Detailed information for compound 1059222

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 442.307 | Formula: C24H16BrN3O
  • H donors: 0 H acceptors: 2 LogP: 6.02 Rotable bonds: 4
    Rule of 5 violations (Lipinski): 1
  • SMILES: Brc1ccc(cc1)c1nn(cc1c1noc(c1)c1ccccc1)c1ccccc1
  • InChi: 1S/C24H16BrN3O/c25-19-13-11-18(12-14-19)24-21(16-28(26-24)20-9-5-2-6-10-20)22-15-23(29-27-22)17-7-3-1-4-8-17/h1-16H
  • InChiKey: HVQJMHDCGYNNIU-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

No synonyms found for this compound

Targets

Known targets for this compound

No curated genes were found associated with this compound

Predicted pathogen targets for this compound

By orthology
No druggable targets predicted by orthology data
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
Mycobacterium ulcerans fatty-acid-CoA ligase 0.0025 0.0152 0.079
Loa Loa (eye worm) hypothetical protein 0.0121 0.1297 0.1756
Brugia malayi Nuclear hormone receptor E75 0.0014 0.0027 0.0049
Brugia malayi hypothetical protein 0.0014 0.0027 0.0049
Echinococcus granulosus lysine specific demethylase 5A 0.0041 0.0344 0.0467
Echinococcus multilocularis nuclear receptor subfamily 1 group D 0.0016 0.0047 0.0047
Plasmodium falciparum GTP-binding nuclear protein RAN/TC4 0.0043 0.0374 0.667
Schistosoma mansoni RAR-like nuclear receptor 0.003 0.0219 0.0295
Brugia malayi PHD-finger family protein 0.0012 0.0002 0.0001
Loa Loa (eye worm) hypothetical protein 0.003 0.0219 0.0295
Trichomonas vaginalis conserved hypothetical protein 0.0044 0.0384 0.1705
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD35 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0018 0.0065 0.0137
Brugia malayi jmjC domain containing protein 0.0106 0.1126 0.2133
Echinococcus granulosus dna polymerase eta 0.0039 0.0325 0.0441
Loa Loa (eye worm) hypothetical protein 0.0039 0.0325 0.044
Echinococcus multilocularis retinoic acid receptor rxr beta a retinoic acid receptor rxr alpha a retinoic acid receptor rxr alpha 0.0014 0.0027 0.0027
Brugia malayi steroid hormone receptor 0.003 0.0219 0.0413
Echinococcus multilocularis NADP dependent isocitrate dehydrogenase 0.0015 0.0039 0.0039
Loa Loa (eye worm) GTP-binding nuclear protein RAN/TC4 0.0043 0.0374 0.0505
Mycobacterium ulcerans acyl-CoA synthetase 0.0025 0.0152 0.079
Echinococcus multilocularis Niemann Pick C1 protein 0.0103 0.1087 0.1087
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0092 0.0952 0.1289
Schistosoma mansoni cpg binding protein 0.003 0.0219 0.0296
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0092 0.0952 0.1291
Echinococcus granulosus geminin 0.0175 0.1952 0.2645
Echinococcus multilocularis peregrin 0.0032 0.0243 0.0243
Toxoplasma gondii isocitrate dehydrogenase 0.0015 0.0039 0.035
Brugia malayi RNA, U transporter 1 0.0168 0.1859 0.3524
Echinococcus multilocularis COUP TF:Svp nuclear hormone receptor 0.003 0.0219 0.0219
Echinococcus multilocularis protein patched 0.0044 0.0384 0.0384
Trypanosoma cruzi apurinic/apyrimidinic endonuclease 0.0019 0.008 0.0209
Brugia malayi ImpB/MucB/SamB family protein 0.0039 0.0325 0.0615
Schistosoma mansoni hypothetical protein 0.0629 0.7379 1
Brugia malayi Nuclear hormone receptor family member nhr-19 0.003 0.0219 0.0413
Schistosoma mansoni alpha-galactosidase/alpha-n-acetylgalactosaminidase 0.0103 0.1084 0.1468
Trypanosoma cruzi apurinic/apyrimidinic endonuclease, putative 0.0019 0.008 0.0209
Schistosoma mansoni coup transcription factor 0.003 0.0219 0.0295
Loa Loa (eye worm) hypothetical protein 0.0014 0.0027 0.0035
Schistosoma mansoni NADP-specific isocitrate dehydrogenase 0.0015 0.0039 0.0051
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0092 0.0952 0.1289
Echinococcus multilocularis hepatocyte nuclear factor 4 alpha 0.003 0.0219 0.0219
Trypanosoma cruzi mitochondrial DNA polymerase beta-PAK, putative 0.0154 0.1698 0.4528
Giardia lamblia Endonuclease/Exonuclease/phosphatase 0.0019 0.008 0.2104
Onchocerca volvulus Huntingtin homolog 0.0121 0.1297 1
Loa Loa (eye worm) hypothetical protein 0.003 0.0219 0.0295
Loa Loa (eye worm) hypothetical protein 0.0103 0.1087 0.1471
Echinococcus granulosus Nuclear hormone receptor HR96 0.0014 0.0027 0.0036
Brugia malayi Nuclear hormone receptor family member nhr-25 0.003 0.0219 0.0413
Plasmodium falciparum isocitrate dehydrogenase [NADP], mitochondrial 0.0015 0.0039 0.0679
Onchocerca volvulus 0.003 0.0219 0.1514
Brugia malayi nuclear receptor RXR 0.0014 0.0027 0.0049
Brugia malayi Latrophilin receptor protein 2 0.0143 0.157 0.2975
Loa Loa (eye worm) cytochrome P450 family protein 0.0026 0.0169 0.0228
Brugia malayi F/Y-rich N-terminus family protein 0.0019 0.0087 0.0163
Mycobacterium ulcerans acyl-CoA synthetase 0.0025 0.0152 0.079
Loa Loa (eye worm) hypothetical protein 0.0054 0.0503 0.068
Loa Loa (eye worm) hypothetical protein 0.0016 0.0047 0.0063
Brugia malayi RNA binding protein 0.025 0.2844 0.539
Entamoeba histolytica acyl-coA synthetase, putative 0.0025 0.0152 0.0672
Brugia malayi ecdysteroid receptor 0.003 0.0219 0.0413
Plasmodium falciparum importin beta, putative 0.0059 0.056 1
Echinococcus granulosus Niemann Pick C1 protein 0.0147 0.1615 0.2189
Trypanosoma brucei DNA polymerase kappa, putative 0.0039 0.0325 0.0865
Echinococcus multilocularis nuclear receptor nhr 48 0.0014 0.0027 0.0027
Trypanosoma cruzi DNA polymerase kappa, putative 0.0039 0.0325 0.0865
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.0143 0.157 0.157
Mycobacterium ulcerans exodeoxyribonuclease III protein XthA 0.0019 0.008 0.0412
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.025 0.2844 0.3853
Echinococcus multilocularis Nuclear hormone receptor family member nhr 41 0.003 0.0219 0.0219
Plasmodium vivax acyl-CoA synthetase, putative 0.0019 0.0077 0.1353
Leishmania major 4-coumarate:coa ligase-like protein 0.0025 0.0152 0.0402
Echinococcus multilocularis GTP binding nuclear protein Ran 0.0043 0.0374 0.0374
Trypanosoma brucei DNA polymerase kappa, putative 0.0039 0.0325 0.0865
Entamoeba histolytica hypothetical protein 0.0109 0.1153 1
Schistosoma mansoni hypothetical protein 0.0411 0.4764 0.6455
Echinococcus granulosus cadherin EGF LAG seven pass G type receptor 0.0143 0.157 0.2128
Brugia malayi Nuclear hormone receptor-like 1 0.0016 0.0047 0.0088
Loa Loa (eye worm) isocitrate dehydrogenase 0.0015 0.0039 0.0051
Leishmania major DNA polymerase kappa, putative,DNA polymerase IV, putative 0.0039 0.0325 0.0865
Leishmania major isocitrate dehydrogenase [NADP], mitochondrial precursor, putative 0.0015 0.0039 0.0101
Schistosoma mansoni ran 0.0043 0.0374 0.0505
Schistosoma mansoni alpha-galactosidase/alpha-n-acetylgalactosaminidase 0.0103 0.1084 0.1468
Brugia malayi AMP-binding enzyme family protein 0.0025 0.0152 0.0286
Echinococcus granulosus nuclear receptor 2DBD gamma 0.003 0.0219 0.0297
Loa Loa (eye worm) latrophilin receptor protein 2 0.0143 0.157 0.2126
Schistosoma mansoni ran 0.0043 0.0374 0.0505
Toxoplasma gondii GTP-binding nuclear protein ran/tc4 0.0043 0.0374 0.3441
Echinococcus granulosus FTZ F1 nuclear receptor protein 0.003 0.0219 0.0297
Loa Loa (eye worm) hypothetical protein 0.0025 0.0152 0.0204
Trypanosoma cruzi DNA polymerase kappa, putative 0.0039 0.0325 0.0865
Echinococcus multilocularis tar DNA binding protein 0.025 0.2844 0.2844
Schistosoma mansoni nuclear hormone receptor 0.0014 0.0027 0.0035
Brugia malayi Calcitonin receptor-like protein seb-1 0.0453 0.5275 1
Brugia malayi nuclear receptor RXR 0.0016 0.0047 0.0088
Loa Loa (eye worm) nuclear Hormone Receptor family member 0.003 0.0219 0.0295
Echinococcus multilocularis GPCR, family 2 0.0143 0.157 0.157
Plasmodium falciparum conserved Plasmodium membrane protein, unknown function 0.0012 0.0003 0.0033
Toxoplasma gondii melibiase subfamily protein 0.0103 0.1084 1
Echinococcus multilocularis NADP dependent isocitrate dehydrogenase 0.0015 0.0039 0.0039
Schistosoma mansoni cpg binding protein 0.003 0.0219 0.0296
Loa Loa (eye worm) hypothetical protein 0.0014 0.0027 0.0035
Brugia malayi hypothetical protein 0.0016 0.0047 0.0088
Plasmodium vivax GTP-binding nuclear protein RAN/TC4, putative 0.0043 0.0374 0.667
Echinococcus multilocularis lysine specific demethylase 5A 0.0039 0.0325 0.0325
Trypanosoma brucei DNA polymerase kappa, putative 0.0039 0.0325 0.0865
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0092 0.0952 0.1289
Trypanosoma brucei mitochondrial DNA polymerase beta 0.0326 0.375 1
Brugia malayi orphan nuclear receptor NR2E1 0.0014 0.0027 0.0049
Echinococcus granulosus jumonji domain containing protein 0.0045 0.0395 0.0535
Loa Loa (eye worm) hypothetical protein 0.0044 0.0384 0.0519
Brugia malayi exodeoxyribonuclease III family protein 0.0019 0.008 0.0149
Wolbachia endosymbiont of Brugia malayi exonuclease III 0.0019 0.008 0.5
Loa Loa (eye worm) hypothetical protein 0.003 0.0219 0.0295
Echinococcus granulosus ecdysone induced protein 78C 0.003 0.0219 0.0297
Mycobacterium tuberculosis Probable chain -fatty-acid-CoA ligase FadD13 (fatty-acyl-CoA synthetase) 0.0025 0.0152 0.0603
Brugia malayi photoreceptor-specific nuclear receptor 0.003 0.0219 0.0413
Giardia lamblia DINP protein human, muc B family 0.0039 0.0325 0.8703
Plasmodium vivax isocitrate dehydrogenase [NADP], mitochondrial, putative 0.0015 0.0039 0.0679
Loa Loa (eye worm) nuclear hormone receptor 0.0014 0.0027 0.0035
Loa Loa (eye worm) hypothetical protein 0.0014 0.0027 0.0035
Schistosoma mansoni ecdysone-induced protein 78c (dr-78) 0.0016 0.0047 0.0063
Loa Loa (eye worm) hypothetical protein 0.003 0.0219 0.0295
Schistosoma mansoni tar DNA-binding protein 0.025 0.2844 0.3853
Trichomonas vaginalis DNA polymerase IV / kappa, putative 0.0039 0.0325 0.1379
Trypanosoma brucei importin beta-1 subunit, putative 0.0059 0.056 0.1491
Trichomonas vaginalis alpha-galactosidase/alpha-N-acetylgalactosaminidase, putative 0.0069 0.0675 0.3337
Trichomonas vaginalis Importin beta-1 subunit, putative 0.0048 0.0427 0.1946
Loa Loa (eye worm) TAR-binding protein 0.025 0.2844 0.3853
Brugia malayi hypothetical protein 0.0014 0.0027 0.0049
Brugia malayi nuclear receptor NHR-67 0.0014 0.0027 0.0049
Schistosoma mansoni tar DNA-binding protein 0.025 0.2844 0.3853
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.003 0.0219 0.0413
Trypanosoma brucei unspecified product 0.0027 0.0179 0.0476
Brugia malayi nuclear hormone receptor 0.003 0.0219 0.0413
Loa Loa (eye worm) hypothetical protein 0.0025 0.0152 0.0204
Loa Loa (eye worm) nucleolar RNA-associated protein alpha 0.0629 0.7379 1
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.003 0.0219 0.0219
Brugia malayi ImpB/MucB/SamB family protein 0.0039 0.0325 0.0615
Brugia malayi Importin beta-1 subunit 0.0059 0.056 0.106
Loa Loa (eye worm) hypothetical protein 0.0019 0.0077 0.0103
Toxoplasma gondii isocitrate dehydrogenase 0.0015 0.0039 0.035
Schistosoma mansoni patched 1 0.0044 0.0384 0.0519
Schistosoma mansoni FTZ-F1 nuclear receptor-like protein 0.003 0.0219 0.0295
Onchocerca volvulus Protein ultraspiracle homolog 0.003 0.0219 0.1514
Loa Loa (eye worm) hypothetical protein 0.0014 0.0027 0.0035
Schistosoma mansoni alpha-galactosidase/alpha-n-acetylgalactosaminidase 0.0069 0.0675 0.0913
Brugia malayi CXXC zinc finger family protein 0.0029 0.02 0.0377
Leishmania major DNA polymerase eta, putative 0.0039 0.0325 0.0865
Echinococcus multilocularis FTZ F1 nuclear receptor protein 0.003 0.0219 0.0219
Entamoeba histolytica hypothetical protein 0.0048 0.0427 0.3232
Loa Loa (eye worm) hypothetical protein 0.0014 0.0027 0.0035
Brugia malayi tailless protein 0.0014 0.0027 0.0049
Schistosoma mansoni hypothetical protein 0.0175 0.1952 0.2644
Trypanosoma brucei unspecified product 0.0039 0.0325 0.0865
Trypanosoma brucei importin beta-1 subunit, putative 0.0059 0.056 0.1491
Brugia malayi Nuclear hormone receptor E75 0.0014 0.0027 0.0049
Schistosoma mansoni rab geranylgeranyl transferase alpha subunit 0.0039 0.0325 0.044
Loa Loa (eye worm) hypothetical protein 0.0016 0.0047 0.0063
Brugia malayi Nuclear hormone receptor family member nhr-1 0.003 0.0219 0.0413
Brugia malayi RNA recognition motif domain containing protein 0.025 0.2844 0.539
Trypanosoma brucei DNA polymerase IV, putative 0.0039 0.0325 0.0865
Brugia malayi nuclear receptor NHR-88 0.003 0.0219 0.0413
Loa Loa (eye worm) PHD-finger family protein 0.0032 0.0243 0.0328
Brugia malayi Nuclear hormone receptor family member nhr-49 0.003 0.0219 0.0413
Schistosoma mansoni Tr4/Tr2 (homologue) 0.003 0.0219 0.0295
Loa Loa (eye worm) exodeoxyribonuclease III family protein 0.0019 0.008 0.0106
Loa Loa (eye worm) hypothetical protein 0.0121 0.1297 0.1756
Brugia malayi hypothetical protein 0.0016 0.0047 0.0088
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0109 0.1153 0.1153
Trypanosoma cruzi DNA polymerase beta thumb, putative 0.0046 0.0403 0.1071
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0014 0.0027 0.0027
Echinococcus granulosus nuclear receptor nhr 48 0.0014 0.0027 0.0036
Loa Loa (eye worm) jmjC domain-containing protein 0.0041 0.0344 0.0465
Schistosoma mansoni nuclear receptor 2DBD-gamma 0.003 0.0219 0.0295
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0061 0.0586 0.0793
Echinococcus multilocularis Nuclear hormone receptor HR96 0.0014 0.0027 0.0027
Echinococcus multilocularis ecdysone induced protein 78C 0.003 0.0219 0.0219
Mycobacterium leprae PROBABLE FATTY-ACID-CoA LIGASE FADD7 (FATTY-ACID-CoA SYNTHETASE) (FATTY-ACID-CoA SYNTHASE) 0.0025 0.0152 0.5
Schistosoma mansoni thyroid hormone receptor 0.003 0.0219 0.0295
Brugia malayi TAR-binding protein 0.025 0.2844 0.539
Trichomonas vaginalis Importin beta-1 subunit, putative 0.0048 0.0427 0.1946
Trypanosoma cruzi mitochondrial DNA polymerase beta-PAK, putative 0.0056 0.0523 0.1391
Trypanosoma cruzi importin beta-1 subunit, putative 0.0048 0.0427 0.1135
Schistosoma mansoni nuclear hormone receptor nor-1/nor-2 0.003 0.0219 0.0295
Brugia malayi hypothetical protein 0.0121 0.1297 0.2457
Loa Loa (eye worm) nuclear hormone receptor family member nhr-31 0.003 0.0219 0.0295
Schistosoma mansoni alpha-galactosidase/alpha-n-acetylgalactosaminidase 0.0103 0.1084 0.1468
Brugia malayi Niemann-Pick C1 protein precursor 0.0103 0.1087 0.2059
Schistosoma mansoni alpha-galactosidase/alpha-n-acetylgalactosaminidase 0.0103 0.1084 0.1468
Leishmania major 4-coumarate:coa ligase-like protein 0.0025 0.0152 0.0402
Loa Loa (eye worm) nuclear hormone receptor family member nhr-1 0.003 0.0219 0.0295
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD2 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0025 0.0152 0.0603
Loa Loa (eye worm) hypothetical protein 0.0173 0.192 0.2601
Toxoplasma gondii hypothetical protein 0.0053 0.0483 0.4451
Echinococcus multilocularis geminin 0.0175 0.1952 0.1952
Onchocerca volvulus Alhambra homolog 0.0032 0.0243 0.1704
Loa Loa (eye worm) jmjC domain-containing protein 0.0067 0.0656 0.0888
Brugia malayi isocitrate dehydrogenase 0.0015 0.0039 0.0072
Schistosoma mansoni retinoid-x-receptor (RXR) 0.003 0.0219 0.0295
Trypanosoma brucei DNA polymerase eta, putative 0.0039 0.0325 0.0865
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0109 0.1153 0.1563
Chlamydia trachomatis acylglycerophosphoethanolamine acyltransferase 0.0019 0.0077 0.5
Schistosoma mansoni jumonji/arid domain-containing protein 0.0041 0.0344 0.0465
Mycobacterium ulcerans long-chain-fatty-acid--CoA ligase 0.0025 0.0152 0.079
Brugia malayi jmjC domain containing protein 0.0041 0.0344 0.0651
Echinococcus multilocularis snurportin 1 0.0629 0.7379 0.7379
Trichomonas vaginalis importin beta-1, putative 0.0048 0.0427 0.1946
Echinococcus multilocularis nuclear receptor subfamily 4 group A 0.0014 0.0027 0.0027
Trypanosoma cruzi isocitrate dehydrogenase [NADP], mitochondrial precursor, putative 0.0015 0.0039 0.0101
Schistosoma mansoni nuclear receptor nhr-48 0.0014 0.0027 0.0035
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0092 0.0952 0.0952
Giardia lamblia GTP-binding nuclear protein RAN/TC4 0.0043 0.0374 1
Echinococcus granulosus nuclear receptor 2DBD gamma 0.003 0.0219 0.0297
Trypanosoma brucei DNA polymerase kappa, putative 0.0039 0.0325 0.0865
Schistosoma mansoni retinoid-x-receptor (RXR) 0.0016 0.0047 0.0063
Trypanosoma brucei DNA polymerase IV, putative 0.0039 0.0325 0.0865
Loa Loa (eye worm) ImpB/MucB/SamB family protein 0.0039 0.0325 0.044
Schistosoma mansoni hypothetical protein 0.0109 0.1153 0.1562
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0453 0.5275 0.7148
Giardia lamblia PHD finger protein 15 0.0032 0.0243 0.6494
Schistosoma mansoni DNA polymerase eta 0.0039 0.0325 0.044
Echinococcus granulosus Protein patched homolog 1 0.0044 0.0384 0.052
Echinococcus granulosus GPCR family 2 0.0143 0.157 0.2128
Echinococcus multilocularis dna polymerase eta 0.0039 0.0325 0.0325
Trypanosoma brucei DNA polymerase kappa, putative 0.0027 0.0179 0.0476
Leishmania major mitochondrial DNA polymerase beta 0.0326 0.375 1
Trypanosoma brucei DNA polymerase kappa, putative 0.0039 0.0325 0.0865
Loa Loa (eye worm) nuclear hormone receptor-like 1 0.0016 0.0047 0.0063
Schistosoma mansoni cpg binding protein 0.0029 0.02 0.0269
Brugia malayi GTP-binding nuclear protein RAN/TC4 0.0043 0.0374 0.0707
Echinococcus multilocularis Transcription factor, JmjC domain containing protein 0.0106 0.1126 0.1126
Trypanosoma cruzi DNA polymerase kappa, putative 0.0039 0.0325 0.0865
Schistosoma mansoni tar DNA-binding protein 0.025 0.2844 0.3853
Loa Loa (eye worm) nuclear receptor NHR-67 0.0014 0.0027 0.0035
Echinococcus granulosus dnaJ subfamily B 0.0411 0.4764 0.6455
Schistosoma mansoni tar DNA-binding protein 0.025 0.2844 0.3853
Echinococcus granulosus GTP binding nuclear protein Ran 0.0043 0.0374 0.0507
Echinococcus granulosus PHD finger protein rhinoceros 0.0032 0.0243 0.0329
Echinococcus granulosus thyroid hormone receptor alpha 0.0014 0.0027 0.0036
Loa Loa (eye worm) hypothetical protein 0.0016 0.0047 0.0063
Trypanosoma brucei GTP-binding nuclear protein rtb2, putative 0.0043 0.0374 0.0994
Loa Loa (eye worm) hypothetical protein 0.0014 0.0027 0.0035
Entamoeba histolytica Ran family GTPase 0.0043 0.0374 0.2741
Loa Loa (eye worm) nuclear hormone receptor family member nhr-49 0.003 0.0219 0.0295
Loa Loa (eye worm) hypothetical protein 0.0014 0.0027 0.0035
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0014 0.0027 0.0036
Schistosoma mansoni thyroid hormone receptor 0.003 0.0219 0.0295
Loa Loa (eye worm) nuclear receptor nhr-7B 0.0014 0.0027 0.0035
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0092 0.0952 0.1804
Echinococcus granulosus expressed conserved protein 0.0097 0.1012 0.1372
Echinococcus granulosus importin subunit beta 1 0.0059 0.056 0.0759
Brugia malayi Cytochrome P450 family protein 0.0026 0.0169 0.0318
Brugia malayi Nuclear hormone receptor family member nhr-31 0.003 0.0219 0.0413
Loa Loa (eye worm) DR-78 0.0014 0.0027 0.0035
Entamoeba histolytica Niemann-Pick C1 protein, putative 0.0103 0.1087 0.938
Schistosoma mansoni ap endonuclease 0.0019 0.008 0.0106
Plasmodium vivax importin-beta 2, putative 0.0059 0.056 1
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.003 0.0219 0.0413
Loa Loa (eye worm) hypothetical protein 0.0014 0.0027 0.0035
Echinococcus multilocularis jumonji domain containing protein 0.0045 0.0395 0.0395
Loa Loa (eye worm) hypothetical protein 0.0025 0.0152 0.0204
Loa Loa (eye worm) hypothetical protein 0.0032 0.0243 0.0328
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0092 0.0952 0.1291
Loa Loa (eye worm) hypothetical protein 0.0056 0.052 0.0704
Trypanosoma brucei DNA polymerase kappa, putative 0.0039 0.0325 0.0865
Schistosoma mansoni jumonji domain containing protein 0.0084 0.0865 0.1171
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD7 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0018 0.0065 0.0137
Echinococcus multilocularis cadherin EGF LAG seven pass G type receptor 0.0143 0.157 0.157
Schistosoma mansoni hypothetical protein 0.0143 0.157 0.2126
Trypanosoma brucei DNA polymerase kappa, putative 0.0039 0.0325 0.0865
Loa Loa (eye worm) hypothetical protein 0.0014 0.0027 0.0035
Loa Loa (eye worm) hypothetical protein 0.0012 0.0002 0.0001
Echinococcus multilocularis protein dispatched 1 0.005 0.0458 0.0458
Brugia malayi ecdysone receptor 0.0014 0.0027 0.0049
Schistosoma mansoni niemann-pick C1 (NPC1) 0.0105 0.1106 0.1497
Echinococcus granulosus hepatocyte nuclear factor 4 alpha 0.003 0.0219 0.0297
Schistosoma mansoni nuclear receptor 0.0014 0.0027 0.0035
Echinococcus multilocularis dnaJ subfamily B 0.0411 0.4764 0.4764
Echinococcus multilocularis Niemann Pick C1 protein 0.0147 0.1615 0.1615
Echinococcus multilocularis isocitrate dehydrogenase 0.0015 0.0039 0.0039
Brugia malayi Nuclear hormone receptor-like 1 0.003 0.0219 0.0413
Brugia malayi Nuclear hormone receptor family member nhr-25 0.003 0.0219 0.0413
Echinococcus multilocularis thyroid hormone receptor alpha 0.003 0.0219 0.0219
Brugia malayi PHD-finger family protein 0.0032 0.0243 0.0459
Brugia malayi Nuclear hormone receptor-like 1 0.0016 0.0047 0.0088
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0092 0.0952 0.1289
Echinococcus granulosus Transcription factor JmjC domain containing protein 0.0106 0.1126 0.1526
Echinococcus multilocularis PHD finger protein rhinoceros 0.0032 0.0243 0.0243
Trypanosoma brucei mitochondrial DNA polymerase beta-PAK 0.0154 0.1698 0.4528
Entamoeba histolytica hypothetical protein 0.0109 0.1153 1
Loa Loa (eye worm) hypothetical protein 0.0019 0.0077 0.0103
Mycobacterium tuberculosis Probable exodeoxyribonuclease III protein XthA (exonuclease III) (EXO III) (AP endonuclease VI) 0.0019 0.008 0.0217
Echinococcus multilocularis sterol regulatory element binding protein 0.0044 0.0384 0.0384
Echinococcus granulosus COUP TF:Svp nuclear hormone receptor 0.003 0.0219 0.0297
Echinococcus granulosus dna polymerase kappa 0.0039 0.0325 0.0441
Trypanosoma brucei DNA polymerase kappa, putative 0.0039 0.0325 0.0865
Schistosoma mansoni photoreceptor-specific nuclear receptor related 0.003 0.0219 0.0295
Schistosoma mansoni nuclear hormone receptor 0.0014 0.0027 0.0035
Loa Loa (eye worm) hypothetical protein 0.0014 0.0027 0.0035
Onchocerca volvulus Steroid hormone receptor family member cnr14 homolog 0.003 0.0219 0.1514
Echinococcus multilocularis dna polymerase kappa 0.0039 0.0325 0.0325
Onchocerca volvulus 0.0029 0.02 0.1362
Loa Loa (eye worm) hypothetical protein 0.0014 0.0027 0.0035
Echinococcus multilocularis Nuclear hormone receptor HR96 0.0014 0.0027 0.0027
Echinococcus multilocularis expressed conserved protein 0.0097 0.1012 0.1012
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0453 0.5275 1
Onchocerca volvulus 0.0025 0.0152 0.0983
Trypanosoma cruzi GTP-binding nuclear protein rtb2, putative 0.0043 0.0374 0.0994
Schistosoma mansoni hypothetical protein 0.0043 0.0365 0.0493
Mycobacterium ulcerans hypothetical protein 0.0025 0.0152 0.079
Mycobacterium ulcerans DNA polymerase IV 0.0039 0.0325 0.1702
Echinococcus granulosus Nuclear hormone receptor family member nhr 41 0.003 0.0219 0.0297
Echinococcus granulosus NADP dependent isocitrate dehydrogenase 0.0015 0.0039 0.0053
Schistosoma mansoni hypothetical protein 0.0043 0.0365 0.0493
Brugia malayi Nuclear hormone receptor family member nhr-41 0.003 0.0219 0.0413
Loa Loa (eye worm) steroid hormone receptor 0.003 0.0219 0.0295
Mycobacterium ulcerans acyl-CoA synthetase 0.0025 0.0152 0.079
Brugia malayi Bromodomain containing protein 0.0032 0.0243 0.0459
Brugia malayi Isocitrate dehydrogenase 0.0015 0.0039 0.0072
Treponema pallidum exodeoxyribonuclease (exoA) 0.0019 0.008 0.5
Plasmodium falciparum phd finger protein, putative 0.0032 0.0243 0.4332
Loa Loa (eye worm) RNA binding protein 0.025 0.2844 0.3853
Echinococcus granulosus nuclear receptor subfamily 1 group D 0.0016 0.0047 0.0064
Mycobacterium leprae PROBABLE FATTY-ACID-CoA LIGASE FADD2 (FATTY-ACID-CoA SYNTHETASE) (FATTY-ACID-CoA SYNTHASE) 0.0025 0.0152 0.5
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD5 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0018 0.0065 0.0137
Schistosoma mansoni alpha-galactosidase/alpha-n-acetylgalactosaminidase 0.0015 0.0029 0.0038
Loa Loa (eye worm) hypothetical protein 0.003 0.0219 0.0295
Schistosoma mansoni retinoic acid receptor RXR 0.003 0.0219 0.0295
Brugia malayi nuclear hormone receptor family member nhr-6 0.0014 0.0027 0.0049
Mycobacterium tuberculosis Conserved hypothetical protein 0.0172 0.1907 1
Schistosoma mansoni transcription factor LCR-F1 0.0109 0.1153 0.1562
Mycobacterium ulcerans long-chain fatty-acid CoA ligase 0.0025 0.0152 0.079
Trypanosoma cruzi mitochondrial DNA polymerase beta, putative 0.0326 0.375 1
Entamoeba histolytica deoxycytidyl transferase, putative 0.0039 0.0325 0.229
Trypanosoma cruzi mitochondrial DNA polymerase beta-PAK, putative 0.0046 0.0403 0.1071
Echinococcus multilocularis NADP dependent isocitrate dehydrogenase 0.0015 0.0039 0.0039
Brugia malayi nuclear receptor subfamily 1, group D, member 1, putative 0.0014 0.0027 0.0049
Echinococcus granulosus tar DNA binding protein 0.025 0.2844 0.3854
Echinococcus multilocularis importin subunit beta 1 0.0059 0.056 0.056
Brugia malayi Nuclear hormone receptor family member nhr-19 0.003 0.0219 0.0413
Loa Loa (eye worm) hypothetical protein 0.0069 0.0675 0.0913
Trichomonas vaginalis DNA polymerase eta, putative 0.0039 0.0325 0.1379
Echinococcus granulosus Niemann Pick C1 protein 0.0103 0.1087 0.1473
Echinococcus granulosus snurportin 1 0.0629 0.7379 1
Schistosoma mansoni hypothetical protein 0.0143 0.157 0.2126
Echinococcus granulosus peregrin 0.0032 0.0243 0.0329
Echinococcus granulosus Nuclear hormone receptor HR96 0.0014 0.0027 0.0036
Schistosoma mansoni zinc finger protein 0.0014 0.0027 0.0035
Loa Loa (eye worm) hypothetical protein 0.0019 0.0077 0.0103
Brugia malayi nuclear receptor NHR-88 0.0014 0.0027 0.0049
Brugia malayi nuclear hormone receptor 0.0014 0.0027 0.0049
Trypanosoma cruzi isocitrate dehydrogenase, putative 0.0015 0.0039 0.0101
Loa Loa (eye worm) hypothetical protein 0.0019 0.0077 0.0103
Schistosoma mansoni nuclear hormone receptor 0.003 0.0219 0.0295
Toxoplasma gondii exonuclease III APE 0.0019 0.008 0.0724
Echinococcus multilocularis Glycoside hydrolase, family 27 0.0103 0.1084 0.1084
Brugia malayi Nuclear hormone receptor family member nhr-3 0.003 0.0219 0.0413
Schistosoma mansoni hypothetical protein 0.031 0.356 0.4824
Leishmania major apurinic/apyrimidinic endonuclease-redox protein 0.0019 0.008 0.0209
Loa Loa (eye worm) hypothetical protein 0.0143 0.157 0.2126
Echinococcus multilocularis isocitrate dehydrogenase 2 (NADP+) 0.0015 0.0039 0.0039
Brugia malayi hypothetical protein 0.0109 0.1153 0.2185
Trypanosoma brucei apurinic/apyrimidinic endonuclease, putative 0.0019 0.008 0.0209
Mycobacterium tuberculosis Conserved hypothetical protein 0.0039 0.0325 0.1534
Echinococcus granulosus sterol regulatory element binding protein 0.0044 0.0384 0.052
Echinococcus multilocularis terminal deoxycytidyl transferase rev1 0.0039 0.0325 0.0325
Plasmodium vivax hypothetical protein, conserved 0.0012 0.0003 0.0033
Trypanosoma brucei unspecified product 0.0027 0.0179 0.0476
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.003 0.0219 0.0219
Toxoplasma gondii PHD-finger domain-containing protein 0.0032 0.0243 0.2235
Trypanosoma brucei DNA polymerase kappa, putative 0.0027 0.0179 0.0476
Leishmania major GTP-binding protein, putative 0.0043 0.0374 0.0994
Mycobacterium ulcerans hypothetical protein 0.0172 0.1907 1
Trypanosoma brucei DNA polymerase IV, putative 0.0039 0.0325 0.0865
Toxoplasma gondii PHD-finger domain-containing protein 0.0032 0.0243 0.2235
Mycobacterium tuberculosis Fatty-acid-AMP ligase FadD30 (fatty-acid-AMP synthetase) (fatty-acid-AMP synthase) 0.0019 0.0077 0.0202
Echinococcus multilocularis DNA (apurinic or apyrimidinic site) lyase 0.0019 0.008 0.008
Brugia malayi Voltage-gated calcium channel, T-type, alpha subunit. C. elegans cca-1 ortholog 0.0173 0.192 0.3638
Toxoplasma gondii histone lysine methyltransferase SET1 0.0055 0.0508 0.468
Schistosoma mansoni steroid hormone receptor ad4bp 0.003 0.0219 0.0295
Toxoplasma gondii Alpha-galactosidase 0.0015 0.0029 0.0258
Mycobacterium ulcerans long-chain-fatty-acid-CoA ligase 0.0025 0.0152 0.079
Loa Loa (eye worm) hypothetical protein 0.0016 0.0047 0.0063
Schistosoma mansoni importin beta-1 0.0059 0.056 0.0757
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.0143 0.157 0.2128
Schistosoma mansoni hypothetical protein 0.0032 0.0243 0.0328
Loa Loa (eye worm) hypothetical protein 0.0059 0.056 0.0757
Brugia malayi Nuclear hormone receptor family member nhr-14 0.003 0.0219 0.0413
Brugia malayi AMP-binding enzyme family protein 0.0025 0.0152 0.0286
Loa Loa (eye worm) hypothetical protein 0.0014 0.0027 0.0035
Echinococcus granulosus DNA apurinic or apyrimidinic site lyase 0.0019 0.008 0.0108
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0092 0.0952 0.0952
Plasmodium vivax hypothetical protein, conserved 0.0032 0.0243 0.4332
Echinococcus granulosus FTZ F1 alpha 0.003 0.0219 0.0297
Entamoeba histolytica acyl-CoA synthetase, putative 0.0025 0.0152 0.0672
Entamoeba histolytica hypothetical protein 0.0109 0.1153 1
Loa Loa (eye worm) CXXC zinc finger family protein 0.0029 0.02 0.0269
Echinococcus multilocularis Alpha N acetylgalactosaminidase 0.0103 0.1084 0.1084
Trypanosoma brucei DNA polymerase kappa, putative 0.0039 0.0325 0.0865
Onchocerca volvulus Huntingtin homolog 0.0121 0.1297 1
Trypanosoma brucei DNA polymerase beta thumb, putative 0.0046 0.0403 0.1071
Echinococcus multilocularis cpg binding protein 0.003 0.0219 0.0219
Trypanosoma cruzi DNA polymerase beta thumb, putative 0.0046 0.0403 0.1071
Schistosoma mansoni nuclear receptor 0.0014 0.0027 0.0035
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD3 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0018 0.0065 0.0137
Brugia malayi nuclear hormone receptor family member odr-7 0.0014 0.0027 0.0049
Trypanosoma cruzi DNA polymerase kappa, putative 0.0039 0.0325 0.0865
Toxoplasma gondii HEAT repeat-containing protein 0.0059 0.056 0.5159
Brugia malayi CHE-14 protein 0.0044 0.0384 0.0725
Trypanosoma brucei DNA polymerase kappa, putative 0.0027 0.0179 0.0476
Plasmodium falciparum acyl-CoA synthetase 0.0019 0.0077 0.1353
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0018 0.0068 0.009
Schistosoma mansoni bromodomain-containing nuclear protein 1 brd1 0.0032 0.0243 0.0328
Brugia malayi conserved hypotetical protein 0.0014 0.0027 0.0049
Loa Loa (eye worm) abnormal chemotaxis protein 14 0.0044 0.0384 0.0519
Leishmania major importin beta-1 subunit, putative 0.0048 0.0427 0.1135
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.0143 0.157 0.2975
Loa Loa (eye worm) hypothetical protein 0.003 0.0219 0.0295
Echinococcus granulosus cpg binding protein 0.003 0.0219 0.0297
Leishmania major 4-coumarate:coa ligase-like protein 0.0025 0.0152 0.0402
Loa Loa (eye worm) hypothetical protein 0.0016 0.0047 0.0063
Trypanosoma cruzi DNA polymerase eta, putative 0.0039 0.0325 0.0865
Schistosoma mansoni nuclear hormone receptor superfamily protein-related 0.0014 0.0027 0.0035
Loa Loa (eye worm) hypothetical protein 0.0453 0.5275 0.7148
Loa Loa (eye worm) hypothetical protein 0.031 0.356 0.4824
Schistosoma mansoni hypothetical protein 0.0043 0.0365 0.0493
Leishmania major mitochondrial DNA polymerase beta-PAK, putative 0.0154 0.1698 0.4528
Echinococcus granulosus terminal deoxycytidyl transferase rev1 0.0039 0.0325 0.0441
Trypanosoma cruzi mitochondrial DNA polymerase beta, putative 0.0326 0.375 1
Mycobacterium ulcerans DNA polymerase IV 0.0039 0.0325 0.1702
Schistosoma mansoni hypothetical protein 0.0043 0.0365 0.0493
Echinococcus granulosus retinoic acid receptor rxr beta a 0.003 0.0219 0.0297
Loa Loa (eye worm) hypothetical protein 0.003 0.0219 0.0295
Entamoeba histolytica hypothetical protein 0.0109 0.1153 1
Brugia malayi Melibiase family protein 0.0069 0.0675 0.1277
Schistosoma mansoni ap endonuclease 0.0019 0.008 0.0106
Schistosoma mansoni hypothetical protein 0.0143 0.157 0.2126
Echinococcus granulosus nuclear receptor subfamily 4 group A 0.0014 0.0027 0.0036
Loa Loa (eye worm) nuclear hormone receptor family member nhr-40 0.003 0.0219 0.0295
Brugia malayi latrophilin 2 splice variant baaae 0.031 0.356 0.6748
Onchocerca volvulus Bile acid receptor homolog 0.003 0.0219 0.1514
Schistosoma mansoni jumonji/arid domain-containing protein 0.0041 0.0344 0.0465
Trypanosoma brucei isocitrate dehydrogenase, putative 0.0015 0.0039 0.0101
Trichomonas vaginalis conserved hypothetical protein 0.0168 0.1863 1
Echinococcus granulosus Alpha N acetylgalactosaminidase 0.0103 0.1084 0.1469
Echinococcus multilocularis FTZ F1 alpha 0.003 0.0219 0.0219
Mycobacterium ulcerans fatty-acid-CoA ligase 0.0019 0.0077 0.0397
Trypanosoma brucei isocitrate dehydrogenase [NADP], mitochondrial precursor, putative 0.0015 0.0039 0.0101
Leishmania major DNA polymerase kappa, putative 0.0039 0.0325 0.0865
Schistosoma mansoni hypothetical protein 0.0143 0.157 0.2126
Trichomonas vaginalis ran, putative 0.0043 0.0374 0.165
Plasmodium vivax AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.0019 0.008 0.1404
Loa Loa (eye worm) hypothetical protein 0.003 0.0219 0.0295
Brugia malayi Steroid receptor seven-up type 2 0.003 0.0219 0.0413
Schistosoma mansoni alpha-galactosidase/alpha-n-acetylgalactosaminidase 0.0069 0.0675 0.0913
Brugia malayi AMP-binding enzyme family protein 0.0025 0.0152 0.0286
Plasmodium falciparum AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.0019 0.008 0.1404
Schistosoma mansoni tar DNA-binding protein 0.025 0.2844 0.3853
Schistosoma mansoni terminal deoxycytidyl transferase 0.0039 0.0325 0.044
Schistosoma mansoni hepatocyte nuclear factor 4-alpha (hnf-4-alpha) 0.0014 0.0027 0.0035
Schistosoma mansoni hypothetical protein 0.0175 0.1952 0.2644
Loa Loa (eye worm) hypothetical protein 0.0019 0.0077 0.0103
Trypanosoma brucei DNA polymerase kappa, putative 0.0039 0.0325 0.0865
Mycobacterium tuberculosis Possible DNA-damage-inducible protein P DinP (DNA polymerase V) (pol IV 2) (DNA nucleotidyltransferase (DNA-directed)) 0.0039 0.0325 0.1534
Loa Loa (eye worm) hypothetical protein 0.0014 0.0027 0.0035
Trypanosoma cruzi GTP-binding nuclear protein rtb2, putative 0.0043 0.0374 0.0994
Loa Loa (eye worm) nuclear hormone receptor family member nhr-41 0.003 0.0219 0.0295
Brugia malayi Nuclear hormone receptor family member nhr-40 0.003 0.0219 0.0413
Entamoeba histolytica acyl-CoA synthetase, putative 0.0025 0.0152 0.0672
Loa Loa (eye worm) nuclear hormone receptor family member nhr-14 0.003 0.0219 0.0295

Activities

Activity type Activity value Assay description Source Reference
Activity (functional) = 14.52 % Antinociceptive activity in Swiss albino mouse assessed as protection against acetic acid-induced abdominal constriction at 15 mg/kg, po measured for 10 mins after 5 mins of acetic acid challenge relative to control ChEMBL. 19481931
Activity (functional) = 31.39 % Antinociceptive activity in Swiss albino mouse assessed as protection against acetic acid-induced abdominal constriction at 30 mg/kg, po measured for 10 mins after 5 mins of acetic acid challenge relative to control ChEMBL. 19481931

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.
 
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External resources for this compound

Bibliographic References

No literature references available for this target.

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