Detailed information for compound 932664

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 346.386 | Formula: C19H18N6O
  • H donors: 2 H acceptors: 4 LogP: 4.18 Rotable bonds: 4
    Rule of 5 violations (Lipinski): 1
  • SMILES: N#Cc1cccc(c1)Nc1nc(N)nc(n1)Oc1c(C)cc(cc1C)C
  • InChi: 1S/C19H18N6O/c1-11-7-12(2)16(13(3)8-11)26-19-24-17(21)23-18(25-19)22-15-6-4-5-14(9-15)10-20/h4-9H,1-3H3,(H3,21,22,23,24,25)
  • InChiKey: RTHCVZDAWAMQOF-UHFFFAOYSA-N  


Substructure search Similarity search

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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
Trypanosoma brucei PAB1-binding protein , putative 0.0025 0.0225 0.0381
Schistosoma mansoni nuclear hormone receptor nor-1/nor-2 0.002 0.0157 0.0157
Brugia malayi steroid hormone receptor 0.002 0.0157 0.0428
Loa Loa (eye worm) hypothetical protein 0.0018 0.013 0.0353
Brugia malayi Nuclear hormone receptor family member nhr-49 0.002 0.0157 0.0428
Loa Loa (eye worm) pre-SET domain-containing protein family protein 0.0203 0.2887 0.787
Leishmania major 4-coumarate:coa ligase-like protein 0.0023 0.0208 0.0343
Loa Loa (eye worm) hypothetical protein 0.0013 0.0055 0.015
Mycobacterium leprae PROBABLE FATTY-ACID-CoA LIGASE FADD7 (FATTY-ACID-CoA SYNTHETASE) (FATTY-ACID-CoA SYNTHASE) 0.0023 0.0208 0.0642
Schistosoma mansoni Tr4/Tr2 (homologue) 0.002 0.0157 0.0157
Trichomonas vaginalis alpha-glucosidase, putative 0.0035 0.0384 0.1013
Plasmodium vivax AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.0018 0.0133 0.0131
Onchocerca volvulus Uncharacterized family 31 glucosidase KIAA1161 homolog 0.0013 0.0055 0.0167
Echinococcus multilocularis tar DNA binding protein 0.0256 0.3668 0.3668
Loa Loa (eye worm) steroid hormone receptor 0.002 0.0157 0.0428
Echinococcus multilocularis peptidase Clp (S14 family) 0.0053 0.0651 0.0651
Echinococcus granulosus hepatocyte nuclear factor 4 alpha 0.002 0.0157 0.0157
Brugia malayi Glycosyl hydrolases family 31 protein 0.0013 0.0055 0.015
Echinococcus multilocularis thyroid hormone receptor alpha 0.002 0.0157 0.0157
Toxoplasma gondii ATP-dependent Clp endopeptidase, proteolytic subunit ClpP domain-containing protein 0.0081 0.1068 1
Brugia malayi CXXC zinc finger family protein 0.0028 0.0276 0.0753
Loa Loa (eye worm) hypothetical protein 0.0017 0.012 0.0327
Brugia malayi Pax transcription activation domain interacting protein 0.0019 0.0149 0.0407
Giardia lamblia Replication factor C, subunit 1 0.0019 0.0149 1
Brugia malayi RNA binding protein 0.0256 0.3668 1
Toxoplasma gondii LsmAD domain-containing protein 0.0025 0.0225 0.0993
Onchocerca volvulus 0.0019 0.0149 0.0452
Echinococcus multilocularis lysosomal alpha glucosidase 0.0159 0.2222 0.2222
Treponema pallidum ATP-dependent Clp protease proteolytic subunit 0.0028 0.0276 0.1533
Brugia malayi topoisomerase 0.0019 0.0149 0.0407
Echinococcus granulosus FTZ F1 alpha 0.002 0.0157 0.0157
Brugia malayi Calcitonin receptor-like protein seb-1 0.0057 0.0713 0.1943
Schistosoma mansoni alpha glucosidase 0.0035 0.0384 0.0384
Echinococcus granulosus Ataxin 2 N terminaldomain containing protein 0.0011 0.0024 0.0024
Mycobacterium leprae PROBABLE ATP-DEPENDENT CLP PROTEASE PROTEOLYTIC SUBUNIT 2 CLPP2 (ENDOPEPTIDASE CLP 2) 0.0081 0.1068 1
Entamoeba histolytica Activator 1 140 kDa subunit, putative 0.0019 0.0149 0.0274
Loa Loa (eye worm) hypothetical protein 0.0017 0.012 0.0327
Loa Loa (eye worm) hypothetical protein 0.002 0.0157 0.0428
Echinococcus granulosus dnaJ subfamily B 0.0398 0.5791 0.5791
Loa Loa (eye worm) RNA binding protein 0.0256 0.3668 1
Trypanosoma cruzi mitochondrial DNA polymerase beta, putative 0.0313 0.4524 1
Brugia malayi Nuclear hormone receptor family member nhr-25 0.002 0.0157 0.0428
Echinococcus multilocularis lysosomal alpha glucosidase 0.0159 0.2222 0.2222
Mycobacterium leprae ATP-dependent Clp protease proteolytic subunit 1 0.0028 0.0276 0.1379
Brugia malayi photoreceptor-specific nuclear receptor 0.002 0.0157 0.0428
Onchocerca volvulus 0.003 0.0302 0.0914
Brugia malayi hypothetical protein 0.0035 0.0382 0.104
Chlamydia trachomatis ATP-dependent Clp protease proteolytic subunit 0.0081 0.1068 1
Schistosoma mansoni RAR-like nuclear receptor 0.002 0.0157 0.0157
Loa Loa (eye worm) nuclear Hormone Receptor family member 0.002 0.0157 0.0428
Trichomonas vaginalis neutral alpha-glucosidase ab precursor, putative 0.0035 0.0384 0.1013
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.003 0.0302 0.0302
Brugia malayi exodeoxyribonuclease III family protein 0.0018 0.0133 0.0361
Schistosoma mansoni retinoid-x-receptor (RXR) 0.0011 0.0017 0.0017
Echinococcus granulosus histone lysine N methyltransferase MLL3 0.001 0.0005 0.0005
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.002 0.0157 0.0157
Loa Loa (eye worm) hypothetical protein 0.002 0.0157 0.0428
Loa Loa (eye worm) hypothetical protein 0.0081 0.1068 0.291
Toxoplasma gondii histone lysine methyltransferase SET/SUV39 0.003 0.0302 0.181
Schistosoma mansoni photoreceptor-specific nuclear receptor related 0.002 0.0157 0.0157
Brugia malayi F/Y-rich N-terminus family protein 0.001 0.0003 0.0008
Trypanosoma brucei glucosidase, putative 0.0035 0.0384 0.0736
Trypanosoma cruzi mitochondrial DNA polymerase beta-PAK, putative 0.0044 0.0516 0.1031
Echinococcus granulosus nuclear receptor 2DBD gamma 0.002 0.0157 0.0157
Echinococcus multilocularis nibrin 0.0019 0.0149 0.0149
Echinococcus granulosus GPCR family 2 0.0018 0.013 0.013
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0057 0.0713 0.1943
Trichomonas vaginalis RNA polymerase II ctd phosphatase, putative 0.0019 0.0149 0.029
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0046 0.0541 0.1476
Trichomonas vaginalis conserved hypothetical protein 0.0019 0.0149 0.029
Loa Loa (eye worm) latrophilin receptor protein 2 0.0018 0.013 0.0353
Brugia malayi hypothetical protein 0.0016 0.0096 0.0261
Entamoeba histolytica exodeoxyribonuclease III, putative 0.0018 0.0133 0.0225
Trichomonas vaginalis maltase-glucoamylase, putative 0.0035 0.0384 0.1013
Schistosoma mansoni alpha-glucosidase 0.0137 0.1893 0.1893
Brugia malayi Nuclear hormone receptor family member nhr-41 0.002 0.0157 0.0428
Entamoeba histolytica glycosyl hydrolase, family 31 protein 0.0035 0.0384 0.0956
Echinococcus multilocularis FTZ F1 alpha 0.002 0.0157 0.0157
Loa Loa (eye worm) hypothetical protein 0.0017 0.012 0.0327
Loa Loa (eye worm) hypothetical protein 0.0011 0.0017 0.0046
Mycobacterium ulcerans hypothetical protein 0.0165 0.2317 1
Echinococcus granulosus neutral alpha glucosidase AB 0.0035 0.0384 0.0384
Treponema pallidum DNA ligase (lig) 0.0019 0.0149 0.0179
Loa Loa (eye worm) nuclear hormone receptor family member nhr-1 0.002 0.0157 0.0428
Trichomonas vaginalis ap endonuclease, putative 0.0018 0.0133 0.0238
Echinococcus granulosus 5'partial|histone lysine N methyltransferase SETDB2 0.0028 0.0277 0.0277
Entamoeba histolytica acyl-coA synthetase, putative 0.0023 0.0208 0.0445
Loa Loa (eye worm) glycosyl hydrolase family 31 protein 0.0159 0.2222 0.6058
Schistosoma mansoni hypothetical protein 0.0018 0.013 0.013
Trypanosoma cruzi hypothetical protein, conserved 0.0019 0.0149 0.0211
Schistosoma mansoni alpha-glucosidase 0.0137 0.1893 0.1893
Schistosoma mansoni mixed-lineage leukemia protein mll 0.006 0.0759 0.0759
Loa Loa (eye worm) hypothetical protein 0.0011 0.0017 0.0046
Leishmania major 4-coumarate:coa ligase-like protein 0.0023 0.0208 0.0343
Schistosoma mansoni cpg binding protein 0.003 0.03 0.03
Onchocerca volvulus 0.002 0.0157 0.0475
Loa Loa (eye worm) hypothetical protein 0.0019 0.0149 0.0407
Loa Loa (eye worm) hypothetical protein 0.0017 0.012 0.0327
Toxoplasma gondii histone lysine methyltransferase SET1 0.0054 0.0665 0.5692
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.002 0.0157 0.0428
Brugia malayi hypothetical protein 0.0011 0.0017 0.0046
Schistosoma mansoni tar DNA-binding protein 0.0256 0.3668 0.3668
Loa Loa (eye worm) hypothetical protein 0.0011 0.0017 0.0046
Brugia malayi nuclear receptor RXR 0.0011 0.0017 0.0046
Brugia malayi Nuclear hormone receptor family member nhr-14 0.002 0.0157 0.0428
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0046 0.0541 0.0541
Echinococcus multilocularis hepatocyte nuclear factor 4 alpha 0.002 0.0157 0.0157
Echinococcus multilocularis microtubule associated protein 2 0.0681 1 1
Brugia malayi Probable ClpP-like protease 0.0081 0.1068 0.291
Trypanosoma cruzi mitochondrial DNA polymerase beta, putative 0.0313 0.4524 1
Loa Loa (eye worm) hypothetical protein 0.002 0.0157 0.0428
Brugia malayi Pre-SET motif family protein 0.003 0.0302 0.0823
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.0256 0.3668 1
Brugia malayi hypothetical protein 0.0019 0.0149 0.0407
Entamoeba histolytica glycosyl hydrolase, family 31 protein 0.0035 0.0384 0.0956
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0035 0.0382 0.0382
Loa Loa (eye worm) hypothetical protein 0.0019 0.0149 0.0407
Trichomonas vaginalis conserved hypothetical protein 0.0019 0.0149 0.029
Mycobacterium tuberculosis Conserved hypothetical protein 0.0165 0.2317 1
Mycobacterium ulcerans short-chain type dehydrogenase/reductase 0.0057 0.0715 0.2706
Schistosoma mansoni hypothetical protein 0.0018 0.013 0.013
Mycobacterium tuberculosis Fatty-acid-AMP ligase FadD30 (fatty-acid-AMP synthetase) (fatty-acid-AMP synthase) 0.0017 0.012 0.0064
Brugia malayi ecdysteroid receptor 0.002 0.0157 0.0428
Echinococcus granulosus tar DNA binding protein 0.0256 0.3668 0.3668
Loa Loa (eye worm) exodeoxyribonuclease III family protein 0.0018 0.0133 0.0361
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.002 0.0157 0.0428
Trichomonas vaginalis replication factor C large subunit, putative 0.0019 0.0149 0.029
Brugia malayi Nuclear hormone receptor-like 1 0.002 0.0157 0.0428
Onchocerca volvulus 0.0028 0.0276 0.0836
Loa Loa (eye worm) hypothetical protein 0.0019 0.0149 0.0407
Plasmodium falciparum AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.0018 0.0133 0.0131
Echinococcus multilocularis Nuclear hormone receptor family member nhr 41 0.002 0.0157 0.0157
Loa Loa (eye worm) hypothetical protein 0.002 0.0157 0.0428
Wolbachia endosymbiont of Brugia malayi NAD-dependent DNA ligase, Lig 0.0019 0.0149 0.0179
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0046 0.0541 0.0541
Trypanosoma cruzi apurinic/apyrimidinic endonuclease 0.0018 0.0133 0.0173
Echinococcus multilocularis geminin 0.0332 0.4803 0.4803
Toxoplasma gondii hypothetical protein 0.0028 0.0276 0.1533
Plasmodium vivax ATP-dependent Clp protease proteolytic subunit, putative 0.0028 0.0276 0.1644
Trichomonas vaginalis ap endonuclease, putative 0.0018 0.0133 0.0238
Echinococcus multilocularis cpg binding protein 0.003 0.03 0.03
Trypanosoma brucei BRCA1 C Terminus (BRCT) domain containing protein, putative 0.0019 0.0149 0.0211
Mycobacterium ulcerans hypothetical protein 0.0023 0.0208 0.0401
Trichomonas vaginalis chromosome transmission fidelity factor, putative 0.0019 0.0149 0.029
Entamoeba histolytica acyl-CoA synthetase, putative 0.0023 0.0208 0.0445
Schistosoma mansoni chromosome transmission fidelity factor 0.0019 0.0149 0.0149
Echinococcus granulosus Nuclear hormone receptor family member nhr 41 0.002 0.0157 0.0157
Loa Loa (eye worm) hypothetical protein 0.002 0.0157 0.0428
Trypanosoma cruzi DNA polymerase beta thumb, putative 0.0044 0.0516 0.1031
Schistosoma mansoni 3-hydroxyacyl-CoA dehydrogenase 0.0057 0.0715 0.0715
Trypanosoma cruzi mitochondrial DNA polymerase beta-PAK, putative 0.0148 0.2067 0.4503
Loa Loa (eye worm) nuclear hormone receptor family member nhr-49 0.002 0.0157 0.0428
Mycobacterium ulcerans short-chain type dehydrogenase/reductase 0.0057 0.0715 0.2706
Schistosoma mansoni hypothetical protein 0.0011 0.0024 0.0024
Echinococcus multilocularis Ataxin 2, N terminal,domain containing protein 0.0011 0.0024 0.0024
Leishmania major mitochondrial DNA polymerase beta 0.0313 0.4524 1
Trypanosoma brucei mitochondrial DNA polymerase beta-PAK 0.0148 0.2067 0.4503
Trypanosoma cruzi BRCA1 C Terminus (BRCT) domain containing protein, putative 0.0019 0.0149 0.0211
Trypanosoma cruzi hypothetical protein, conserved 0.0019 0.0149 0.0211
Trichomonas vaginalis alpha-glucosidase, putative 0.0035 0.0384 0.1013
Loa Loa (eye worm) hypothetical protein 0.0057 0.0713 0.1943
Brugia malayi ATP dependent DNA ligase C terminal region family protein 0.0019 0.0149 0.0407
Plasmodium vivax ATP-dependent Clp protease proteolytic subunit, putative 0.0081 0.1068 1
Toxoplasma gondii ATP-dependent Clp endopeptidase, proteolytic subunit ClpP domain-containing protein 0.0081 0.1068 1
Mycobacterium ulcerans long-chain-fatty-acid--CoA ligase 0.0023 0.0208 0.0401
Schistosoma mansoni cpg binding protein 0.003 0.03 0.03
Echinococcus multilocularis DNA (apurinic or apyrimidinic site) lyase 0.0018 0.0133 0.0133
Brugia malayi latrophilin 2 splice variant baaae 0.0039 0.0443 0.1207
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.002 0.0157 0.0157
Entamoeba histolytica hypothetical protein 0.0035 0.0382 0.0948
Loa Loa (eye worm) nuclear hormone receptor family member nhr-14 0.002 0.0157 0.0428
Echinococcus multilocularis histone lysine N methyltransferase MLL3 0.001 0.0005 0.0005
Schistosoma mansoni hypothetical protein 0.0039 0.0443 0.0443
Schistosoma mansoni topbp1 0.0019 0.0149 0.0149
Toxoplasma gondii hypothetical protein 0.005 0.0612 0.5129
Onchocerca volvulus 0.0011 0.002 0.006
Loa Loa (eye worm) glycosyl hydrolase family 31 protein 0.0035 0.0384 0.1047
Schistosoma mansoni FTZ-F1 nuclear receptor-like protein 0.002 0.0157 0.0157
Toxoplasma gondii ATPase, AAA family protein 0.0019 0.0149 0.0179
Trypanosoma cruzi DNA polymerase beta thumb, putative 0.0044 0.0516 0.1031
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0046 0.0541 0.0541
Trichomonas vaginalis neutral alpha-glucosidase ab precursor, putative 0.0035 0.0384 0.1013
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.0018 0.013 0.0353
Leishmania major hypothetical protein, conserved 0.0025 0.0225 0.0381
Plasmodium vivax SET domain protein, putative 0.003 0.0302 0.1918
Brugia malayi Nuclear hormone receptor family member nhr-19 0.002 0.0157 0.0428
Brugia malayi hypothetical protein 0.0025 0.0225 0.0614
Echinococcus granulosus 3 hydroxyacyl coenzyme A dehydrogenase type 2 0.0057 0.0715 0.0715
Brugia malayi AMP-binding enzyme family protein 0.0023 0.0208 0.0568
Loa Loa (eye worm) hypothetical protein 0.0244 0.3498 0.9536
Trypanosoma brucei mitochondrial DNA polymerase beta 0.0313 0.4524 1
Loa Loa (eye worm) nuclear hormone receptor family member nhr-31 0.002 0.0157 0.0428
Loa Loa (eye worm) CXXC zinc finger family protein 0.0028 0.0276 0.0753
Schistosoma mansoni tar DNA-binding protein 0.0256 0.3668 0.3668
Schistosoma mansoni hypothetical protein 0.0332 0.4803 0.4803
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0057 0.0713 0.1943
Echinococcus multilocularis COUP TF:Svp nuclear hormone receptor 0.002 0.0157 0.0157
Leishmania major 4-coumarate:coa ligase-like protein 0.0023 0.0208 0.0343
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.003 0.0302 0.0302
Echinococcus multilocularis ATP dependent Clp protease proteolytic subunit 0.0081 0.1068 0.1068
Brugia malayi nuclear receptor NHR-88 0.002 0.0157 0.0428
Schistosoma mansoni ap endonuclease 0.0018 0.0133 0.0133
Schistosoma mansoni tar DNA-binding protein 0.0256 0.3668 0.3668
Mycobacterium leprae PROBABLE FATTY-ACID-CoA LIGASE FADD2 (FATTY-ACID-CoA SYNTHETASE) (FATTY-ACID-CoA SYNTHASE) 0.0023 0.0208 0.0642
Trichomonas vaginalis conserved hypothetical protein 0.0019 0.0149 0.029
Trypanosoma cruzi FHA domain containing protein, putative 0.0019 0.0149 0.0211
Trypanosoma cruzi PAB1-binding protein , putative 0.0025 0.0225 0.0381
Entamoeba histolytica acyl-CoA synthetase, putative 0.0023 0.0208 0.0445
Loa Loa (eye worm) hypothetical protein 0.0023 0.0208 0.0568
Mycobacterium ulcerans acyl-CoA synthetase 0.0023 0.0208 0.0401
Mycobacterium tuberculosis Probable short-chain type dehydrogenase/reductase 0.0057 0.0715 0.2753
Loa Loa (eye worm) hypothetical protein 0.0023 0.0208 0.0568
Echinococcus multilocularis nuclear receptor subfamily 1 group D 0.0011 0.0017 0.0017
Plasmodium vivax ataxin-2 like protein, putative 0.0025 0.0225 0.1111
Trypanosoma brucei apurinic/apyrimidinic endonuclease, putative 0.0018 0.0133 0.0173
Trypanosoma cruzi hypothetical protein, conserved 0.0035 0.0384 0.0736
Mycobacterium ulcerans long-chain fatty-acid CoA ligase 0.0023 0.0208 0.0401
Schistosoma mansoni hypothetical protein 0.0398 0.5791 0.5791
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0046 0.0541 0.0541
Echinococcus granulosus DNA apurinic or apyrimidinic site lyase 0.0018 0.0133 0.0133
Loa Loa (eye worm) 3-hydroxyacyl-CoA dehydrogenase type II 0.0054 0.0657 0.1791
Loa Loa (eye worm) hypothetical protein 0.0019 0.0149 0.0407
Echinococcus multilocularis cadherin EGF LAG seven pass G type receptor 0.0018 0.013 0.013
Brugia malayi N-terminal motif family protein 0.0176 0.2478 0.6754
Echinococcus multilocularis neutral alpha glucosidase AB 0.0035 0.0384 0.0384
Brugia malayi Pre-SET motif family protein 0.0203 0.2887 0.787
Trichomonas vaginalis alpha-glucosidase, putative 0.0035 0.0384 0.1013
Echinococcus multilocularis FTZ F1 nuclear receptor protein 0.002 0.0157 0.0157
Schistosoma mansoni retinoic acid receptor RXR 0.002 0.0157 0.0157
Mycobacterium ulcerans exodeoxyribonuclease III protein XthA 0.0018 0.0133 0.0057
Entamoeba histolytica Acid sphingomyelinase-like phosphodiesterase, putative 0.0244 0.3498 1
Trichomonas vaginalis conserved hypothetical protein 0.0019 0.0149 0.029
Brugia malayi Glycosyl hydrolases family 31 protein 0.0035 0.0384 0.1047
Entamoeba histolytica hypothetical protein 0.0035 0.0382 0.0948
Echinococcus granulosus replication factor c subunit 1 0.0019 0.0149 0.0149
Trypanosoma cruzi hypothetical protein, conserved 0.0035 0.0384 0.0736
Mycobacterium ulcerans NAD-dependent DNA ligase LigA 0.0019 0.0149 0.0133
Trypanosoma cruzi mitochondrial DNA polymerase beta-PAK, putative 0.0054 0.0659 0.1352
Mycobacterium ulcerans ATP-dependent Clp protease proteolytic subunit 0.0081 0.1068 0.4313
Echinococcus granulosus peptidase Clp S14 family 0.0053 0.0651 0.0651
Mycobacterium tuberculosis Probable chain -fatty-acid-CoA ligase FadD13 (fatty-acyl-CoA synthetase) 0.0023 0.0208 0.0463
Entamoeba histolytica hypothetical protein 0.0019 0.0149 0.0274
Schistosoma mansoni hypothetical protein 0.0035 0.0382 0.0382
Echinococcus granulosus nuclear receptor 2DBD gamma 0.002 0.0157 0.0157
Brugia malayi DKFZp564C0469 protein 0.0019 0.0149 0.0407
Mycobacterium ulcerans ATP-dependent Clp protease proteolytic subunit 0.0081 0.1068 0.4313
Brugia malayi hypothetical protein 0.0011 0.0017 0.0046
Echinococcus multilocularis 3 hydroxyacyl coenzyme A dehydrogenase type 2 0.0057 0.0715 0.0715
Echinococcus multilocularis histone lysine N methyltransferase SETMAR 0.003 0.0302 0.0302
Brugia malayi AMP-binding enzyme family protein 0.0023 0.0208 0.0568
Entamoeba histolytica Acid sphingomyelinase-like phosphodiesterase, putative 0.0244 0.3498 1
Brugia malayi AMP-binding enzyme family protein 0.0023 0.0208 0.0568
Brugia malayi Nuclear hormone receptor family member nhr-31 0.002 0.0157 0.0428
Chlamydia trachomatis DNA ligase 0.0019 0.0149 0.0308
Loa Loa (eye worm) hypothetical protein 0.002 0.0157 0.0428
Schistosoma mansoni thyroid hormone receptor 0.002 0.0157 0.0157
Loa Loa (eye worm) hypothetical protein 0.0176 0.2478 0.6754
Onchocerca volvulus 0.0023 0.0208 0.063
Trichomonas vaginalis sucrase-isomaltase, putative 0.0035 0.0384 0.1013
Echinococcus granulosus histone lysine methyltransferase setb 0.003 0.0302 0.0302
Plasmodium falciparum replication factor C subunit 1, putative 0.0019 0.0149 0.0308
Brugia malayi Nuclear hormone receptor family member nhr-1 0.002 0.0157 0.0428
Schistosoma mansoni transcription factor LCR-F1 0.0035 0.0382 0.0382
Echinococcus granulosus nibrin 0.0019 0.0149 0.0149
Mycobacterium ulcerans long-chain-fatty-acid-CoA ligase 0.0023 0.0208 0.0401
Toxoplasma gondii glycosyl hydrolase, family 31 protein 0.0035 0.0384 0.269
Echinococcus multilocularis replication factor c subunit 1 0.0019 0.0149 0.0149
Brugia malayi RNA recognition motif domain containing protein 0.0256 0.3668 1
Brugia malayi Latrophilin receptor protein 2 0.0018 0.013 0.0353
Schistosoma mansoni coup transcription factor 0.002 0.0157 0.0157
Echinococcus granulosus ecdysone induced protein 78C 0.002 0.0157 0.0157
Schistosoma mansoni hypothetical protein 0.0018 0.013 0.013
Schistosoma mansoni microtubule-associated protein tau 0.0681 1 1
Brugia malayi nuclear hormone receptor 0.002 0.0157 0.0428
Trichomonas vaginalis alpha-glucosidase, putative 0.0035 0.0384 0.1013
Brugia malayi Nuclear hormone receptor family member nhr-25 0.002 0.0157 0.0428
Loa Loa (eye worm) nuclear hormone receptor-like 1 0.0011 0.0017 0.0046
Trichomonas vaginalis RNA polymerase II ctd phosphatase, putative 0.0019 0.0149 0.029
Loa Loa (eye worm) TAR-binding protein 0.0256 0.3668 1
Mycobacterium ulcerans acyl-CoA synthetase 0.0023 0.0208 0.0401
Entamoeba histolytica hypothetical protein 0.0035 0.0382 0.0948
Trichomonas vaginalis alpha-glucosidase, putative 0.0035 0.0384 0.1013
Onchocerca volvulus 0.0231 0.3304 1
Leishmania major alpha glucosidase II subunit, putative 0.0035 0.0384 0.0736
Toxoplasma gondii poly(ADP-ribose) polymerase catalytic domain-containing protein 0.0019 0.0149 0.0179
Trypanosoma cruzi apurinic/apyrimidinic endonuclease, putative 0.0018 0.0133 0.0173
Brugia malayi Steroid receptor seven-up type 2 0.002 0.0157 0.0428
Loa Loa (eye worm) nuclear hormone receptor family member nhr-40 0.002 0.0157 0.0428
Schistosoma mansoni tar DNA-binding protein 0.0256 0.3668 0.3668
Trypanosoma brucei DNA polymerase beta thumb, putative 0.0044 0.0516 0.1031
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD2 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0023 0.0208 0.0463
Echinococcus granulosus cpg binding protein 0.003 0.03 0.03
Schistosoma mansoni ecdysone-induced protein 78c (dr-78) 0.0011 0.0017 0.0017
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.003 0.0302 0.0302
Brugia malayi Nuclear hormone receptor-like 1 0.0011 0.0017 0.0046
Schistosoma mansoni thyroid hormone receptor 0.002 0.0157 0.0157
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0046 0.0541 0.0541
Loa Loa (eye worm) hypothetical protein 0.0019 0.0149 0.0407
Loa Loa (eye worm) hypothetical protein 0.0025 0.0225 0.0614
Onchocerca volvulus Protein ultraspiracle homolog 0.002 0.0157 0.0475
Brugia malayi TAR-binding protein 0.0256 0.3668 1
Echinococcus granulosus geminin 0.0332 0.4803 0.4803
Brugia malayi hypothetical protein 0.0019 0.0149 0.0407
Treponema pallidum ATP-dependent Clp protease proteolytic subunit 0.0081 0.1068 1
Onchocerca volvulus 0.0092 0.1226 0.3712
Loa Loa (eye worm) hypothetical protein 0.003 0.0302 0.0823
Plasmodium falciparum ataxin-2 like protein, putative 0.0025 0.0225 0.1111
Schistosoma mansoni DNA ligase IV 0.0019 0.0149 0.0149
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.0018 0.013 0.013
Loa Loa (eye worm) nuclear hormone receptor family member nhr-41 0.002 0.0157 0.0428
Schistosoma mansoni cpg binding protein 0.0028 0.0276 0.0276
Mycobacterium tuberculosis Probable ATP-dependent CLP protease proteolytic subunit 2 ClpP2 (endopeptidase CLP 2) 0.0053 0.0651 0.2468
Echinococcus granulosus cadherin EGF LAG seven pass G type receptor 0.0018 0.013 0.013
Echinococcus granulosus FTZ F1 nuclear receptor protein 0.002 0.0157 0.0157
Mycobacterium ulcerans fatty-acid-CoA ligase 0.0023 0.0208 0.0401
Leishmania major 3-oxoacyl-(acyl-carrier protein) reductase, putative 0.0057 0.0715 0.1476
Schistosoma mansoni hypothetical protein 0.0332 0.4803 0.4803
Chlamydia trachomatis ATP-dependent Clp protease proteolytic subunit 0.0081 0.1068 1
Onchocerca volvulus Steroid hormone receptor family member cnr14 homolog 0.002 0.0157 0.0475
Loa Loa (eye worm) hypothetical protein 0.0019 0.0149 0.0407
Schistosoma mansoni tar DNA-binding protein 0.0256 0.3668 0.3668
Loa Loa (eye worm) hypothetical protein 0.0017 0.012 0.0327
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.0018 0.013 0.013
Trypanosoma cruzi PAB1-binding protein , putative 0.0025 0.0225 0.0381
Brugia malayi Nuclear hormone receptor family member nhr-19 0.002 0.0157 0.0428
Schistosoma mansoni ap endonuclease 0.0018 0.0133 0.0133
Entamoeba histolytica hypothetical protein 0.0035 0.0382 0.0948
Leishmania major mitochondrial DNA polymerase beta-PAK, putative 0.0148 0.2067 0.4503
Brugia malayi Nuclear hormone receptor family member nhr-3 0.002 0.0157 0.0428
Schistosoma mansoni peptidase Clp (S14 family) 0.0081 0.1068 0.1068
Onchocerca volvulus Bile acid receptor homolog 0.002 0.0157 0.0475
Echinococcus granulosus nuclear receptor subfamily 1 group D 0.0011 0.0017 0.0017
Schistosoma mansoni topbp1 0.0019 0.0149 0.0149
Leishmania major apurinic/apyrimidinic endonuclease-redox protein 0.0018 0.0133 0.0173
Echinococcus granulosus ATP dependent Clp protease proteolytic subunit 0.0081 0.1068 0.1068
Mycobacterium tuberculosis Probable exodeoxyribonuclease III protein XthA (exonuclease III) (EXO III) (AP endonuclease VI) 0.0018 0.0133 0.012
Loa Loa (eye worm) hypothetical protein 0.0011 0.0017 0.0046
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0035 0.0382 0.0382
Trichomonas vaginalis set domain proteins, putative 0.0231 0.3304 1
Schistosoma mansoni steroid hormone receptor ad4bp 0.002 0.0157 0.0157
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0046 0.0541 0.0541
Brugia malayi Nuclear hormone receptor family member nhr-40 0.002 0.0157 0.0428
Echinococcus granulosus lysosomal alpha glucosidase 0.0159 0.2222 0.2222
Loa Loa (eye worm) hypothetical protein 0.0011 0.0017 0.0046
Plasmodium falciparum ATP-dependent Clp protease proteolytic subunit 0.0081 0.1068 1
Schistosoma mansoni retinoid-x-receptor (RXR) 0.002 0.0157 0.0157
Mycobacterium leprae PROBABLE ATP-DEPENDENT CLP PROTEASE PROTEOLYTIC SUBUNIT 1 CLPP1 (ENDOPEPTIDASE CLP) 0.0053 0.0651 0.5469
Loa Loa (eye worm) hypothetical protein 0.002 0.0157 0.0428
Echinococcus multilocularis dnaJ subfamily B 0.0398 0.5791 0.5791
Echinococcus granulosus retinoic acid receptor rxr beta a 0.002 0.0157 0.0157
Trichomonas vaginalis conserved hypothetical protein 0.0019 0.0149 0.029
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0046 0.0541 0.1476
Loa Loa (eye worm) histone methyltransferase 0.001 0.0005 0.0013
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0046 0.0541 0.0541
Trichomonas vaginalis chromosome transmission fidelity factor, putative 0.0019 0.0149 0.029
Onchocerca volvulus Rap guanine nucleotide exchange factor 1 homolog 0.0176 0.2478 0.7499
Echinococcus multilocularis ecdysone induced protein 78C 0.002 0.0157 0.0157
Brugia malayi Glycosyl hydrolases family 31 protein 0.0159 0.2222 0.6058
Echinococcus multilocularis histone lysine methyltransferase setb histone lysine methyltransferase eggless 0.003 0.0302 0.0302
Echinococcus granulosus COUP TF:Svp nuclear hormone receptor 0.002 0.0157 0.0157
Brugia malayi Nuclear hormone receptor-like 1 0.0011 0.0017 0.0046
Loa Loa (eye worm) hypothetical protein 0.002 0.0157 0.0428
Schistosoma mansoni nuclear receptor 2DBD-gamma 0.002 0.0157 0.0157
Plasmodium falciparum ATP-dependent Clp protease proteolytic subunit 0.0028 0.0276 0.1644
Schistosoma mansoni hypothetical protein 0.0018 0.013 0.013
Loa Loa (eye worm) hypothetical protein 0.0039 0.0443 0.1207
Mycobacterium tuberculosis Probable ATP-dependent CLP protease proteolytic subunit 1 ClpP1 (endopeptidase CLP) 0.0053 0.0651 0.2468
Schistosoma mansoni histone-lysine n-methyltransferase suv9 0.003 0.0302 0.0302
Brugia malayi 3-hydroxyacyl-CoA dehydrogenase type II 0.0057 0.0715 0.1948
Loa Loa (eye worm) hypothetical protein 0.0023 0.0208 0.0568
Echinococcus multilocularis GPCR, family 2 0.0018 0.013 0.013
Wolbachia endosymbiont of Brugia malayi ATP-dependent Clp protease proteolytic subunit 0.0081 0.1068 1
Mycobacterium ulcerans acyl-CoA synthetase 0.0023 0.0208 0.0401
Plasmodium falciparum ataxin-2 like protein, putative 0.0025 0.0225 0.1111
Plasmodium vivax replication factor C subunit 1, putative 0.0019 0.0149 0.0308
Schistosoma mansoni nuclear hormone receptor 0.002 0.0157 0.0157

Activities

Activity type Activity value Assay description Source Reference
IC50 (functional) = 0.21 uM Antitrypanocidal activity against suramin-sensitive Trypanosoma brucei brucei Squib427 assessed as reduction in parasite growth after 72 hrs ChEMBL. 25199582
IC50 (functional) = 0.84 uM Antitrypanocidal activity against suramin-sensitive Trypanosoma brucei rhodesiense STIB-900 assessed as reduction in parasite growth after 72 hrs ChEMBL. 25199582
IC50 (functional) = 4.51 uM Trypanocidal activity against nifurtimox-sensitive Trypanosoma cruzi Tulahuen CL2 infected in human MRC5 SV2 cells assessed as parasite growth inhibition after 168 hrs by beta-galactosidase assay ChEMBL. 25199582
IC50 (functional) = 6.27 uM Antiplasmodial activity against chloroquine-resistant Plasmodium falciparum K1 infected in human O positive erythrocyte assessed as reduction in parasitemia after 72 hrs ChEMBL. 25199582
IC50 (functional) = 18.16 uM Antileishmanial activity against Leishmania infantum MHOM/MA (BE)/67 infected in primary peritoneal mouse macrophages assessed as reduction in parasite burdun ChEMBL. 25199582

Phenotypes

Whole-cell/tissue/organism interactions

Species name Source Reference Is orphan
Trypanosoma cruzi ChEMBL23 25199582
Trypanosoma brucei gambiense 25199582
Plasmodium falciparum 25199582
Leishmania infantum ChEMBL23 25199582

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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