Detailed information for compound 1455073

Basic information

Technical information
  • TDR Targets ID: 1455073
  • Name: 1-(5-chloro-2-methylphenyl)-4-[1-[1-(furan-2- ylmethyl)tetrazol-5-yl]butyl]piperazine hydro chloride
  • MW: 451.393 | Formula: C21H28Cl2N6O
  • H donors: 0 H acceptors: 3 LogP: 4.8 Rotable bonds: 7
    Rule of 5 violations (Lipinski): 1
  • SMILES: CCCC(c1nnnn1Cc1ccco1)N1CCN(CC1)c1cc(Cl)ccc1C.Cl
  • InChi: 1S/C21H27ClN6O.ClH/c1-3-5-19(21-23-24-25-28(21)15-18-6-4-13-29-18)26-9-11-27(12-10-26)20-14-17(22)8-7-16(20)2;/h4,6-8,13-14,19H,3,5,9-12,15H2,1-2H3;1H
  • InChiKey: BTLRQWTVQRIMPM-UHFFFAOYSA-N  

Network

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Synonyms

  • 1-(5-chloro-2-methyl-phenyl)-4-[1-[1-(2-furylmethyl)tetrazol-5-yl]butyl]piperazine hydrochloride
  • 1-(5-chloro-2-methylphenyl)-4-[1-[1-(2-furylmethyl)-5-tetrazolyl]butyl]piperazine hydrochloride
  • 1-(5-chloro-2-methyl-phenyl)-4-[1-[1-(furan-2-ylmethyl)-1,2,3,4-tetrazol-5-yl]butyl]piperazine hydrochloride
  • 1-(5-Chloro-2-methyl-phenyl)-4-[1-(1-furan-2-ylmethyl-1H-tetrazol-5-yl)-butyl]-piperazine
  • MLS000070880
  • SMR000005004

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens calcium channel, voltage-dependent, T type, alpha 1H subunit Starlite/ChEMBL No references
Homo sapiens thyroid stimulating hormone receptor Starlite/ChEMBL No references
Homo sapiens neuropeptide S receptor 1 Starlite/ChEMBL No references
Homo sapiens ubiquitin specific peptidase 2 Starlite/ChEMBL No references
Homo sapiens glucagon-like peptide 1 receptor Starlite/ChEMBL No references
Homo sapiens multiple endocrine neoplasia I No references
Homo sapiens arachidonate 15-lipoxygenase Starlite/ChEMBL No references
Homo sapiens lysine (K)-specific methyltransferase 2A Starlite/ChEMBL No references
Influenza A virus Nonstructural protein 1 Starlite/ChEMBL No references

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Echinococcus granulosus neuropeptide s receptor Get druggable targets OG5_136011 All targets in OG5_136011
Trypanosoma brucei ubiquitin carboxyl-terminal hydrolase, putative Get druggable targets OG5_127431 All targets in OG5_127431
Brugia malayi Ubiquitin carboxyl-terminal hydrolase family protein Get druggable targets OG5_127431 All targets in OG5_127431
Toxoplasma gondii histone lysine methyltransferase SET1 Get druggable targets OG5_130642 All targets in OG5_130642
Neospora caninum Multidomain chromatinic protein with the following architecture: 3x PHD-bromo-3xPHD-SET domain and associated cysteine cluster a Get druggable targets OG5_130642 All targets in OG5_130642
Schistosoma japonicum Menin, putative Get druggable targets OG5_133913 All targets in OG5_133913
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_127431 All targets in OG5_127431
Schistosoma japonicum IPR001394,Peptidase C19, ubiquitin carboxyl-terminal hydrolase 2,domain-containing Get druggable targets OG5_127431 All targets in OG5_127431
Echinococcus granulosus neuropeptide receptor A26 Get druggable targets OG5_136011 All targets in OG5_136011
Brugia malayi follicle stimulating hormone receptor Get druggable targets OG5_130089 All targets in OG5_130089
Schistosoma mansoni hypothetical protein Get druggable targets OG5_133913 All targets in OG5_133913
Leishmania donovani ubiquitin carboxyl-terminal hydrolase, putative Get druggable targets OG5_127431 All targets in OG5_127431
Giardia lamblia Ubiquitin carboxyl-terminal hydrolase 4 Get druggable targets OG5_127431 All targets in OG5_127431
Schistosoma japonicum Ubiquitin carboxyl-terminal hydrolase 8, putative Get druggable targets OG5_127431 All targets in OG5_127431
Candida albicans ubiquitin-specific protease Get druggable targets OG5_127431 All targets in OG5_127431
Trichomonas vaginalis conserved hypothetical protein Get druggable targets OG5_127431 All targets in OG5_127431
Schistosoma mansoni ubiquitin-specific peptidase 8 (C19 family) Get druggable targets OG5_127431 All targets in OG5_127431
Echinococcus multilocularis neuropeptide s receptor Get druggable targets OG5_136011 All targets in OG5_136011
Cryptosporidium hominis ubiquitin specific protease 66 Get druggable targets OG5_127431 All targets in OG5_127431
Schistosoma japonicum IPR015063,Domain of unknown function DUF1873,domain-containing Get druggable targets OG5_127431 All targets in OG5_127431
Cryptosporidium parvum ubiquitin C-terminal hydrolase of the cysteine proteinase fold Get druggable targets OG5_127431 All targets in OG5_127431
Schistosoma japonicum Ubiquitin carboxyl-terminal hydrolase 8, putative Get druggable targets OG5_127431 All targets in OG5_127431
Trypanosoma congolense ubiquitin carboxyl-terminal hydrolase, putative Get druggable targets OG5_127431 All targets in OG5_127431
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase Get druggable targets OG5_127431 All targets in OG5_127431
Trypanosoma brucei gambiense ubiquitin carboxyl-terminal hydrolase, putative,cysteine peptidase, Clan CA, family C19, putative Get druggable targets OG5_127431 All targets in OG5_127431
Trypanosoma cruzi ubiquitin carboxyl-terminal hydrolase, putative Get druggable targets OG5_127431 All targets in OG5_127431
Echinococcus granulosus dnaJ subfamily B Get druggable targets OG5_133913 All targets in OG5_133913
Echinococcus granulosus ubiquitin specific protease 41 Get druggable targets OG5_127431 All targets in OG5_127431
Leishmania braziliensis ubiquitin hydrolase, putative,cysteine peptidase, Clan CA, family C19, putative Get druggable targets OG5_127431 All targets in OG5_127431
Echinococcus multilocularis ubiquitin specific protease 41 Get druggable targets OG5_127431 All targets in OG5_127431
Echinococcus granulosus ubiquitin carboxyl terminal hydrolase 8 Get druggable targets OG5_127431 All targets in OG5_127431
Trichomonas vaginalis conserved hypothetical protein Get druggable targets OG5_129328 All targets in OG5_129328
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase Get druggable targets OG5_127431 All targets in OG5_127431
Loa Loa (eye worm) follicle stimulating hormone receptor Get druggable targets OG5_130089 All targets in OG5_130089
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_129328 All targets in OG5_129328
Entamoeba histolytica ubiquitin carboxyl-terminal hydrolase domain containing protein Get druggable targets OG5_127431 All targets in OG5_127431
Schistosoma japonicum expressed protein Get druggable targets OG5_127431 All targets in OG5_127431
Echinococcus multilocularis Peptidase C19, ubiquitin carboxyl terminal hydrolase 2 Get druggable targets OG5_127431 All targets in OG5_127431
Leishmania infantum ubiquitin hydrolase, putative,cysteine peptidase, Clan CA, family C19, putative Get druggable targets OG5_127431 All targets in OG5_127431
Leishmania mexicana ubiquitin hydrolase, putative,cysteine peptidase, Clan CA, family C19, putative Get druggable targets OG5_127431 All targets in OG5_127431
Schistosoma japonicum ko:K09188 myeloid/lymphoid or mixed-lineage leukemia protein 3, putative Get druggable targets OG5_130642 All targets in OG5_130642
Echinococcus granulosus Peptidase C19 ubiquitin carboxyl terminal hydrolase 2 Get druggable targets OG5_127431 All targets in OG5_127431
Schistosoma japonicum hypothetical protein Get druggable targets OG5_127431 All targets in OG5_127431
Brugia malayi Voltage-gated calcium channel, T-type, alpha subunit. C. elegans cca-1 ortholog Get druggable targets OG5_129328 All targets in OG5_129328
Echinococcus multilocularis ubiquitin carboxyl terminal hydrolase 8 Get druggable targets OG5_127431 All targets in OG5_127431
Echinococcus multilocularis neuropeptide receptor A26 Get druggable targets OG5_136011 All targets in OG5_136011
Leishmania major ubiquitin hydrolase, putative,cysteine peptidase, Clan CA, family C19, putative Get druggable targets OG5_127431 All targets in OG5_127431
Schistosoma japonicum IPR000276,Rhodopsin-like GPCR superfamily,domain-containing Get druggable targets OG5_136011 All targets in OG5_136011
Echinococcus multilocularis dnaJ subfamily B Get druggable targets OG5_133913 All targets in OG5_133913
Schistosoma mansoni ubiquitin-specific peptidase 2 (C19 family) Get druggable targets OG5_127431 All targets in OG5_127431
Trypanosoma cruzi ubiquitin carboxyl-terminal hydrolase, putative Get druggable targets OG5_127431 All targets in OG5_127431
Schistosoma mansoni mixed-lineage leukemia protein mll Get druggable targets OG5_130642 All targets in OG5_130642
Schistosoma japonicum ko:K01072 ubiquitin thiolesterase [EC3.1.2.15], putative Get druggable targets OG5_127431 All targets in OG5_127431

By sequence similarity to non orthologous known druggable targets
Species Potential target Known druggable target Length Alignment span Identity
Plasmodium falciparum ubiquitin specific protease, putative ubiquitin specific peptidase 2 362 aa 378 aa 25.7 %
Mycobacterium tuberculosis Hypothetical protein Nonstructural protein 1   230 aa 202 aa 23.8 %
Loa Loa (eye worm) pigment dispersing factor receptor c glucagon-like peptide 1 receptor 463 aa 388 aa 25.8 %
Echinococcus granulosus arachidonate 5 lipoxygenase arachidonate 15-lipoxygenase 662 aa 590 aa 23.9 %

Obtained from network model

Ranking Plot


Putative Targets List


Species Potential target Raw Global Species
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0009 0.004 0.0045
Brugia malayi Protein-tyrosine phosphatase containing protein 0.0028 0.0313 0.0518
Trichomonas vaginalis conserved hypothetical protein 0.0008 0.0029 0.003
Loa Loa (eye worm) hypothetical protein 0.0028 0.0313 0.0351
Schistosoma mansoni cpg binding protein 0.0035 0.0417 0.0467
Trypanosoma cruzi glycerol-3-phosphate dehydrogenase, putative 0.0052 0.0667 1
Loa Loa (eye worm) dual specificity protein phosphatase CDC14B 0.0028 0.0313 0.0351
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.006 0.0786 0.1299
Echinococcus multilocularis cadherin EGF LAG seven pass G type receptor 0.0019 0.0191 0.0238
Onchocerca volvulus 0.0028 0.0313 0.4696
Trypanosoma cruzi L-2-hydroxyglutarate dehydrogenase, mitochondrial, putative 0.0052 0.0667 1
Brugia malayi Ubiquitin carboxyl-terminal hydrolase family protein 0.0045 0.0561 0.0927
Echinococcus granulosus receptor type tyrosine protein phosphatase 0.0028 0.0313 0.0313
Echinococcus multilocularis receptor type tyrosine protein phosphatase zeta 0.0028 0.0313 0.039
Loa Loa (eye worm) protein-tyrosine phosphatase 0.0028 0.0313 0.0351
Trichomonas vaginalis conserved hypothetical protein 0.0008 0.0029 0.003
Brugia malayi follicle stimulating hormone receptor 0.0283 0.4002 0.6615
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase 0.0045 0.0561 0.0581
Brugia malayi protein-tyrosine phosphatase Lar-like precursor, putative 0.0028 0.0313 0.0518
Echinococcus granulosus tyrosine protein phosphatase non receptor type 0.0158 0.2199 0.2199
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.0019 0.0191 0.0238
Trichomonas vaginalis conserved hypothetical protein 0.0008 0.0029 0.003
Loa Loa (eye worm) hypothetical protein 0.0052 0.0667 0.0747
Brugia malayi Protein-tyrosine phosphatase containing protein 0.0028 0.0313 0.0518
Entamoeba histolytica anaerobic glycerol-3-phosphate dehydrogenase subunit A, putative 0.0052 0.0667 0.0379
Echinococcus multilocularis tyrosine protein phosphatase non receptor type 0.0158 0.2199 0.2742
Schistosoma mansoni hypothetical protein 0.0494 0.7058 0.7904
Trichomonas vaginalis conserved hypothetical protein 0.0208 0.2928 0.3034
Loa Loa (eye worm) protein-tyrosine phosphatase 0.0028 0.0313 0.0351
Loa Loa (eye worm) protein-tyrosine phosphatase 0.0028 0.0313 0.0351
Brugia malayi CXXC zinc finger family protein 0.0035 0.0417 0.0689
Loa Loa (eye worm) hypothetical protein 0.0028 0.0313 0.0351
Echinococcus granulosus tyrosine protein phosphatase non receptor type 0.0158 0.2199 0.2199
Brugia malayi Protein-tyrosine phosphatase containing protein 0.0028 0.0313 0.0518
Loa Loa (eye worm) hypothetical protein 0.0019 0.0191 0.0214
Echinococcus granulosus Receptor type tyrosine protein phosphatase O 0.0028 0.0313 0.0313
Echinococcus multilocularis dnaJ subfamily B 0.0494 0.7058 0.8802
Echinococcus multilocularis ubiquitin carboxyl terminal hydrolase 8 0.0045 0.0561 0.07
Loa Loa (eye worm) glycerol-3-phosphate dehydrogenase 0.0052 0.0667 0.0747
Schistosoma mansoni hypothetical protein 0.0024 0.026 0.0291
Schistosoma mansoni receptor tyrosine phosphatase type r2a 0.0028 0.0313 0.0351
Trypanosoma brucei FAD dependent oxidoreductase, putative 0.0052 0.0667 1
Trichomonas vaginalis conserved hypothetical protein 0.0008 0.0029 0.003
Loa Loa (eye worm) hypothetical protein 0.0028 0.0313 0.0351
Echinococcus granulosus receptor type tyrosine protein phosphatase 0.0028 0.0313 0.0313
Trypanosoma cruzi ubiquitin carboxyl-terminal hydrolase, putative 0.0045 0.0561 0.8415
Onchocerca volvulus 0.0028 0.0313 0.4696
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0008 0.0029 0.003
Loa Loa (eye worm) hypothetical protein 0.0041 0.051 0.0571
Brugia malayi latrophilin 2 splice variant baaae 0.0041 0.051 0.0844
Loa Loa (eye worm) hypothetical protein 0.0623 0.893 1
Echinococcus granulosus ubiquitin carboxyl terminal hydrolase 8 0.0045 0.0561 0.0561
Echinococcus multilocularis ubiquitin specific protease 41 0.0045 0.0561 0.07
Giardia lamblia Glycerol-3-phosphate dehydrogenase 0.0052 0.0667 1
Mycobacterium leprae PROBABLE D-AMINO ACID OXIDASE AAO 0.0623 0.893 1
Schistosoma mansoni cpg binding protein 0.0037 0.0445 0.0499
Brugia malayi Calcitonin receptor-like protein seb-1 0.006 0.0786 0.1299
Loa Loa (eye worm) hypothetical protein 0.0024 0.026 0.0291
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0008 0.0029 0.003
Loa Loa (eye worm) protein-tyrosine phosphatase 0.0028 0.0313 0.0351
Schistosoma mansoni receptor tyrosine phosphatase type r2a 0.0028 0.0313 0.0351
Loa Loa (eye worm) hypothetical protein 0.0028 0.0313 0.0351
Trypanosoma cruzi Present in the outer mitochondrial membrane proteome 20 0.0052 0.0667 1
Echinococcus granulosus tyrosine protein phosphatase non receptor type 0.0028 0.0313 0.0313
Brugia malayi pyruvate dehydrogenase phosphatase regulatory subunit precursor 0.0052 0.0667 0.1102
Loa Loa (eye worm) hypothetical protein 0.0028 0.0313 0.0351
Loa Loa (eye worm) protein-tyrosine-phosphatase 0.0028 0.0313 0.0351
Onchocerca volvulus 0.0028 0.0313 0.4696
Brugia malayi Protein-tyrosine phosphatase containing protein 0.0028 0.0313 0.0518
Loa Loa (eye worm) protein-tyrosine phosphatase 0.0028 0.0313 0.0351
Loa Loa (eye worm) protein-tyrosine phosphatase 1 0.0028 0.0313 0.0351
Schistosoma mansoni ATP:guanidino kinase (Smc74) 0.0052 0.0667 0.0747
Loa Loa (eye worm) hypothetical protein 0.0028 0.0313 0.0351
Echinococcus multilocularis arachidonate 5 lipoxygenase 0.0067 0.0879 0.1097
Onchocerca volvulus 0.0028 0.0313 0.4696
Loa Loa (eye worm) doublecortin family protein 0.0024 0.026 0.0291
Trichomonas vaginalis conserved hypothetical protein 0.0008 0.0029 0.003
Brugia malayi Protein-tyrosine phosphatase containing protein 0.0028 0.0313 0.0518
Loa Loa (eye worm) hypothetical protein 0.0052 0.0667 0.0747
Echinococcus multilocularis cpg binding protein 0.0037 0.0445 0.0555
Echinococcus multilocularis neuropeptide receptor A26 0.056 0.8019 1
Echinococcus multilocularis lipoxygenase domain containing protein 0.0024 0.026 0.0324
Brugia malayi Protein-tyrosine phosphatase containing protein 0.0028 0.0313 0.0518
Leishmania major protein-tyrosine phosphatase 1-like protein 0.0028 0.0313 0.4696
Echinococcus granulosus cadherin EGF LAG seven pass G type receptor 0.0019 0.0191 0.0191
Schistosoma mansoni protein tyrosine phosphatase 0.0028 0.0313 0.0351
Echinococcus granulosus FAD dependent oxidoreductase domain containing protein 0.0052 0.0667 0.0667
Loa Loa (eye worm) hypothetical protein 0.0028 0.0313 0.0351
Loa Loa (eye worm) hypothetical protein 0.0028 0.0313 0.0351
Schistosoma mansoni fad oxidoreductase 0.0052 0.0667 0.0747
Loa Loa (eye worm) hypothetical protein 0.0028 0.0313 0.0351
Onchocerca volvulus 0.0028 0.0313 0.4696
Onchocerca volvulus 0.0028 0.0313 0.4696
Schistosoma mansoni pcd6 interacting protein-related 0.0028 0.0313 0.0351
Echinococcus multilocularis tyrosine protein phosphatase non receptor type 0.0028 0.0313 0.039
Echinococcus granulosus receptor type tyrosine protein phosphatase zeta 0.0028 0.0313 0.0313
Onchocerca volvulus 0.0028 0.0313 0.4696
Onchocerca volvulus 0.0028 0.0313 0.4696
Trichomonas vaginalis pps1 dual specificty phosphatase, putative 0.0673 0.965 1
Loa Loa (eye worm) protein-tyrosine phosphatase 0.0028 0.0313 0.0351
Echinococcus granulosus Polycystic kidney disease protein 0.0024 0.026 0.026
Echinococcus multilocularis tyrosine protein phosphatase non receptor type 0.0158 0.2199 0.2742
Echinococcus granulosus receptor type tyrosine protein phosphatase zeta 0.0028 0.0313 0.0313
Schistosoma mansoni receptor tyrosine phosphatase type r2a 0.0028 0.0313 0.0351
Echinococcus granulosus neuropeptide receptor A26 0.056 0.8019 0.8019
Loa Loa (eye worm) hypothetical protein 0.0028 0.0313 0.0351
Loa Loa (eye worm) hypothetical protein 0.0028 0.0313 0.0351
Leishmania major hypothetical protein, conserved 0.0052 0.0667 1
Echinococcus granulosus GPCR family 2 0.0019 0.0191 0.0191
Toxoplasma gondii FAD-dependent glycerol-3-phosphate dehydrogenase 0.0052 0.0667 0.7704
Echinococcus granulosus cpg binding protein 0.0037 0.0445 0.0445
Brugia malayi Protein-tyrosine phosphatase containing protein 0.0424 0.6049 1
Echinococcus multilocularis Polycystic kidney disease protein 0.0024 0.026 0.0324
Echinococcus multilocularis neuropeptide s receptor 0.056 0.8019 1
Loa Loa (eye worm) hypothetical protein 0.0028 0.0313 0.0351
Echinococcus multilocularis receptor type tyrosine protein phosphatase protein tyrosine phosphatase receptor type 0.0028 0.0313 0.039
Trypanosoma brucei electron transfer flavoprotein-ubiquinone oxidoreductase, putative 0.0052 0.0667 1
Schistosoma mansoni glycerol-3-phosphate dehydrogenase 0.0052 0.0667 0.0747
Echinococcus multilocularis receptor type tyrosine protein phosphatase 0.0028 0.0313 0.039
Onchocerca volvulus 0.0028 0.0313 0.4696
Loa Loa (eye worm) hypothetical protein 0.0028 0.0313 0.0351
Echinococcus multilocularis receptor type tyrosine protein phosphatase zeta 0.0028 0.0313 0.039
Echinococcus multilocularis Receptor type tyrosine protein phosphatase O 0.0028 0.0313 0.039
Echinococcus multilocularis Receptor type tyrosine protein phosphatase O 0.0028 0.0313 0.039
Onchocerca volvulus 0.0028 0.0313 0.4696
Echinococcus granulosus lipoxygenase domain containing protein 0.0024 0.026 0.026
Echinococcus multilocularis RUN 0.0024 0.026 0.0324
Schistosoma mansoni receptor protein tyrosine phosphatase n (ia2) 0.0028 0.0313 0.0351
Schistosoma mansoni fad oxidoreductase 0.0052 0.0667 0.0747
Onchocerca volvulus 0.0028 0.0313 0.4696
Trypanosoma brucei glycerol-3-phosphate dehydrogenase (FAD-dependent), putative 0.0052 0.0667 1
Loa Loa (eye worm) hypothetical protein 0.0028 0.0313 0.0351
Schistosoma mansoni hypothetical protein 0.0019 0.0191 0.0214
Onchocerca volvulus 0.0028 0.0313 0.4696
Toxoplasma gondii histone lysine methyltransferase SET1 0.0066 0.0865 1
Trichomonas vaginalis pten, drome, putative 0.0028 0.0313 0.0324
Brugia malayi Protein-tyrosine phosphatase containing protein 0.0028 0.0313 0.0518
Loa Loa (eye worm) hypothetical protein 0.0028 0.0313 0.0351
Brugia malayi hypothetical protein 0.0028 0.0313 0.0518
Echinococcus multilocularis receptor type tyrosine protein phosphatase 0.0028 0.0313 0.039
Echinococcus multilocularis 0.0028 0.0313 0.039
Echinococcus multilocularis receptor type tyrosine protein phosphatase 0.0028 0.0313 0.039
Brugia malayi Protein-tyrosine phosphatase containing protein 0.0028 0.0313 0.0518
Loa Loa (eye worm) fibronectin type III domain-containing protein 0.0028 0.0313 0.0351
Echinococcus multilocularis lipoxygenase domain containing protein 0.0024 0.026 0.0324
Echinococcus multilocularis histone lysine N methyltransferase MLL3 0.0011 0.007 0.0088
Loa Loa (eye worm) hypothetical protein 0.0214 0.3013 0.3374
Brugia malayi Protein-tyrosine phosphatase containing protein 0.0028 0.0313 0.0518
Onchocerca volvulus 4.1 G protein, putative homolog 0.0028 0.0313 0.4696
Onchocerca volvulus 0.0028 0.0313 0.4696
Brugia malayi hypothetical protein 0.0024 0.026 0.0429
Trypanosoma cruzi tyrosine specific protein phosphatase, putative 0.0028 0.0313 0.4696
Schistosoma mansoni rab6-interacting 0.0024 0.026 0.0291
Echinococcus multilocularis hypothetical protein 0.0028 0.0313 0.039
Brugia malayi Latrophilin receptor protein 2 0.0019 0.0191 0.0315
Loa Loa (eye worm) protein-tyrosine phosphatase 0.0028 0.0313 0.0351
Brugia malayi F/Y-rich N-terminus family protein 0.0011 0.0068 0.0113
Brugia malayi Protein-tyrosine phosphatase containing protein 0.0028 0.0313 0.0518
Loa Loa (eye worm) hypothetical protein 0.0028 0.0313 0.0351
Plasmodium vivax FAD-dependent glycerol-3-phosphate dehydrogenase, putative 0.0052 0.0667 1
Brugia malayi Protein-tyrosine phosphatase 0.0028 0.0313 0.0518
Echinococcus multilocularis FAD dependent oxidoreductase domain containing protein 0.0052 0.0667 0.0831
Brugia malayi RE18450p 0.0052 0.0667 0.1102
Trichomonas vaginalis conserved hypothetical protein 0.0008 0.0029 0.003
Brugia malayi Dual specificity protein phosphatase CDC14B 0.0028 0.0313 0.0518
Brugia malayi dimethylglycine dehydrogenase, mitochondrial precursor, putative 0.0052 0.0667 0.1102
Onchocerca volvulus 0.0028 0.0313 0.4696
Brugia malayi Doublecortin family protein 0.0024 0.026 0.0429
Schistosoma mansoni lipoxygenase 0.0067 0.0879 0.0985
Loa Loa (eye worm) hypothetical protein 0.0028 0.0313 0.0351
Onchocerca volvulus 0.0028 0.0313 0.4696
Schistosoma mansoni protein-tyrosine phosphatase non-receptor type nt5 0.0028 0.0313 0.0351
Brugia malayi Protein-tyrosine phosphatase 1 0.0028 0.0313 0.0518
Brugia malayi Protein-tyrosine phosphatase containing protein 0.0028 0.0313 0.0518
Onchocerca volvulus 0.0028 0.0313 0.4696
Onchocerca volvulus Putative fad oxidoreductase 0.0052 0.0667 1
Trypanosoma brucei L-2-hydroxyglutarate dehydrogenase, mitochondrial, putative 0.0052 0.0667 1
Entamoeba histolytica dual specificity protein phosphatase, putative 0.0673 0.965 1
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0074 0.0979 0.1096
Brugia malayi Protein-tyrosine phosphatase containing protein 0.0028 0.0313 0.0518
Schistosoma mansoni loxhd1 0.0024 0.026 0.0291
Echinococcus multilocularis Receptor type tyrosine protein phosphatase O 0.0028 0.0313 0.039
Loa Loa (eye worm) hypothetical protein 0.0028 0.0313 0.0351
Echinococcus granulosus receptor type tyrosine protein phosphatase 0.0028 0.0313 0.0313
Echinococcus granulosus lipoxygenase domain containing protein 0.0024 0.026 0.026
Echinococcus multilocularis receptor type tyrosine protein phosphatase 0.0028 0.0313 0.039
Brugia malayi hypothetical protein 0.0028 0.0313 0.0518
Schistosoma mansoni protein tyrosine phosphatase non-receptor type nt1 0.0424 0.6049 0.6773
Trichomonas vaginalis conserved hypothetical protein 0.0008 0.0029 0.003
Brugia malayi Protein-tyrosine phosphatase containing protein 0.0028 0.0313 0.0518
Trypanosoma cruzi glycerol-3-phosphate dehydrogenase (FAD-dependent), putative 0.0052 0.0667 1
Trichomonas vaginalis conserved hypothetical protein 0.0008 0.0029 0.003
Echinococcus granulosus tyrosine protein phosphatase non receptor type 0.0028 0.0313 0.0313
Echinococcus granulosus tyrosine protein phosphatase non receptor type 0.0424 0.6049 0.6049
Schistosoma mansoni receptor protein tyrosine phosphatase n (ia2) 0.0028 0.0313 0.0351
Onchocerca volvulus 0.0028 0.0313 0.4696
Schistosoma mansoni receptor protein tyrosine phosphatase 0.0028 0.0313 0.0351
Echinococcus granulosus histone lysine N methyltransferase MLL3 0.0009 0.004 0.004
Trypanosoma cruzi tyrosine specific protein phosphatase, putative 0.0028 0.0313 0.4696
Onchocerca volvulus 0.0028 0.0313 0.4696
Leishmania major glycerol-3-phosphate dehydrogenase-like protein 0.0052 0.0667 1
Echinococcus granulosus tyrosine protein phosphatase non receptor type 0.0028 0.0313 0.0313
Loa Loa (eye worm) hypothetical protein 0.0024 0.026 0.0291
Trichomonas vaginalis chromodomain-helicase-DNA-binding protein, putative 0.0008 0.0029 0.003
Loa Loa (eye worm) hypothetical protein 0.0028 0.0313 0.0351
Onchocerca volvulus 0.0028 0.0313 0.4696
Echinococcus granulosus receptor type tyrosine protein phosphatase 0.0028 0.0313 0.0313
Echinococcus granulosus dnaJ subfamily B 0.0494 0.7058 0.7058
Brugia malayi Protein-tyrosine phosphatase containing protein 0.0158 0.2199 0.3635
Schistosoma mansoni hypothetical protein 0.0019 0.0191 0.0214
Brugia malayi Protein-tyrosine phosphatase 0.0028 0.0313 0.0518
Echinococcus granulosus arachidonate 5 lipoxygenase 0.0067 0.0879 0.0879
Loa Loa (eye worm) hypothetical protein 0.0028 0.0313 0.0351
Schistosoma mansoni receptor tyrosine phosphatase type r2a 0.0028 0.0313 0.0351
Loa Loa (eye worm) hypothetical protein 0.0028 0.0313 0.0351
Brugia malayi cDNA sequence BC016226 0.0052 0.0667 0.1102
Entamoeba histolytica ubiquitin carboxyl-terminal hydrolase domain containing protein 0.0045 0.0561 0.0266
Schistosoma mansoni protein tyrosine phosphatase 0.0028 0.0313 0.0351
Echinococcus granulosus receptor type tyrosine protein phosphatase 0.0028 0.0313 0.0313
Trypanosoma brucei ubiquitin carboxyl-terminal hydrolase, putative 0.0045 0.0561 0.8415
Chlamydia trachomatis D-amino acid dehydrogenase 0.0052 0.0667 0.5
Schistosoma mansoni protein tyrosine phosphatase 0.0028 0.0313 0.0351
Giardia lamblia Ubiquitin carboxyl-terminal hydrolase 4 0.0045 0.0561 0.7012
Loa Loa (eye worm) protein-tyrosine phosphatase 0.0028 0.0313 0.0351
Onchocerca volvulus 0.0028 0.0313 0.4696
Loa Loa (eye worm) pigment dispersing factor receptor c 0.006 0.0786 0.088
Echinococcus multilocularis receptor type tyrosine protein phosphatase F 0.0028 0.0313 0.039
Echinococcus granulosus mixed lineage leukemia protein mll 0.0009 0.004 0.004
Loa Loa (eye worm) hypothetical protein 0.0028 0.0313 0.0351
Echinococcus multilocularis Receptor type tyrosine protein phosphatase O 0.0028 0.0313 0.039
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.0019 0.0191 0.0191
Brugia malayi Protein-tyrosine phosphatase containing protein 0.0028 0.0313 0.0518
Loa Loa (eye worm) protein-tyrosine phosphatase 0.0028 0.0313 0.0351
Schistosoma mansoni protein-tyrosine phosphatase n9 0.0028 0.0313 0.0351
Toxoplasma gondii hypothetical protein 0.0052 0.0667 0.7704
Schistosoma mansoni protein tyrosine phosphatase n11 (shp2) 0.0158 0.2199 0.2462
Echinococcus granulosus receptor type tyrosine protein phosphatase 0.0028 0.0313 0.0313
Onchocerca volvulus 0.0028 0.0313 0.4696
Schistosoma mansoni lipoxygenase 0.0024 0.026 0.0291
Onchocerca volvulus 0.0024 0.026 0.3893
Mycobacterium tuberculosis Probable D-amino acid oxidase Aao 0.0571 0.8179 1
Loa Loa (eye worm) hypothetical protein 0.0045 0.0561 0.0628
Schistosoma mansoni NAD dehydrogenase 0.0052 0.0667 0.0747
Echinococcus multilocularis tyrosine protein phosphatase non receptor type 0.0028 0.0313 0.039
Schistosoma mansoni polycystin 1-related 0.0024 0.026 0.0291
Trypanosoma cruzi ubiquitin carboxyl-terminal hydrolase, putative 0.0045 0.0561 0.8415
Schistosoma mansoni receptor tyrosine phosphatase type r2a 0.0028 0.0313 0.0351
Echinococcus multilocularis tyrosine protein phosphatase non receptor type 0.0424 0.6049 0.7544
Trypanosoma cruzi L-2-hydroxyglutarate dehydrogenase, mitochondrial, putative 0.0052 0.0667 1
Loa Loa (eye worm) histone methyltransferase 0.0011 0.007 0.0079
Brugia malayi Voltage-gated calcium channel, T-type, alpha subunit. C. elegans cca-1 ortholog 0.0214 0.3013 0.4981
Schistosoma mansoni d-amino acid oxidase 0.0623 0.893 1
Brugia malayi Protein-tyrosine phosphatase containing protein 0.0028 0.0313 0.0518
Schistosoma mansoni receptor protein tyrosine phosphatase r (pcptp1) 0.0028 0.0313 0.0351
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0008 0.0029 0.003
Trichomonas vaginalis conserved hypothetical protein 0.0045 0.0561 0.0581
Schistosoma mansoni rgs-gaip interacting protein gipc 0.0028 0.0313 0.0351
Leishmania major hypothetical protein, conserved 0.0052 0.0667 1
Echinococcus multilocularis GPCR, family 2 0.0019 0.0191 0.0238
Brugia malayi hypothetical protein 0.0024 0.026 0.0429
Onchocerca volvulus 0.0028 0.0313 0.4696
Loa Loa (eye worm) hypothetical protein 0.0028 0.0313 0.0351
Echinococcus multilocularis receptor type tyrosine protein phosphatase 0.0028 0.0313 0.039
Brugia malayi hypothetical protein 0.0028 0.0313 0.0518
Loa Loa (eye worm) protein-tyrosine phosphatase 0.0028 0.0313 0.0351
Echinococcus multilocularis histone lysine N methyltransferase MLL3 0.0009 0.004 0.005
Trichomonas vaginalis conserved hypothetical protein 0.0008 0.0029 0.003
Onchocerca volvulus Dimethylglycine dehydrogenase, mitochondrial homolog 0.0052 0.0667 1
Trichomonas vaginalis helicase, putative 0.0008 0.0029 0.003
Brugia malayi Protein-tyrosine phosphatase containing protein 0.0028 0.0313 0.0518
Loa Loa (eye worm) protein-tyrosine phosphatase 0.0424 0.6049 0.6773
Entamoeba histolytica NAD(FAD)-dependent dehydrogenase, putative 0.0052 0.0667 0.0379
Schistosoma mansoni hypothetical protein 0.0019 0.0191 0.0214
Brugia malayi Protein-tyrosine phosphatase containing protein 0.0028 0.0313 0.0518
Echinococcus granulosus glycerol 3 phosphate dehydrogenase 0.0052 0.0667 0.0667
Echinococcus granulosus receptor type tyrosine protein phosphatase 0.0028 0.0313 0.0313
Trichomonas vaginalis chromodomain-helicase-DNA-binding protein, putative 0.0008 0.0029 0.003
Onchocerca volvulus 0.0024 0.026 0.3893
Schistosoma mansoni hypothetical protein 0.0041 0.051 0.0571
Leishmania major tyrosine specific protein phosphatase, putative 0.0028 0.0313 0.4696
Loa Loa (eye worm) hypothetical protein 0.0028 0.0313 0.0351
Onchocerca volvulus 0.0035 0.0417 0.6251
Loa Loa (eye worm) latrophilin receptor protein 2 0.0019 0.0191 0.0214
Trypanosoma brucei glycerol-3-phosphate dehydrogenase (FAD-dependent), mitochondrial 0.0052 0.0667 1
Echinococcus granulosus histone lysine N methyltransferase MLL3 0.0011 0.007 0.007
Loa Loa (eye worm) CXXC zinc finger family protein 0.0035 0.0417 0.0467
Trypanosoma cruzi FAD dependent oxidoreductase, putative 0.0052 0.0667 1
Echinococcus multilocularis Peptidase C19, ubiquitin carboxyl terminal hydrolase 2 0.0045 0.0561 0.07
Leishmania major ubiquitin hydrolase, putative,cysteine peptidase, Clan CA, family C19, putative 0.0045 0.0561 0.8415
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.0019 0.0191 0.0315
Loa Loa (eye worm) hypothetical protein 0.0028 0.0313 0.0351
Brugia malayi hypothetical protein 0.0028 0.0313 0.0518
Echinococcus granulosus neuropeptide s receptor 0.056 0.8019 0.8019
Loa Loa (eye worm) hypothetical protein 0.0052 0.0667 0.0747
Brugia malayi Protein-tyrosine phosphatase containing protein 0.0028 0.0313 0.0518
Echinococcus multilocularis mixed lineage leukemia protein mll 0.0009 0.004 0.005
Echinococcus granulosus Peptidase C19 ubiquitin carboxyl terminal hydrolase 2 0.0045 0.0561 0.0561
Echinococcus granulosus protein tyrosine phosphatase n9 0.0028 0.0313 0.0313
Onchocerca volvulus Pyruvate dehydrogenase phosphatase regulatory subunit, mitochondrial homolog 0.0052 0.0667 1
Echinococcus multilocularis receptor type tyrosine protein phosphatase 0.0028 0.0313 0.039
Mycobacterium ulcerans D-amino acid oxidase Aao 0.0623 0.893 1
Echinococcus granulosus receptor type tyrosine protein phosphatase 0.0028 0.0313 0.0313
Loa Loa (eye worm) protein-tyrosine phosphatase 0.0028 0.0313 0.0351
Loa Loa (eye worm) hypothetical protein 0.0028 0.0313 0.0351
Brugia malayi Protein-tyrosine phosphatase containing protein 0.0028 0.0313 0.0518
Onchocerca volvulus 0.0028 0.0313 0.4696
Echinococcus granulosus ubiquitin specific protease 41 0.0045 0.0561 0.0561
Schistosoma mansoni ubiquitin-specific peptidase 8 (C19 family) 0.0045 0.0561 0.0628
Brugia malayi Protein-tyrosine phosphatase containing protein 0.0028 0.0313 0.0518
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0008 0.0029 0.003
Trypanosoma cruzi glycerol-3-phosphate dehydrogenase (FAD-dependent), putative 0.0052 0.0667 1
Echinococcus multilocularis protein tyrosine phosphatase n9 0.0028 0.0313 0.039
Schistosoma mansoni non-receptor protein-tyrosine phosphatase 0.0028 0.0313 0.0351
Loa Loa (eye worm) hypothetical protein 0.006 0.0786 0.088
Brugia malayi hypothetical protein 0.0028 0.0313 0.0518
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0008 0.0029 0.003
Echinococcus multilocularis glycerol 3 phosphate dehydrogenase 0.0052 0.0667 0.0831
Echinococcus granulosus RUN 0.0024 0.026 0.026
Echinococcus multilocularis receptor type tyrosine protein phosphatase H 0.0028 0.0313 0.039
Loa Loa (eye worm) protein-tyrosine phosphatase 0.0028 0.0313 0.0351
Loa Loa (eye worm) protein-tyrosine phosphatase 0.0028 0.0313 0.0351
Loa Loa (eye worm) protein tyrosine phosphatase 0.0028 0.0313 0.0351
Plasmodium falciparum FAD-dependent glycerol-3-phosphate dehydrogenase, putative 0.0052 0.0667 1
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0008 0.0029 0.003
Schistosoma mansoni hypothetical protein 0.0019 0.0191 0.0214
Trypanosoma cruzi tyrosine specific protein phosphatase, putative 0.0028 0.0313 0.4696
Schistosoma mansoni cpg binding protein 0.0037 0.0445 0.0499
Brugia malayi Protein-tyrosine phosphatase containing protein 0.0028 0.0313 0.0518
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase 0.0045 0.0561 0.0581
Loa Loa (eye worm) protein-tyrosine phosphatase 0.0158 0.2199 0.2462
Trypanosoma brucei protein tyrosine phosphatase 1 0.0028 0.0313 0.4696
Schistosoma mansoni rab6-interacting 0.0024 0.026 0.0291
Echinococcus multilocularis receptor type tyrosine protein phosphatase protein tyrosine phosphatase receptor type 0.0028 0.0313 0.039
Loa Loa (eye worm) follicle stimulating hormone receptor 0.0283 0.4002 0.4481
Schistosoma mansoni ubiquitin-specific peptidase 2 (C19 family) 0.0045 0.0561 0.0628

Activities

Activity type Activity value Assay description Source Reference
EC50 (functional) 0.728 uM PUBCHEM_BIOASSAY: Inhibitors of T-Type Calcium Channel. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID449739, AID463087, AID493021, AID493022, AID493023, AID493041, AID504579, AID504584, AID504619, AID504628] ChEMBL. No reference
Potency (functional) = 0.631 um PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Ubiquitin-specific Protease USP2a. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) = 0.7079 um PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors Targeting the Menin-MLL Interaction in MLL Related Leukemias: Competition With Fluorescein Labeled MLL-derived Peptide. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) = 0.7943 um PUBCHEM_BIOASSAY: qHTS Assay for Agonists of the Thyroid Stimulating Hormone Receptor. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) = 0.7943 um PUBCHEM_BIOASSAY: qHTS Assay for Agonists of the Thyroid Stimulating Hormone Receptor: Activators of Intracellular cAMP Concentrations in Parental HEK 293. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) = 1.5849 um PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of 15-hLO (15-human lipoxygenase). (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 5.0119 uM PubChem BioAssay. qHTS of GLP-1 Receptor Inverse Agonists (Inhibition Mode). (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) = 10 um PUBCHEM_BIOASSAY: qHTS Assay for Antagonists of the Neuropeptide S Receptor: cAMP Signal Transduction. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 10.4179 uM PUBCHEM_BIOASSAY: Primary qHTS for delayed death inhibitors of the malarial parasite plastid, 48 hour incubation. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488752, AID488774, AID504848, AID504850] ChEMBL. No reference
Potency (functional) 11.6891 uM PUBCHEM_BIOASSAY: Primary qHTS for delayed death inhibitors of the malarial parasite plastid, 96 hour incubation. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488745, AID488752, AID488774, AID504848, AID504850] ChEMBL. No reference
Potency (functional) = 19.9526 um PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Influenza NS1 Protein Function. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 25.1189 uM PubChem BioAssay. A quantitative high throughput screen for small molecules that induce DNA re-replication in MCF 10a normal breast cells. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 31.6228 uM PUBCHEM_BIOASSAY: qHTS for Inhibitors of binding or entry into cells for Lassa Virus. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID463114, AID540249] ChEMBL. No reference
Potency (functional) 35.4813 uM PUBCHEM_BIOASSAY: Nrf2 qHTS screen for inhibitors. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID493153, AID493163, AID504648] ChEMBL. No reference

Phenotypes

Whole-cell/tissue/organism interactions

Species name Source Reference Is orphan
Plasmodium falciparum ChEMBL23

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

Annotated phenotypes:

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

External resources for this compound

Bibliographic References

No literature references available for this target.

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