Detailed information for compound 1476042

Basic information

Technical information
  • TDR Targets ID: 1476042
  • Name: N-[2-(1-cyclohexenyl)ethyl]-1-[[2-(2-fluoroph enyl)-5-methyl-1,3-oxazol-4-yl]methyl]piperid ine-4-carboxamide
  • MW: 425.539 | Formula: C25H32FN3O2
  • H donors: 1 H acceptors: 2 LogP: 4.19 Rotable bonds: 8
    Rule of 5 violations (Lipinski): 1
  • SMILES: O=C(C1CCN(CC1)Cc1nc(oc1C)c1ccccc1F)NCCC1=CCCCC1
  • InChi: 1S/C25H32FN3O2/c1-18-23(28-25(31-18)21-9-5-6-10-22(21)26)17-29-15-12-20(13-16-29)24(30)27-14-11-19-7-3-2-4-8-19/h5-7,9-10,20H,2-4,8,11-17H2,1H3,(H,27,30)
  • InChiKey: AAFWGXZKDLGSEQ-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • N-[2-(1-cyclohexenyl)ethyl]-1-[[2-(2-fluorophenyl)-5-methyl-oxazol-4-yl]methyl]piperidine-4-carboxamide
  • N-[2-(1-cyclohexenyl)ethyl]-1-[[2-(2-fluorophenyl)-5-methyl-4-oxazolyl]methyl]-4-piperidinecarboxamide
  • N-[2-(1-cyclohexenyl)ethyl]-1-[[2-(2-fluorophenyl)-5-methyl-oxazol-4-yl]methyl]isonipecotamide
  • MLS000095215
  • N-(2-cyclohex-1-en-1-ylethyl)-1-{[2-(2-fluorophenyl)-5-methyl-1,3-oxazol-4-yl]methyl}piperidine-4-carboxamide
  • SMR000030769

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens ataxin 2 Starlite/ChEMBL No references
Homo sapiens multiple endocrine neoplasia I No references
Homo sapiens lysine (K)-specific methyltransferase 2A Starlite/ChEMBL No references

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Schistosoma mansoni hypothetical protein Get druggable targets OG5_133913 All targets in OG5_133913
Echinococcus granulosus dnaJ subfamily B Get druggable targets OG5_133913 All targets in OG5_133913
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
Echinococcus multilocularis dnaJ subfamily B Get druggable targets OG5_133913 All targets in OG5_133913
Schistosoma japonicum ko:K09188 myeloid/lymphoid or mixed-lineage leukemia protein 3, putative Get druggable targets OG5_130642 All targets in OG5_130642
Schistosoma mansoni mixed-lineage leukemia protein mll Get druggable targets OG5_130642 All targets in OG5_130642
By sequence similarity to non orthologous known druggable targets
No druggable targets predicted by sequence similarity
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Echinococcus multilocularis tyrosine protein kinase Fyn 0.0038 0.0403 0.0403
Brugia malayi nuclear hormone receptor 0.001 0.0044 0.0092
Schistosoma mansoni coup transcription factor 0.001 0.0044 0.007
Leishmania major hypothetical protein, conserved 0.0135 0.1639 1
Schistosoma mansoni TRABID protein (C64 family) 0.0135 0.1639 0.2627
Echinococcus multilocularis tyrosine protein kinase Fyn 0.0038 0.0403 0.0403
Trypanosoma cruzi Zn-finger in Ran binding protein and others/FYVE zinc finger, putative 0.0135 0.1639 1
Loa Loa (eye worm) hypothetical protein 0.001 0.0044 0.0092
Echinococcus granulosus tyrosine protein kinase Src42A 0.0038 0.0403 0.0403
Trypanosoma cruzi WLM domain containing protein, putative 0.0135 0.1639 1
Plasmodium falciparum SWIB/MDM2 domain-containing protein 0.0379 0.4766 1
Schistosoma mansoni cpg binding protein 0.0037 0.0382 0.0612
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0008 0.0013 0.0027
Entamoeba histolytica protein kinase, putative 0.0031 0.0306 1
Onchocerca volvulus 0.001 0.0044 0.0092
Echinococcus multilocularis tyrosine protein kinase lyn tyrosine protein kinase blk 0.0038 0.0403 0.0403
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0008 0.0013 0.0027
Schistosoma mansoni fusion 0.0135 0.1639 0.2627
Schistosoma mansoni growth factor receptor-bound protein 0.0008 0.0009 0.0014
Schistosoma mansoni cellular tumor antigen P53 0.0102 0.1217 0.1951
Giardia lamblia Hypothetical protein 0.0007 0 0.5
Echinococcus granulosus growth factor receptor bound protein 2 0.0008 0.0009 0.0009
Toxoplasma gondii LsmAD domain-containing protein 0.003 0.0302 0.0634
Leishmania major hypothetical protein, conserved 0.0135 0.1639 1
Echinococcus multilocularis histone lysine N methyltransferase MLL3 0.0009 0.0022 0.0022
Echinococcus granulosus NCK adaptor protein 0.0008 0.0009 0.0009
Onchocerca volvulus 0.0135 0.1639 0.3438
Brugia malayi Zn-finger in Ran binding protein and others containing protein 0.0135 0.1639 0.3438
Echinococcus granulosus histone lysine N methyltransferase MLL3 0.0011 0.005 0.005
Echinococcus multilocularis SWI:SNF matrix associated 0.0379 0.4766 0.4766
Echinococcus multilocularis Upstream activation factor subunit UAF30 0.0379 0.4766 0.4766
Echinococcus multilocularis tyrosine protein kinase Src42A 0.0033 0.0341 0.0341
Echinococcus multilocularis tyrosine protein kinase HCK 0.0031 0.0306 0.0306
Echinococcus granulosus COUP TF:Svp nuclear hormone receptor 0.001 0.0044 0.0044
Giardia lamblia E3 ubiquitin ligase for Rad6p required for the ubiquitination of histone H2B 0.0007 0 0.5
Giardia lamblia Ribonuclease 0.0007 0 0.5
Loa Loa (eye worm) histone methyltransferase 0.0011 0.005 0.0104
Brugia malayi Tyrosine-protein kinase abl-1 0.0009 0.0023 0.0048
Giardia lamblia Protein 21.1 0.0007 0 0.5
Echinococcus granulosus tyrosine protein kinase HCK 0.0031 0.0306 0.0306
Echinococcus multilocularis mixed lineage leukemia protein mll 0.0009 0.0022 0.0022
Giardia lamblia Protein 21.1 0.0007 0 0.5
Giardia lamblia Protein 21.1 0.0007 0 0.5
Trypanosoma brucei hypothetical protein, conserved 0.0135 0.1639 1
Giardia lamblia Kinase, NEK 0.0007 0 0.5
Loa Loa (eye worm) brahma associated protein 0.0379 0.4766 1
Brugia malayi Variant SH3 domain containing protein 0.0008 0.0009 0.0019
Echinococcus granulosus 3'partial|tyrosine protein kinase Fgr 0.0038 0.0403 0.0403
Schistosoma mansoni hypothetical protein 0.0379 0.4766 0.764
Brugia malayi F/Y-rich N-terminus family protein 0.0011 0.0048 0.01
Echinococcus granulosus tyrosine protein kinase Blk 0.0035 0.0355 0.0355
Giardia lamblia Hypothetical protein 0.0007 0 0.5
Echinococcus granulosus tyrosine kinase 0.0035 0.0355 0.0355
Brugia malayi Nuclear hormone receptor family member nhr-25 0.001 0.0044 0.0092
Echinococcus granulosus Upstream activation factor subunit UAF30 0.0379 0.4766 0.4766
Brugia malayi protein-tyrosine kinase 0.0035 0.0355 0.0745
Echinococcus multilocularis NCK adaptor protein 0.0008 0.0009 0.0009
Trichomonas vaginalis conserved hypothetical protein 0.0008 0.0013 0.0027
Onchocerca volvulus 0.0135 0.1639 0.3438
Schistosoma mansoni zinc finger protein 0.0135 0.1639 0.2627
Brugia malayi Zn-finger in Ran binding protein and others containing protein 0.0135 0.1639 0.3438
Schistosoma mansoni cpg binding protein 0.0035 0.0356 0.0571
Giardia lamblia Protein 21.1 0.0007 0 0.5
Giardia lamblia Hypothetical protein 0.0007 0 0.5
Onchocerca volvulus 0.0135 0.1639 0.3438
Schistosoma mansoni cpg binding protein 0.0037 0.0382 0.0612
Loa Loa (eye worm) apoptosis regulator protein 0.014 0.171 0.3589
Loa Loa (eye worm) nuclear hormone receptor family member nhr-49 0.001 0.0044 0.0092
Loa Loa (eye worm) hypothetical protein 0.003 0.0302 0.0634
Echinococcus granulosus Zinc finger RanBP2 type 0.0135 0.1639 0.1639
Toxoplasma gondii ran binding protein 0.0135 0.1639 0.3438
Giardia lamblia Protein 21.1 0.0007 0 0.5
Trypanosoma brucei hypothetical protein, conserved 0.0135 0.1639 1
Trichomonas vaginalis conserved hypothetical protein 0.0008 0.0013 0.0027
Loa Loa (eye worm) hypothetical protein 0.001 0.0044 0.0092
Giardia lamblia Protein 21.1 0.0007 0 0.5
Echinococcus multilocularis Nuclear pore complex protein Nup153 0.0135 0.1639 0.1639
Loa Loa (eye worm) TK protein kinase 0.0031 0.0306 0.0642
Echinococcus multilocularis tyrosine protein kinase Abl 0.0009 0.0023 0.0023
Echinococcus granulosus tyrosine protein kinase Src64B 0.0038 0.0403 0.0403
Plasmodium falciparum zinc finger Ran-binding domain-containing protein 2, putative 0.0135 0.1639 0.3438
Echinococcus granulosus mixed lineage leukemia protein mll 0.0009 0.0022 0.0022
Brugia malayi photoreceptor-specific nuclear receptor 0.001 0.0044 0.0092
Giardia lamblia Kinase 0.0007 0 0.5
Loa Loa (eye worm) hypothetical protein 0.0135 0.1639 0.3438
Brugia malayi Nuclear hormone receptor family member nhr-25 0.001 0.0044 0.0092
Echinococcus multilocularis SWI:SNF matrix associated 0.0379 0.4766 0.4766
Brugia malayi Nuclear hormone receptor family member nhr-3 0.001 0.0044 0.0092
Trichomonas vaginalis conserved hypothetical protein 0.0008 0.0013 0.0027
Trypanosoma cruzi mitochondrial RNA binding complex 1 subunit, putative 0.0135 0.1639 1
Loa Loa (eye worm) hypothetical protein 0.0102 0.1217 0.2554
Toxoplasma gondii SWIB/MDM2 domain-containing protein 0.0379 0.4766 1
Echinococcus multilocularis dnaJ subfamily B 0.0494 0.6239 0.6239
Giardia lamblia Protein 21.1 0.0007 0 0.5
Trichomonas vaginalis conserved hypothetical protein 0.0008 0.0013 0.0027
Trypanosoma brucei Zn-finger in Ran binding protein and others/FYVE zinc finger, putative 0.0135 0.1639 1
Schistosoma mansoni steroid hormone receptor ad4bp 0.001 0.0044 0.007
Plasmodium falciparum SWIB/MDM2 domain-containing protein 0.0379 0.4766 1
Echinococcus multilocularis tyrosine protein kinase Fgr 0.0038 0.0403 0.0403
Giardia lamblia Protein 21.1 0.0007 0 0.5
Brugia malayi Variant SH3 domain containing protein 0.0008 0.0009 0.0019
Trichomonas vaginalis helicase, putative 0.0008 0.0013 0.0027
Onchocerca volvulus 0.0035 0.0356 0.0748
Loa Loa (eye worm) variant SH3 domain-containing protein 0.0008 0.0009 0.0019
Echinococcus granulosus retinoic acid receptor rxr beta a 0.001 0.0044 0.0044
Schistosoma mansoni tyrosine kinase 0.0009 0.0023 0.0037
Plasmodium falciparum ataxin-2 like protein, putative 0.003 0.0302 0.0634
Schistosoma mansoni proto-oncogene tyrosine-protein kinase src 0.0009 0.0023 0.0037
Trypanosoma cruzi Zn-finger in Ran binding protein and others, putative 0.0135 0.1639 1
Schistosoma mansoni hypothetical protein 0.0494 0.6239 1
Toxoplasma gondii DNA topoisomerase domain-containing protein 0.0379 0.4766 1
Toxoplasma gondii Zn-finger in Ran binding protein and others domain-containing protein 0.0135 0.1639 0.3438
Trypanosoma cruzi hypothetical protein, conserved 0.0135 0.1639 1
Schistosoma mansoni RNA binding protein 0.0135 0.1639 0.2627
Echinococcus multilocularis tyrosine protein kinase Btk29A 0.0009 0.0023 0.0023
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.001 0.0044 0.0092
Echinococcus granulosus FTZ F1 nuclear receptor protein 0.001 0.0044 0.0044
Echinococcus granulosus dnaJ subfamily B 0.0494 0.6239 0.6239
Schistosoma mansoni proto-oncogene tyrosine-protein kinase abl1 0.0008 0.0009 0.0014
Brugia malayi Nuclear hormone receptor family member nhr-41 0.001 0.0044 0.0092
Echinococcus granulosus nuclear receptor 2DBD gamma 0.001 0.0044 0.0044
Echinococcus granulosus Nuclear pore complex protein Nup153 0.0135 0.1639 0.1639
Echinococcus granulosus tyrosine protein kinase Fyn 0.0038 0.0403 0.0403
Loa Loa (eye worm) nuclear hormone receptor family member nhr-31 0.001 0.0044 0.0092
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0008 0.0013 0.0027
Echinococcus multilocularis tyrosine protein kinase Srms 0.0035 0.0355 0.0355
Brugia malayi hypothetical protein 0.002 0.0164 0.0344
Echinococcus granulosus SWI:SNF matrix associated 0.0379 0.4766 0.4766
Giardia lamblia Zinc finger domain 0.0007 0 0.5
Brugia malayi Zn-finger in Ran binding protein and others containing protein 0.0135 0.1639 0.3438
Echinococcus multilocularis Zinc finger, RanBP2 type 0.0135 0.1639 0.1639
Giardia lamblia Hypothetical protein 0.0007 0 0.5
Echinococcus multilocularis Bcl 2 ous antagonist:killer 0.014 0.171 0.171
Loa Loa (eye worm) sex muscle abnormal protein 5 0.0008 0.0009 0.0019
Schistosoma mansoni tyrosine kinase 0.0038 0.0403 0.0645
Echinococcus granulosus Ataxin 2 N terminaldomain containing protein 0.0014 0.0087 0.0087
Loa Loa (eye worm) hypothetical protein 0.001 0.0044 0.0092
Echinococcus multilocularis FTZ F1 alpha 0.001 0.0044 0.0044
Giardia lamblia Protein 21.1 0.0007 0 0.5
Schistosoma mansoni growth factor receptor-bound protein 0.0008 0.0009 0.0014
Trichomonas vaginalis conserved hypothetical protein 0.0008 0.0013 0.0027
Onchocerca volvulus Bile acid receptor homolog 0.001 0.0044 0.0092
Brugia malayi Nuclear hormone receptor-like 1 0.001 0.0044 0.0092
Leishmania major hypothetical protein, conserved 0.003 0.0302 0.1843
Loa Loa (eye worm) TK protein kinase 0.0035 0.0355 0.0745
Schistosoma mansoni hypothetical protein 0.0014 0.0087 0.0139
Brugia malayi Nuclear hormone receptor family member nhr-19 0.001 0.0044 0.0092
Trypanosoma cruzi hypothetical protein, conserved 0.0135 0.1639 1
Echinococcus granulosus ring and YY1 binding protein 0.0135 0.1639 0.1639
Echinococcus granulosus FTZ F1 alpha 0.001 0.0044 0.0044
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0009 0.0022 0.0036
Loa Loa (eye worm) nuclear hormone receptor family member nhr-14 0.001 0.0044 0.0092
Echinococcus granulosus Bcl 2 ous antagonist:killer 0.014 0.171 0.171
Giardia lamblia Protein 21.1 0.0007 0 0.5
Brugia malayi Nuclear hormone receptor family member nhr-14 0.001 0.0044 0.0092
Toxoplasma gondii histone lysine methyltransferase SET1 0.0066 0.0754 0.1581
Onchocerca volvulus 0.0102 0.1217 0.2554
Schistosoma mansoni thyroid hormone receptor 0.001 0.0044 0.007
Schistosoma mansoni brg-1 associated factor 0.0379 0.4766 0.764
Loa Loa (eye worm) hypothetical protein 0.0135 0.1639 0.3438
Giardia lamblia Kinase, NEK 0.0007 0 0.5
Brugia malayi YY1-associated factor 2 0.0135 0.1639 0.3438
Schistosoma mansoni retinoid-x-receptor (RXR) 0.001 0.0044 0.007
Echinococcus multilocularis hepatocyte nuclear factor 4 alpha 0.001 0.0044 0.0044
Brugia malayi nuclear receptor NHR-88 0.001 0.0044 0.0092
Giardia lamblia Protein 21.1 0.0007 0 0.5
Loa Loa (eye worm) hypothetical protein 0.001 0.0044 0.0092
Echinococcus granulosus tumor protein p63 0.0696 0.8828 0.8828
Schistosoma mansoni nuclear hormone receptor nor-1/nor-2 0.001 0.0044 0.007
Onchocerca volvulus Steroid hormone receptor family member cnr14 homolog 0.001 0.0044 0.0092
Plasmodium vivax hypothetical protein, conserved 0.0379 0.4766 1
Echinococcus granulosus tyrosine protein kinase Lyn 0.0038 0.0403 0.0403
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.001 0.0044 0.0044
Loa Loa (eye worm) hypothetical protein 0.0008 0.0009 0.0019
Giardia lamblia Zinc finger domain 0.0007 0 0.5
Trichomonas vaginalis conserved hypothetical protein 0.0379 0.4766 1
Loa Loa (eye worm) nuclear hormone receptor family member nhr-1 0.001 0.0044 0.0092
Loa Loa (eye worm) hypothetical protein 0.001 0.0044 0.0092
Brugia malayi brahma associated protein 60 kDa 0.0379 0.4766 1
Schistosoma mansoni hypothetical protein 0.0379 0.4766 0.764
Brugia malayi SWIB/MDM2 domain containing protein 0.0379 0.4766 1
Giardia lamblia Hypothetical protein 0.0007 0 0.5
Trypanosoma cruzi hypothetical protein, conserved 0.0135 0.1639 1
Echinococcus multilocularis tyrosine protein kinase Src42A 0.0038 0.0403 0.0403
Echinococcus multilocularis histone lysine N methyltransferase MLL3 0.0011 0.005 0.005
Loa Loa (eye worm) hypothetical protein 0.0135 0.1639 0.3438
Loa Loa (eye worm) hypothetical protein 0.001 0.0044 0.0092
Echinococcus granulosus tyrosine protein kinase Src42A 0.0033 0.0341 0.0341
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0008 0.0013 0.0027
Brugia malayi Steroid receptor seven-up type 2 0.001 0.0044 0.0092
Giardia lamblia Protein 21.1 0.0007 0 0.5
Echinococcus multilocularis Ataxin 2, N terminal,domain containing protein 0.0014 0.0087 0.0087
Loa Loa (eye worm) SWIB/MDM2 domain-containing protein 0.0379 0.4766 1
Trypanosoma brucei mitochondrial RNA binding complex 1 subunit 0.0135 0.1639 1
Trypanosoma brucei PAB1-binding protein , putative 0.003 0.0302 0.1843
Loa Loa (eye worm) nuclear hormone receptor family member nhr-40 0.001 0.0044 0.0092
Giardia lamblia Protein 21.1 0.0007 0 0.5
Schistosoma mansoni retinoic acid receptor RXR 0.001 0.0044 0.007
Loa Loa (eye worm) nuclear Hormone Receptor family member 0.001 0.0044 0.0092
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.001 0.0044 0.0044
Echinococcus multilocularis FTZ F1 nuclear receptor protein 0.001 0.0044 0.0044
Giardia lamblia Protein 21.1 0.0007 0 0.5
Trypanosoma cruzi PAB1-binding protein , putative 0.003 0.0302 0.1843
Echinococcus multilocularis growth factor receptor bound protein 2 0.0008 0.0009 0.0009
Trichomonas vaginalis conserved hypothetical protein 0.0008 0.0013 0.0027
Brugia malayi Nuclear hormone receptor family member nhr-1 0.001 0.0044 0.0092
Schistosoma mansoni nuclear receptor 2DBD-gamma 0.001 0.0044 0.007
Plasmodium vivax SWIB/MDM2 domain-containing protein, putative 0.0379 0.4766 1
Schistosoma mansoni hypothetical protein 0.014 0.171 0.2742
Brugia malayi Nuclear hormone receptor family member nhr-40 0.001 0.0044 0.0092
Echinococcus multilocularis ring and YY1 binding protein 0.0135 0.1639 0.1639
Echinococcus multilocularis ecdysone induced protein 78C 0.001 0.0044 0.0044
Trichomonas vaginalis conserved hypothetical protein 0.0008 0.0013 0.0027
Echinococcus granulosus ecdysone induced protein 78C 0.001 0.0044 0.0044
Onchocerca volvulus Ubiquitin thioesterase ZRANB1 homolog 0.0135 0.1639 0.3438
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0074 0.0854 0.1369
Echinococcus multilocularis proto oncogene tyrosine protein kinase LCK 0.0038 0.0403 0.0403
Schistosoma mansoni apoptosis regulator bax 0.014 0.171 0.2742
Echinococcus granulosus tyrosine protein kinase Fyn 0.0038 0.0403 0.0403
Echinococcus multilocularis thyroid hormone receptor alpha 0.001 0.0044 0.0044
Loa Loa (eye worm) hypothetical protein 0.0135 0.1639 0.3438
Giardia lamblia Hypothetical protein 0.0007 0 0.5
Giardia lamblia Protein 21.1 0.0007 0 0.5
Plasmodium falciparum ataxin-2 like protein, putative 0.003 0.0302 0.0634
Schistosoma mansoni FTZ-F1 nuclear receptor-like protein 0.001 0.0044 0.007
Chlamydia trachomatis SWIB complex protein 0.0379 0.4766 0.5
Schistosoma mansoni Tr4/Tr2 (homologue) 0.001 0.0044 0.007
Brugia malayi CXXC zinc finger family protein 0.0035 0.0356 0.0748
Echinococcus multilocularis Nuclear hormone receptor family member nhr 41 0.001 0.0044 0.0044
Giardia lamblia Hypothetical protein 0.0007 0 0.5
Echinococcus granulosus Nuclear hormone receptor family member nhr 41 0.001 0.0044 0.0044
Schistosoma mansoni hypothetical protein 0.014 0.171 0.2742
Echinococcus multilocularis tyrosine protein kinase Src64B 0.0038 0.0403 0.0403
Echinococcus multilocularis tyrosine protein kinase Fyn 0.0038 0.0403 0.0403
Schistosoma mansoni nuclear hormone receptor 0.001 0.0044 0.007
Echinococcus granulosus nuclear receptor 2DBD gamma 0.001 0.0044 0.0044
Brugia malayi Sex muscle abnormal protein 5 0.0008 0.0009 0.0019
Schistosoma mansoni RAR-like nuclear receptor 0.001 0.0044 0.007
Brugia malayi brahma associated protein 60 kDa 0.0379 0.4766 1
Schistosoma mansoni tyrosine kinase 0.0009 0.0023 0.0037
Trichomonas vaginalis conserved hypothetical protein 0.0008 0.0013 0.0027
Echinococcus granulosus zinc finger protein Ran binding 0.0135 0.1639 0.1639
Brugia malayi Apoptosis regulator proteins, Bcl-2 family protein 0.014 0.171 0.3589
Schistosoma mansoni photoreceptor-specific nuclear receptor related 0.001 0.0044 0.007
Brugia malayi Nuclear hormone receptor family member nhr-19 0.001 0.0044 0.0092
Schistosoma mansoni bcl-2 homologous antagonist/killer (bak) 0.014 0.171 0.2742
Schistosoma mansoni hypothetical protein 0.0135 0.1639 0.2627
Echinococcus granulosus hepatocyte nuclear factor 4 alpha 0.001 0.0044 0.0044
Loa Loa (eye worm) hypothetical protein 0.001 0.0044 0.0092
Echinococcus multilocularis COUP TF:Svp nuclear hormone receptor 0.001 0.0044 0.0044
Trypanosoma cruzi WLM domain containing protein, putative 0.0135 0.1639 1
Echinococcus multilocularis c src tyrosine kinase 0.0009 0.0023 0.0023
Giardia lamblia Ser/Thr protein kinase 0.0007 0 0.5
Schistosoma mansoni hypothetical protein 0.0379 0.4766 0.764
Giardia lamblia Protein 21.1 0.0007 0 0.5
Echinococcus multilocularis tumor protein p63 0.0696 0.8828 0.8828
Brugia malayi ecdysteroid receptor 0.001 0.0044 0.0092
Trypanosoma cruzi Zn-finger in Ran binding protein and others, putative 0.0135 0.1639 1
Loa Loa (eye worm) CXXC zinc finger family protein 0.0035 0.0356 0.0748
Echinococcus granulosus cpg binding protein 0.0037 0.0382 0.0382
Giardia lamblia Protein 21.1 0.0007 0 0.5
Schistosoma mansoni adapter molecule crk 0.0008 0.0009 0.0014
Onchocerca volvulus Protein ultraspiracle homolog 0.001 0.0044 0.0092
Giardia lamblia Protein 21.1 0.0007 0 0.5
Echinococcus multilocularis cpg binding protein 0.0037 0.0382 0.0382
Loa Loa (eye worm) hypothetical protein 0.0135 0.1639 0.3438
Giardia lamblia Protein 21.1 0.0007 0 0.5
Chlamydia trachomatis DNA topoisomerase I 0.0379 0.4766 0.5
Loa Loa (eye worm) steroid hormone receptor 0.001 0.0044 0.0092
Giardia lamblia Protein 21.1 0.0007 0 0.5
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.001 0.0044 0.0092
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0008 0.0013 0.0027
Giardia lamblia Protein 21.1 0.0007 0 0.5
Echinococcus granulosus tyrosine protein kinase Fyn 0.0038 0.0403 0.0403
Giardia lamblia Protein 21.1 0.0007 0 0.5
Giardia lamblia Protein 21.1 0.0007 0 0.5
Leishmania major hypothetical protein, conserved 0.0135 0.1639 1
Trichomonas vaginalis chromodomain-helicase-DNA-binding protein, putative 0.0008 0.0013 0.0027
Echinococcus granulosus proto oncogene tyrosine protein kinase LCK 0.0038 0.0403 0.0403
Brugia malayi steroid hormone receptor 0.001 0.0044 0.0092
Echinococcus multilocularis zinc finger protein Ran binding 0.0135 0.1639 0.1639
Echinococcus multilocularis SWI:SNF matrix associated 0.0379 0.4766 0.4766
Echinococcus multilocularis tyrosine protein kinase Fyn 0.0035 0.0355 0.0355
Schistosoma mansoni nck2/grb4 0.0008 0.0009 0.0014
Trichomonas vaginalis chromodomain-helicase-DNA-binding protein, putative 0.0008 0.0013 0.0027
Schistosoma mansoni thyroid hormone receptor 0.001 0.0044 0.007
Schistosoma mansoni tyrosine kinase 0.0038 0.0403 0.0645
Echinococcus multilocularis EGFP:Bcl2 fusion protein 0.0788 1 1
Onchocerca volvulus 0.0135 0.1639 0.3438
Brugia malayi SRC-1 0.0038 0.0403 0.0845
Brugia malayi hypothetical protein 0.003 0.0302 0.0634
Plasmodium vivax ataxin-2 like protein, putative 0.003 0.0302 0.0634
Echinococcus granulosus tyrosine kinase|tyrosine protein kinase Fyn 0.0035 0.0355 0.0355
Echinococcus granulosus tyrosine protein kinase Btk29A 0.0009 0.0023 0.0023
Echinococcus multilocularis tyrosine protein kinase Blk 0.0035 0.0355 0.0355
Loa Loa (eye worm) SRC-1 0.0038 0.0403 0.0845
Giardia lamblia Protein 21.1 0.0007 0 0.5
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0008 0.0013 0.0027
Trypanosoma cruzi mitochondrial RNA binding complex 1 subunit, putative 0.0135 0.1639 1
Loa Loa (eye worm) nuclear hormone receptor family member nhr-41 0.001 0.0044 0.0092
Leishmania major hypothetical protein, conserved 0.0135 0.1639 1
Loa Loa (eye worm) hypothetical protein 0.001 0.0044 0.0092
Echinococcus granulosus histone lysine N methyltransferase MLL3 0.0009 0.0022 0.0022
Echinococcus multilocularis tyrosine protein kinase lyn lyn a protein tyrosine kinase lymphocyte specific protein tyrosine kinase 0.0038 0.0403 0.0403
Trypanosoma cruzi PAB1-binding protein , putative 0.003 0.0302 0.1843
Trichomonas vaginalis conserved hypothetical protein 0.0008 0.0013 0.0027
Loa Loa (eye worm) hypothetical protein 0.014 0.171 0.3589
Leishmania major hypothetical protein, conserved 0.0135 0.1639 1
Brugia malayi Nuclear hormone receptor family member nhr-49 0.001 0.0044 0.0092
Brugia malayi Zn-finger in Ran binding protein and others containing protein 0.0135 0.1639 0.3438
Schistosoma mansoni hypothetical protein 0.014 0.171 0.2742
Onchocerca volvulus 0.0379 0.4766 1
Brugia malayi Nuclear hormone receptor family member nhr-31 0.001 0.0044 0.0092
Echinococcus granulosus c src tyrosine kinase 0.0009 0.0023 0.0023

Activities

Activity type Activity value Assay description Source Reference
Potency (functional) = 11.2202 um PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors Targeting the Menin-MLL Interaction in MLL Related Leukemias: Competition With Texas Red Labeled MLL-derived Mutant Peptide. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 12.5893 uM PubChem BioAssay. qHTS for Inhibitors of ATXN expression. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 18.526 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) 28.1838 uM PubChem BioAssay. qHTS for Agonist of gsp, the Etiologic Mutation Responsible for Fibrous Dysplasia/McCune-Albright Syndrome: qHTS. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 31.6228 uM PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of 15-hLO-2 (15-human lipoxygenase 2). (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID2312, AID2537, AID2702] ChEMBL. No reference
Potency (functional) 37.933 uM PubChem BioAssay. qHTS Assay to Find Inhibitors of Pin1. (Class of assay: confirmatory) 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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