trichomonas vaginalis alpha-glucosidase, putative 0.0035 0.0132 0.0602
Schistosoma mansoni FTZ-F1 nuclear receptor-like protein 0.004 0.0174 0.0306
Trichomonas vaginalis penicillin-binding protein, putative 0.0035 0.013 0.0596
Echinococcus granulosus nuclear receptor 2DBD gamma 0.004 0.0174 0.029
Echinococcus granulosus tar DNA binding protein 0.0124 0.09 0.1572
Schistosoma mansoni bromodomain containing protein 0.0062 0.0362 0.0637
Echinococcus granulosus neutral alpha glucosidase AB 0.0035 0.0132 0.0216
Loa Loa (eye worm) TAR-binding protein 0.0124 0.09 0.1766
Loa Loa (eye worm) nuclear hormone receptor family member nhr-31 0.004 0.0174 0.0341
Mycobacterium tuberculosis Probable conserved exported protein 0.005 0.0257 0.0129
Leishmania major importin beta-1 subunit, putative 0.0025 0.0043 0.0232
Loa Loa (eye worm) hypothetical protein 0.0035 0.013 0.0256
Echinococcus granulosus nuclear receptor 2DBD gamma 0.004 0.0174 0.029
Brugia malayi LBP / BPI / CETP family, C-terminal domain containing protein 0.0096 0.0659 0.1277
Echinococcus multilocularis transient receptor potential ion channel A 0.0101 0.0698 0.1215
Loa Loa (eye worm) hypothetical protein 0.0609 0.5098 1
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0045 0.0214 0.0361
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.004 0.0174 0.0323
Loa Loa (eye worm) hypothetical protein 0.0021 0.0009 0.0018
Trypanosoma brucei PAB1-binding protein , putative 0.0026 0.0053 0.2246
Schistosoma mansoni aldehyde dehydrogenase 0.0123 0.0888 0.1564
Toxoplasma gondii HEAT repeat-containing protein 0.0031 0.0093 0.0818
Loa Loa (eye worm) RNA binding protein 0.0124 0.09 0.1766
Loa Loa (eye worm) transcription factor SMAD2 0.0118 0.0851 0.167
Loa Loa (eye worm) intermediate filament tail domain-containing protein 0.0081 0.0526 0.1032
Brugia malayi Nuclear hormone receptor-like 1 0.004 0.0174 0.0323
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.004 0.0174 0.0323
Onchocerca volvulus 0.0096 0.0659 0.3309
Onchocerca volvulus Protein ultraspiracle homolog 0.004 0.0174 0.0544
Onchocerca volvulus 0.0092 0.0624 0.311
Loa Loa (eye worm) hypothetical protein 0.0035 0.0131 0.0256
Schistosoma mansoni importin beta-1 0.0031 0.0093 0.0164
Schistosoma mansoni nuclear hormone receptor 0.004 0.0174 0.0306
Schistosoma mansoni microtubule-associated protein tau 0.0675 0.5675 1
Echinococcus granulosus fetal alzheimer antigen falz 0.0022 0.0016 0.0012
Loa Loa (eye worm) hypothetical protein 0.0021 0.0009 0.0018
Schistosoma mansoni tar DNA-binding protein 0.0124 0.09 0.1586
Trypanosoma cruzi hypothetical protein, conserved 0.0035 0.0132 0.8141
Brugia malayi PHD-finger family protein 0.0024 0.0036 0.0053
Echinococcus granulosus DNA apurinic or apyrimidinic site lyase 0.0038 0.0156 0.026
Brugia malayi LBP / BPI / CETP family, C-terminal domain containing protein 0.0055 0.0303 0.0578
Trypanosoma cruzi PAB1-binding protein , putative 0.0026 0.0053 0.2246
Echinococcus granulosus lysosomal alpha glucosidase 0.0159 0.1206 0.2113
Onchocerca volvulus 0.0035 0.013 0.0297
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0035 0.013 0.023
Loa Loa (eye worm) hypothetical protein 0.004 0.017 0.0334
Onchocerca volvulus 0.0096 0.0659 0.3309
Mycobacterium ulcerans secreted antigen 85-A FbpA 0.005 0.0257 0.0129
Trypanosoma brucei importin beta-1 subunit, putative 0.0031 0.0093 0.5285
Loa Loa (eye worm) hypothetical protein 0.0046 0.0223 0.0437
Schistosoma mansoni survival motor neuron protein 0.0047 0.0235 0.0414
Trypanosoma cruzi hypothetical protein, conserved 0.0035 0.0132 0.8141
Loa Loa (eye worm) MH2 domain-containing protein 0.0118 0.0851 0.167
Onchocerca volvulus Steroid hormone receptor family member cnr14 homolog 0.004 0.0174 0.0544
Plasmodium vivax AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.0038 0.0156 1
Loa Loa (eye worm) latrophilin receptor protein 2 0.0049 0.0248 0.0486
Plasmodium vivax SET domain protein, putative 0.0029 0.0078 0.4154
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0154 0.1161 0.2278
Loa Loa (eye worm) hypothetical protein 0.004 0.0174 0.0341
Schistosoma mansoni ran 0.0023 0.0022 0.004
Schistosoma mansoni lamin 0.0081 0.0526 0.0927
Loa Loa (eye worm) hypothetical protein 0.0038 0.015 0.0295
Loa Loa (eye worm) hypothetical protein 0.0035 0.013 0.0256
Brugia malayi Esterase D 0.005 0.0257 0.0488
Schistosoma mansoni tar DNA-binding protein 0.0124 0.09 0.1586
Brugia malayi Nuclear hormone receptor family member nhr-40 0.004 0.0174 0.0323
Loa Loa (eye worm) hypothetical protein 0.0041 0.0181 0.0355
Echinococcus granulosus FTZ F1 nuclear receptor protein 0.004 0.0174 0.029
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0035 0.013 0.023
Onchocerca volvulus 0.0096 0.0659 0.3309
Schistosoma mansoni lamin 0.0081 0.0526 0.0927
Schistosoma mansoni ecdysone-induced protein 78c (dr-78) 0.0021 0.0009 0.0016
Echinococcus multilocularis S formylglutathione hydrolase 0.005 0.0257 0.0438
Loa Loa (eye worm) glycosyl hydrolase family 31 protein 0.0035 0.0132 0.0258
Echinococcus granulosus ecdysone induced protein 78C 0.004 0.0174 0.029
Loa Loa (eye worm) hypothetical protein 0.0081 0.0526 0.1032
Brugia malayi Glycosyl hydrolases family 31 protein 0.0035 0.0132 0.024
Trichomonas vaginalis conserved hypothetical protein 0.0041 0.0181 0.0875
Schistosoma mansoni hypothetical protein 0.0182 0.1401 0.2469
Echinococcus multilocularis hepatocyte nuclear factor 4 alpha 0.004 0.0174 0.029
Toxoplasma gondii aldehyde dehydrogenase 0.0123 0.0888 1
Toxoplasma gondii ABC1 family protein 0.0035 0.013 0.1246
Brugia malayi LBP / BPI / CETP family, N-terminal domain containing protein 0.0096 0.0659 0.1277
Echinococcus granulosus FTZ F1 alpha 0.004 0.0174 0.029
Trichomonas vaginalis Importin beta-1 subunit, putative 0.0025 0.0043 0.0111
Brugia malayi Bromodomain containing protein 0.0037 0.015 0.0276
Trichomonas vaginalis neutral alpha-glucosidase ab precursor, putative 0.0035 0.0132 0.0602
Loa Loa (eye worm) esterase D 0.005 0.0257 0.0505
Brugia malayi steroid hormone receptor 0.004 0.0174 0.0323
Loa Loa (eye worm) hypothetical protein 0.004 0.0174 0.0341
Echinococcus granulosus GPCR family 2 0.0049 0.0248 0.0421
Trichomonas vaginalis D-aminoacylase, putative 0.0035 0.013 0.0596
Brugia malayi Steroid receptor seven-up type 2 0.004 0.0174 0.0323
Echinococcus multilocularis lysosomal alpha glucosidase 0.0159 0.1206 0.2113
Brugia malayi cytoplasmic intermediate filament protein 0.0043 0.0201 0.0376
Loa Loa (eye worm) hypothetical protein 0.0042 0.0187 0.0366
Loa Loa (eye worm) hypothetical protein 0.0035 0.013 0.0256
Brugia malayi Pre-SET motif family protein 0.0029 0.0078 0.0135
Loa Loa (eye worm) nuclear hormone receptor family member nhr-14 0.004 0.0174 0.0341
Trypanosoma cruzi apurinic/apyrimidinic endonuclease, putative 0.0038 0.0156 1
Trichomonas vaginalis sucrase-isomaltase, putative 0.0035 0.0132 0.0602
Brugia malayi nuclear receptor NHR-88 0.004 0.0174 0.0323
Echinococcus multilocularis microtubule associated protein 2 0.0675 0.5675 1
Echinococcus multilocularis survival motor neuron protein 1 0.0232 0.1834 0.322
Brugia malayi RNA binding protein 0.0124 0.09 0.1751
Loa Loa (eye worm) hypothetical protein 0.0041 0.0181 0.0355
Echinococcus granulosus cadherin EGF LAG seven pass G type receptor 0.0049 0.0248 0.0421
Schistosoma mansoni hypothetical protein 0.033 0.2688 0.4737
Loa Loa (eye worm) hypothetical protein 0.0055 0.0303 0.0595
Mycobacterium ulcerans hypothetical protein 0.005 0.0257 0.0129
Echinococcus multilocularis FTZ F1 alpha 0.004 0.0174 0.029
Mycobacterium ulcerans aldehyde dehydrogenase 0.0123 0.0888 0.0767
Brugia malayi hypothetical protein 0.0232 0.1834 0.3585
Echinococcus granulosus TRP transient receptor potential channel 0.0039 0.0161 0.0268
Echinococcus multilocularis cadherin EGF LAG seven pass G type receptor 0.0049 0.0248 0.0421
Echinococcus multilocularis cytoplasmic intermediate filament protein 0.0039 0.0163 0.0272
Brugia malayi TAR-binding protein 0.0124 0.09 0.1751
Trichomonas vaginalis importin beta-1, putative 0.0025 0.0043 0.0111
Schistosoma mansoni transient receptor potential channel 4 0.0104 0.0728 0.1283
Mycobacterium tuberculosis Possible conserved membrane protein 0.005 0.0257 0.0129
Giardia lamblia Endonuclease/Exonuclease/phosphatase 0.0038 0.0156 1
Schistosoma mansoni coup transcription factor 0.004 0.0174 0.0306
Echinococcus multilocularis lamin dm0 0.0081 0.0526 0.0912
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0035 0.0131 0.0214
Mycobacterium ulcerans aldehyde dehydrogenase 0.0123 0.0888 0.0767
Loa Loa (eye worm) hypothetical protein 0.0021 0.0009 0.0018
Plasmodium falciparum AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.0038 0.0156 1
Brugia malayi intermediate filament protein 0.0081 0.0526 0.1016
Brugia malayi photoreceptor-specific nuclear receptor 0.004 0.0174 0.0323
Brugia malayi hypothetical protein 0.0035 0.0131 0.0239
Echinococcus multilocularis transient receptor potential gamma protein 0.0104 0.0728 0.1268
Onchocerca volvulus 0.0096 0.0659 0.3309
Entamoeba histolytica glycosyl hydrolase, family 31 protein 0.0035 0.0132 0.4644
Schistosoma mansoni alpha glucosidase 0.0035 0.0132 0.0232
Schistosoma mansoni hypothetical protein 0.0035 0.0131 0.023
Trypanosoma cruzi apurinic/apyrimidinic endonuclease 0.0038 0.0156 1
Schistosoma mansoni transient receptor potential channel 0.0069 0.0422 0.0744
Mycobacterium ulcerans hypothetical protein 0.005 0.0257 0.0129
Loa Loa (eye worm) hypothetical protein 0.0041 0.0181 0.0355
Echinococcus granulosus bromodomain adjacent to zinc finger domain 0.0035 0.013 0.0213
Echinococcus granulosus importin subunit beta 1 0.0031 0.0093 0.0148
Echinococcus multilocularis COUP TF:Svp nuclear hormone receptor 0.004 0.0174 0.029
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0035 0.0131 0.0214
Echinococcus multilocularis aldehyde dehydrogenase, mitochondrial 0.0123 0.0888 0.1551
Brugia malayi Nuclear hormone receptor family member nhr-25 0.004 0.0174 0.0323
Mycobacterium ulcerans secreted antigen 85-B FbpB 0.005 0.0257 0.0129
Schistosoma mansoni retinoic acid receptor RXR 0.004 0.0174 0.0306
Loa Loa (eye worm) LBP/BPI/CETP family domain-containing protein 0.0055 0.0303 0.0595
Plasmodium falciparum importin beta, putative 0.0031 0.0093 0.5285
Loa Loa (eye worm) hypothetical protein 0.0049 0.0248 0.0486
Schistosoma mansoni alpha-glucosidase 0.0137 0.1014 0.1787
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0045 0.0214 0.0419
Loa Loa (eye worm) steroid hormone receptor 0.004 0.0174 0.0341
Trypanosoma cruzi hypothetical protein, conserved 0.0035 0.013 0.8047
Trypanosoma brucei hypothetical protein, conserved 0.0035 0.013 0.8047
Onchocerca volvulus 0.004 0.0174 0.0544
Echinococcus granulosus short transient receptor potential channel 6 0.0069 0.0422 0.0729
Echinococcus multilocularis histone lysine N methyltransferase SETMAR 0.0029 0.0078 0.0122
Loa Loa (eye worm) hypothetical protein 0.0035 0.013 0.0256
Schistosoma mansoni acetyl-CoA C-acetyltransferase 0.0022 0.0016 0.0029
Echinococcus granulosus bromodomain adjacent to zinc finger domain 0.0058 0.0331 0.0568
Echinococcus multilocularis tar DNA binding protein 0.0124 0.09 0.1572
Loa Loa (eye worm) hypothetical protein 0.004 0.0174 0.0341
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0154 0.1161 0.2264
Loa Loa (eye worm) nuclear hormone receptor family member nhr-41 0.004 0.0174 0.0341
Trichomonas vaginalis maltase-glucoamylase, putative 0.0035 0.0132 0.0602
Brugia malayi beta-lactamase family protein 0.0035 0.013 0.0238
Trypanosoma brucei glucosidase, putative 0.0035 0.0132 0.8141
Loa Loa (eye worm) hypothetical protein 0.0055 0.0303 0.0595
Toxoplasma gondii LsmAD domain-containing protein 0.0026 0.0053 0.0348
Plasmodium vivax hypothetical protein, conserved 0.0035 0.013 0.8047
Entamoeba histolytica hypothetical protein 0.0035 0.0131 0.4607
Brugia malayi RNA, U transporter 1 0.0088 0.0588 0.1137
Echinococcus multilocularis thyroid hormone receptor alpha 0.004 0.0174 0.029
Mycobacterium tuberculosis Probable aldehyde dehydrogenase 0.0123 0.0888 0.0767
Mycobacterium ulcerans secreted antigen 85-C FbpC 0.1174 1 1
Loa Loa (eye worm) hypothetical protein 0.004 0.0174 0.0341
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0045 0.0214 0.0361
Mycobacterium ulcerans hypothetical protein 0.005 0.0257 0.0129
Brugia malayi Nuclear hormone receptor family member nhr-31 0.004 0.0174 0.0323
Brugia malayi GTP-binding nuclear protein RAN/TC4 0.0023 0.0022 0.0026
Schistosoma mansoni tar DNA-binding protein 0.0124 0.09 0.1586
Schistosoma mansoni hypothetical protein 0.0105 0.0738 0.1301
Trypanosoma brucei importin beta-1 subunit, putative 0.0031 0.0093 0.5285
Trichomonas vaginalis neutral alpha-glucosidase ab precursor, putative 0.0035 0.0132 0.0602
Loa Loa (eye worm) LBP/BPI/CETP family domain-containing protein 0.0096 0.0659 0.1293
Trichomonas vaginalis ap endonuclease, putative 0.0038 0.0156 0.074
Loa Loa (eye worm) hypothetical protein 0.0232 0.1834 0.3597
Entamoeba histolytica hypothetical protein 0.0035 0.0131 0.4607
Schistosoma mansoni photoreceptor-specific nuclear receptor related 0.004 0.0174 0.0306
Loa Loa (eye worm) pre-SET domain-containing protein family protein 0.0204 0.1589 0.3118
Brugia malayi hypothetical protein 0.0026 0.0053 0.0085
Trichomonas vaginalis alpha-glucosidase, putative 0.0035 0.0132 0.0602
Brugia malayi Nuclear hormone receptor family member nhr-41 0.004 0.0174 0.0323
Entamoeba histolytica hypothetical protein 0.0035 0.0131 0.4607
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0029 0.0078 0.0138
Brugia malayi beta-lactamase family protein 0.0035 0.013 0.0238
Brugia malayi nuclear hormone receptor 0.004 0.0174 0.0323
Trypanosoma cruzi importin beta-1 subunit, putative 0.0025 0.0043 0.1499
Loa Loa (eye worm) hypothetical protein 0.004 0.0174 0.0341
Loa Loa (eye worm) GTP-binding nuclear protein RAN/TC4 0.0023 0.0022 0.0044
Entamoeba histolytica endo-1,4-beta-xylanase, putative 0.005 0.0257 1
Brugia malayi Nuclear hormone receptor family member nhr-14 0.004 0.0174 0.0323
Schistosoma mansoni retinoid-x-receptor (RXR) 0.004 0.0174 0.0306
Loa Loa (eye worm) beta-lactamase 0.0035 0.013 0.0256
Loa Loa (eye worm) hypothetical protein 0.0041 0.0181 0.0355
Echinococcus multilocularis snurportin 1 0.033 0.2688 0.4728
Schistosoma mansoni cathepsin D (A01 family) 0.0053 0.0281 0.0495
Loa Loa (eye worm) hypothetical protein 0.0021 0.0009 0.0018
Echinococcus granulosus lamin 0.0081 0.0526 0.0912
Mycobacterium tuberculosis Possible penicillin-binding protein 0.0225 0.1775 0.1666
Mycobacterium tuberculosis Probable exodeoxyribonuclease III protein XthA (exonuclease III) (EXO III) (AP endonuclease VI) 0.0038 0.0156 0.0027
Onchocerca volvulus 0.0055 0.0303 0.1282
Loa Loa (eye worm) exodeoxyribonuclease III family protein 0.0038 0.0156 0.0307
Schistosoma mansoni ap endonuclease 0.0038 0.0156 0.0276
Echinococcus multilocularis fetal alzheimer antigen, falz 0.0022 0.0016 0.0012
Echinococcus granulosus transient receptor potential gamma protein 0.0104 0.0728 0.1268
Brugia malayi beta-lactamase 0.0035 0.013 0.0238
Schistosoma mansoni alpha-glucosidase 0.0137 0.1014 0.1787
Loa Loa (eye worm) nuclear Hormone Receptor family member 0.004 0.0174 0.0341
Toxoplasma gondii histone lysine methyltransferase SET/SUV39 0.0029 0.0078 0.0643
Echinococcus granulosus COUP TF:Svp nuclear hormone receptor 0.004 0.0174 0.029
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.004 0.0174 0.029
Brugia malayi latrophilin 2 splice variant baaae 0.0105 0.0738 0.1433
Brugia malayi RNA recognition motif domain containing protein 0.0124 0.09 0.1751
Loa Loa (eye worm) hypothetical protein 0.0035 0.013 0.0256
Brugia malayi Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative 0.0035 0.013 0.0238
Brugia malayi Intermediate filament tail domain containing protein 0.0081 0.0526 0.1016
Loa Loa (eye worm) hypothetical protein 0.0096 0.0659 0.1293
Echinococcus granulosus muscleblind protein 0.0609 0.5098 0.8981
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.0124 0.09 0.1766
Loa Loa (eye worm) hypothetical protein 0.0039 0.0161 0.0316
Echinococcus granulosus GTP binding nuclear protein Ran 0.0023 0.0022 0.0023
Brugia malayi Nuclear hormone receptor family member nhr-19 0.004 0.0174 0.0323
Echinococcus multilocularis bromodomain adjacent to zinc finger domain 0.0035 0.013 0.0213
Brugia malayi Nuclear hormone receptor family member nhr-19 0.004 0.0174 0.0323
Mycobacterium tuberculosis Secreted MPT51/MPB51 antigen protein FbpD (MPT51/MPB51 antigen 85 complex C) (AG58C) (mycolyl transferase 85C) (fibronectin-bind 0.005 0.0257 0.0129
Mycobacterium ulcerans hypothetical protein 0.005 0.0257 0.0129
Trichomonas vaginalis alpha-glucosidase, putative 0.0035 0.0132 0.0602
Echinococcus multilocularis musashi 0.0081 0.0526 0.0912
Loa Loa (eye worm) hypothetical protein 0.0609 0.5098 1
Trichomonas vaginalis D-aminoacylase, putative 0.0035 0.013 0.0596
Mycobacterium leprae Secreted antigen 85A FbpA (mycolyl transferase 85A) (fibronectin-binding protein A) (antigen 85 complex A) 0.005 0.0257 0.0129
Toxoplasma gondii exonuclease III APE 0.0038 0.0156 0.1548
Loa Loa (eye worm) cytoplasmic intermediate filament protein 0.0043 0.0201 0.0394
Schistosoma mansoni ap endonuclease 0.0038 0.0156 0.0276
Loa Loa (eye worm) beta-LACTamase domain containing family member 0.0035 0.013 0.0256
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0045 0.0214 0.0361
Loa Loa (eye worm) nuclear hormone receptor-like 1 0.0021 0.0009 0.0018
Leishmania major hypothetical protein, conserved 0.0035 0.013 0.1246
Schistosoma mansoni steroid hormone receptor ad4bp 0.004 0.0174 0.0306
Echinococcus granulosus lamin dm0 0.0081 0.0526 0.0912
Mycobacterium tuberculosis Conserved protein 0.005 0.0257 0.0129
Brugia malayi Nuclear hormone receptor family member nhr-25 0.004 0.0174 0.0323
Loa Loa (eye worm) hypothetical protein 0.0031 0.0093 0.0183
Onchocerca volvulus 0.0081 0.0526 0.2553
Onchocerca volvulus 0.0055 0.0303 0.1282
Onchocerca volvulus 0.0096 0.0659 0.3309
Echinococcus granulosus beta LACTamase domain containing family member 0.0035 0.013 0.0214
Echinococcus granulosus cytoplasmic intermediate filament protein 0.0039 0.0163 0.0272
Onchocerca volvulus Bile acid receptor homolog 0.004 0.0174 0.0544
Echinococcus granulosus short transient receptor potential channel 6 0.0069 0.0422 0.0729
Onchocerca volvulus 0.0096 0.0659 0.3309
Echinococcus multilocularis DNA (apurinic or apyrimidinic site) lyase 0.0038 0.0156 0.026
Brugia malayi LBP / BPI / CETP family, C-terminal domain containing protein 0.0055 0.0303 0.0578
Echinococcus granulosus aldehyde dehydrogenase mitochondrial 0.0123 0.0888 0.1551
Brugia malayi Iron-sulfur cluster assembly accessory protein 0.0047 0.0235 0.0443
Leishmania major aldehyde dehydrogenase, mitochondrial precursor 0.0123 0.0888 1

Activities

Activity type Activity value Assay description Source Reference
EC50 (functional) = 140 nM Stimulation of IP3-coupled mobilization of calcium in HEK293 cells expressing MCH-R1 ChEMBL. 16919453
EC50 (functional) = 140 nM Stimulation of IP3-coupled mobilization of calcium in HEK293 cells expressing MCH-R1 ChEMBL. 16919453
IC50 (binding) = 8 nM Displacement of 125I-[Phe13,Tyr19]-MCH from human MCH-R1 ChEMBL. 16919453
IC50 (binding) = 8 nM Displacement of 125I-[Phe13,Tyr19]-MCH from human MCH-R1 ChEMBL. 16919453
IC50 (binding) = 7 ug ml-1 Ability to inhibit binding of radiolabeled C5a anaphylatoxin to intact membrane bound receptor from human neutrophils. ChEMBL. 1310118
IC50 (binding) = 7 ug ml-1 Ability to inhibit binding of radiolabeled C5a anaphylatoxin to intact membrane bound receptor from human neutrophils. ChEMBL. 1310118
Inhibition (binding) < 50 % Inhibition of 125I-[Phe13,Tyr19]-MCH binding to human MCH-R2 at 2uM ChEMBL. 16919453
Inhibition (binding) < 50 % Inhibition of 125I-[Phe13,Tyr19]-MCH binding to human MCH-R2 at 2uM ChEMBL. 16919453

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

2 literature references were collected for this gene.

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