Detailed information for compound 1484148

Basic information

Technical information
  • TDR Targets ID: 1484148
  • Name: 3-(3,4-dihydro-1H-isoquinolin-2-yl)-6-methyl- 2H-1,2,4-triazin-5-one
  • MW: 242.276 | Formula: C13H14N4O
  • H donors: 1 H acceptors: 4 LogP: 1.56 Rotable bonds: 1
    Rule of 5 violations (Lipinski): 1
  • SMILES: Cc1nnc(nc1O)N1CCc2c(C1)cccc2
  • InChi: 1S/C13H14N4O/c1-9-12(18)14-13(16-15-9)17-7-6-10-4-2-3-5-11(10)8-17/h2-5H,6-8H2,1H3,(H,14,16,18)
  • InChiKey: CDJXMBZQPMGPNN-UHFFFAOYSA-N  


Substructure search Similarity search

Network

Hover on a compound node to display the structore

Synonyms

  • ST5205513
  • 3-(3,4-dihydro-2(1H)-isoquinolinyl)-6-methyl-1,2,4-triazin-5(4H)-one
  • MLS000066164
  • SMR000079749
  • ZINC00150628
  • SDCCGMLS-0065346.P001

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
Entamoeba histolytica prolyl oligopeptidase family protein 0.0055 0.0499 0.0499
Echinococcus granulosus aldo keto reductase 0.0961 1 1
Schistosoma mansoni prolyl oligopeptidase (S09 family) 0.0055 0.0499 0.0499
Entamoeba histolytica acyl-CoA synthetase, putative 0.0026 0.019 0.019
Schistosoma mansoni aldo-keto reductase 0.0961 1 1
Toxoplasma gondii aldo/keto reductase family oxidoreductase 0.0278 0.284 0.284
Entamoeba histolytica fatty acid elongase, putative 0.0094 0.0902 0.0902
Trichomonas vaginalis aldo-keto reductase, putative 0.0961 1 1
Mycobacterium leprae PROBABLE FATTY-ACID-CoA LIGASE FADD2 (FATTY-ACID-CoA SYNTHETASE) (FATTY-ACID-CoA SYNTHASE) 0.0026 0.019 0.019
Trichomonas vaginalis Clan SC, family S33, methylesterase-like serine peptidase 0.0055 0.0499 0.0499
Trypanosoma cruzi aldo-keto reductase 0.0961 1 1
Leishmania major aldo-keto reductase-like protein 0.0961 1 1
Trichomonas vaginalis aldo/keto reductase, putative 0.0961 1 1
Toxoplasma gondii acylaminoacyl-peptidase, putative 0.0055 0.0499 0.0499
Schistosoma mansoni cpg binding protein 0.0033 0.0266 0.0266
Echinococcus multilocularis microtubule associated protein 2 0.0747 0.7757 0.7757
Schistosoma mansoni niemann-pick C1 (NPC1) 0.011 0.1075 0.1075
Trichomonas vaginalis Clan SC, family S9, acylaminoacyl-peptidase-like serine peptidase 0.0055 0.0499 0.0499
Echinococcus granulosus expressed conserved protein 0.0102 0.0989 0.0989
Plasmodium vivax acyl-CoA synthetase, putative 0.0019 0.0122 0.0163
Echinococcus granulosus aldo keto reductase family 1 member B4 0.0961 1 1
Loa Loa (eye worm) hypothetical protein 0.0179 0.1794 0.1794
Onchocerca volvulus 0.0961 1 1
Mycobacterium ulcerans acyl-CoA synthetase 0.0026 0.019 0.019
Loa Loa (eye worm) oxidoreductase 0.0961 1 1
Trichomonas vaginalis aldo-keto reductase, putative 0.0961 1 1
Schistosoma mansoni prolyl oligopeptidase (S09 family) 0.0055 0.0499 0.0499
Entamoeba histolytica fatty acid elongase, putative 0.0094 0.0902 0.0902
Wolbachia endosymbiont of Brugia malayi 3-oxoacyl-ACP synthase 0.072 0.7476 0.5
Brugia malayi AMP-binding enzyme family protein 0.0026 0.019 0.019
Schistosoma mansoni hypothetical protein 0.0045 0.0391 0.0391
Echinococcus granulosus geminin 0.0183 0.1845 0.1845
Echinococcus granulosus aldo keto reductase family 1, member B4 0.0278 0.284 0.284
Echinococcus granulosus dipeptidyl aminopeptidaseprotein 0.0595 0.6162 0.6162
Toxoplasma gondii prolyl endopeptidase 0.0055 0.0499 0.0499
Echinococcus multilocularis aldo keto reductase 0.0961 1 1
Leishmania major 4-coumarate:coa ligase-like protein 0.0026 0.019 0.019
Echinococcus multilocularis expressed conserved protein 0.0102 0.0989 0.0989
Loa Loa (eye worm) hypothetical protein 0.0019 0.0122 0.0122
Loa Loa (eye worm) hypothetical protein 0.0057 0.0518 0.0518
Echinococcus multilocularis aldo keto reductase family 1, member B4 0.0961 1 1
Mycobacterium leprae PROBABLE PROTEASE II PTRBB (OLIGOPEPTIDASE B) 0.0055 0.0499 0.0499
Onchocerca volvulus 0.0961 1 1
Schistosoma mansoni hypothetical protein 0.0183 0.1845 0.1845
Loa Loa (eye worm) prolyl oligopeptidase 0.0595 0.6162 0.6162
Echinococcus granulosus microtubule associated protein 2 0.0747 0.7757 0.7757
Brugia malayi hypothetical protein 0.0164 0.1637 0.1637
Brugia malayi prolyl oligopeptidase family protein 0.0055 0.0499 0.0499
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD2 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0026 0.019 0.019
Echinococcus granulosus aldo keto reductase family 1 member B4 0.0961 1 1
Schistosoma mansoni cpg binding protein 0.0031 0.0247 0.0247
Brugia malayi glutamate-cysteine ligase modifier subunit 0.0278 0.284 0.284
Echinococcus granulosus aldo keto reductase family 1 member B4 0.0961 1 1
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.005 0.044 0.044
Mycobacterium leprae Conserved hypothetical protein 0.0682 0.7081 0.7081
Echinococcus multilocularis histone lysine N methyltransferase MLL3 0.0008 0.0002 0.0002
Echinococcus multilocularis sterol regulatory element binding protein 0.0046 0.0409 0.0409
Mycobacterium ulcerans beta-ketoacyl synthase-like protein 0.072 0.7476 0.7476
Loa Loa (eye worm) hypothetical protein 0.0055 0.0499 0.0499
Trichomonas vaginalis aldo-keto reductase, putative 0.0961 1 1
Loa Loa (eye worm) hypothetical protein 0.0026 0.019 0.019
Schistosoma mansoni microtubule-associated protein tau 0.0747 0.7757 0.7757
Trichomonas vaginalis aldo-keto reductase, putative 0.0961 1 1
Echinococcus multilocularis aldo keto reductase family 1, member B4 0.0961 1 1
Echinococcus multilocularis aldehyde reductase 0.0682 0.7081 0.7081
Mycobacterium leprae PROBABLE FATTY-ACID-CoA LIGASE FADD7 (FATTY-ACID-CoA SYNTHETASE) (FATTY-ACID-CoA SYNTHASE) 0.0026 0.019 0.019
Loa Loa (eye worm) hypothetical protein 0.0026 0.019 0.019
Mycobacterium ulcerans hypothetical protein 0.0278 0.284 0.284
Echinococcus granulosus aldo keto reductase family 1 member B4 0.0961 1 1
Echinococcus granulosus hypothetical protein 0.0961 1 1
Loa Loa (eye worm) hypothetical protein 0.0019 0.0122 0.0122
Echinococcus multilocularis aldo keto reductase family 1, member B4 0.0961 1 1
Mycobacterium ulcerans fatty-acid-CoA ligase 0.0026 0.019 0.019
Leishmania major prostaglandin f2-alpha synthase/D-arabinose dehydrogenase 0.0961 1 1
Echinococcus multilocularis atpase aaa+ type core atpase aaa type core 0.0878 0.9129 0.9129
Mycobacterium ulcerans long-chain fatty-acid CoA ligase 0.0026 0.019 0.019
Mycobacterium tuberculosis Conserved protein 0.0278 0.284 0.284
Trichomonas vaginalis alcohol dehydrogenase, putative 0.0278 0.284 0.284
Trichomonas vaginalis aldo-keto reductase, putative 0.0278 0.284 0.284
Giardia lamblia Aldose reductase 0.0961 1 1
Trypanosoma brucei Dipeptidyl-peptidase 8-like, putative 0.0282 0.2881 0.2881
Entamoeba histolytica dipeptidyl-peptidase, putative 0.0055 0.0499 0.0499
Echinococcus granulosus Protein patched homolog 1 0.0046 0.0409 0.0409
Echinococcus granulosus aldo keto reductase family 1 member B4 0.0961 1 1
Plasmodium vivax aldehyde reductase, putative 0.0278 0.284 0.3799
Echinococcus granulosus aldo keto reductase family 1 member B4 0.0961 1 1
Mycobacterium ulcerans long-chain-fatty-acid--CoA ligase 0.0026 0.019 0.019
Echinococcus multilocularis aldo keto reductase family 1, member B4 0.0961 1 1
Echinococcus granulosus aldehyde reductase 0.0682 0.7081 0.7081
Trypanosoma cruzi aldo/keto reductase, putative 0.0278 0.284 0.284
Trypanosoma cruzi hypothetical protein, conserved 0.0055 0.0499 0.0499
Trichomonas vaginalis dihydrodiol dehydrogenase, putative 0.0961 1 1
Trypanosoma brucei aldo-keto reductase, putative 0.0961 1 1
Loa Loa (eye worm) prolyl oligopeptidase 0.0055 0.0499 0.0499
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0066 0.0613 0.0613
Leishmania major oligopeptidase b 0.0055 0.0499 0.0499
Trypanosoma brucei serine peptidase, clan SC, family S9A-like protein 0.0055 0.0499 0.0499
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD7 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0018 0.0111 0.0111
Onchocerca volvulus Prolyl endopeptidase homolog 0.0055 0.0499 0.0499
Entamoeba histolytica fatty acid elongase, putative 0.0094 0.0902 0.0902
Trypanosoma cruzi oligopeptidase b 0.0055 0.0499 0.0499
Loa Loa (eye worm) oxidoreductase 0.0961 1 1
Trichomonas vaginalis aldo-keto reductase, putative 0.0961 1 1
Trypanosoma brucei prolyl endopeptidase 0.0055 0.0499 0.0499
Echinococcus multilocularis aldo keto reductase family 1, member B4 0.0961 1 1
Schistosoma mansoni aldo-keto reductase 0.0961 1 1
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.005 0.044 0.044
Leishmania major prolyl oligopeptidase, putative,serine peptidase clan SC, family S9A, putative 0.0055 0.0499 0.0499
Toxoplasma gondii aldo-keto reductase 0.0278 0.284 0.284
Loa Loa (eye worm) hypothetical protein 0.0961 1 1
Echinococcus multilocularis Niemann Pick C1 protein 0.0108 0.1058 0.1058
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.005 0.044 0.044
Giardia lamblia Aldose reductase 0.0961 1 1
Trichomonas vaginalis aldo-keto reductase, putative 0.0961 1 1
Echinococcus granulosus Niemann Pick C1 protein 0.0108 0.1058 0.1058
Brugia malayi oxidoreductase, aldo/keto reductase family protein 0.0961 1 1
Trypanosoma cruzi oligopeptidase B-like protein, putative 0.0055 0.0499 0.0499
Loa Loa (eye worm) hypothetical protein 0.0104 0.1007 0.1007
Brugia malayi hypothetical protein 0.0179 0.1794 0.1794
Leishmania major 4-coumarate:coa ligase-like protein 0.0026 0.019 0.019
Schistosoma mansoni subfamily S9B unassigned peptidase (S09 family) 0.0595 0.6162 0.6162
Chlamydia trachomatis oxoacyl-ACP synthase III 0.072 0.7476 1
Echinococcus granulosus Dipeptidyl peptidase 9 0.0282 0.2881 0.2881
Loa Loa (eye worm) hypothetical protein 0.0019 0.0122 0.0122
Echinococcus granulosus sterol regulatory element binding protein 0.0046 0.0409 0.0409
Echinococcus granulosus prolyl endopeptidase 0.0055 0.0499 0.0499
Loa Loa (eye worm) hypothetical protein 0.0019 0.0122 0.0122
Plasmodium falciparum aldehyde reductase, putative 0.0278 0.284 0.3799
Entamoeba histolytica aldose reductase, putative 0.0961 1 1
Onchocerca volvulus 0.0278 0.284 0.284
Trypanosoma cruzi dipeptidyl-peptidase 8-like serine peptidase 0.0282 0.2881 0.2881
Loa Loa (eye worm) oxidoreductase 0.0961 1 1
Echinococcus multilocularis acylamino acid releasing enzyme 0.0055 0.0499 0.0499
Echinococcus multilocularis mixed lineage leukemia protein mll 0.0008 0.0002 0.0002
Schistosoma mansoni hypothetical protein 0.0045 0.0391 0.0391
Echinococcus multilocularis aldo keto reductase family 1, member B4 0.0961 1 1
Entamoeba histolytica alcohol dehydrogenase, putative 0.0278 0.284 0.284
Mycobacterium ulcerans protease II (oligopeptidase B), PtrB 0.0055 0.0499 0.0499
Brugia malayi CXXC zinc finger family protein 0.0031 0.0247 0.0247
Schistosoma mansoni cpg binding protein 0.0033 0.0266 0.0266
Onchocerca volvulus 0.0961 1 1
Trichomonas vaginalis conserved hypothetical protein 0.0278 0.284 0.284
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD35 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0018 0.0111 0.0111
Trypanosoma brucei serine peptidase, Clan SC, Family S9B 0.0282 0.2881 0.2881
Brugia malayi prolyl oligopeptidase family protein 0.0055 0.0499 0.0499
Loa Loa (eye worm) histone methyltransferase 0.001 0.0022 0.0022
Echinococcus granulosus cpg binding protein 0.0033 0.0266 0.0266
Loa Loa (eye worm) glutamate-cysteine ligase modifier subunit 0.0278 0.284 0.284
Brugia malayi prolyl oligopeptidase family protein 0.0282 0.2881 0.2881
Echinococcus granulosus aldo keto reductase 0.0961 1 1
Trypanosoma brucei oligopeptidase b 0.0055 0.0499 0.0499
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.005 0.044 0.044
Mycobacterium ulcerans long-chain-fatty-acid-CoA ligase 0.0026 0.019 0.019
Mycobacterium tuberculosis Probable protease II PtrBb [second part] (oligopeptidase B) 0.0055 0.0499 0.0499
Entamoeba histolytica acyl-CoA synthetase, putative 0.0026 0.019 0.019
Trichomonas vaginalis aldo-keto reductase, putative 0.0961 1 1
Plasmodium falciparum peptidase, putative 0.0055 0.0499 0.0667
Toxoplasma gondii oxidoreductase, aldo/keto reductase family protein 0.0278 0.284 0.284
Trypanosoma cruzi aldo/keto reductase, putative 0.0961 1 1
Brugia malayi F/Y-rich N-terminus family protein 0.0009 0.0021 0.0021
Entamoeba histolytica aldose reductase, putative 0.0961 1 1
Loa Loa (eye worm) hypothetical protein 0.0026 0.019 0.019
Echinococcus multilocularis Dipeptidyl peptidase 9 0.0282 0.2881 0.2881
Toxoplasma gondii histone lysine methyltransferase SET1 0.0059 0.0539 0.0539
Echinococcus multilocularis Niemann Pick C1 protein 0.0155 0.1545 0.1545
Mycobacterium ulcerans acyl-CoA synthetase 0.0026 0.019 0.019
Entamoeba histolytica acyl-coA synthetase, putative 0.0026 0.019 0.019
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.005 0.044 0.044
Entamoeba histolytica dipeptidyl-peptidase, putative 0.0055 0.0499 0.0499
Loa Loa (eye worm) oxidoreductase 0.0961 1 1
Schistosoma mansoni patched 1 0.0046 0.0409 0.0409
Echinococcus multilocularis aldo keto reductase family 1, member B4 0.0961 1 1
Echinococcus granulosus aldo keto reductase family 1 member B4 0.0961 1 1
Echinococcus granulosus mixed lineage leukemia protein mll 0.0008 0.0002 0.0002
Trypanosoma cruzi serine peptidase, Clan SC, Family S9B 0.0282 0.2881 0.2881
Mycobacterium leprae PROBABLE OXIDOREDUCTASE 0.0961 1 1
Brugia malayi NADH-dependent xylose reductase 0.0278 0.284 0.284
Echinococcus granulosus histone lysine N methyltransferase MLL3 0.001 0.0022 0.0022
Trypanosoma brucei Alpha/beta hydrolase domain-containing protein 0.0055 0.0499 0.0499
Toxoplasma gondii aldose reductase, putative 0.0961 1 1
Schistosoma mansoni potassium channel beta 0.0278 0.284 0.284
Echinococcus multilocularis protein dispatched 1 0.0053 0.0478 0.0478
Trichomonas vaginalis aldo-keto reductase, putative 0.0961 1 1
Echinococcus multilocularis aldo keto reductase 0.0961 1 1
Mycobacterium tuberculosis 3-oxoacyl-[acyl-carrier-protein] synthase III FabH (beta-ketoacyl-ACP synthase III) (KAS III) 0.072 0.7476 0.7476
Schistosoma mansoni acylaminoacyl-peptidase (S09 family) 0.0055 0.0499 0.0499
Brugia malayi oxidoreductase, aldo/keto reductase family protein 0.0961 1 1
Loa Loa (eye worm) abnormal chemotaxis protein 14 0.0046 0.0409 0.0409
Echinococcus multilocularis aldo keto reductase family 1, member B4 0.0961 1 1
Trypanosoma cruzi serine peptidase, clan SC, family S9A-like protein, putative 0.0055 0.0499 0.0499
Trichomonas vaginalis conserved hypothetical protein 0.0055 0.0499 0.0499
Echinococcus granulosus voltage gated potassium channel subunit 0.0278 0.284 0.284
Echinococcus granulosus aldo keto reductase 0.0961 1 1
Echinococcus multilocularis aldo keto reductase family 1, member B4 0.0961 1 1
Loa Loa (eye worm) CXXC zinc finger family protein 0.0031 0.0247 0.0247
Leishmania major dipeptidyl-peptidase 8-like serine peptidase, putative,serine peptidase, Clan SC, Family S9B 0.0282 0.2881 0.2881
Mycobacterium ulcerans 3-oxoacyl-ACP synthase 0.072 0.7476 0.7476
Loa Loa (eye worm) hypothetical protein 0.0019 0.0122 0.0122
Entamoeba histolytica prolyl oligopeptidase family protein 0.0055 0.0499 0.0499
Schistosoma mansoni hypothetical protein 0.0443 0.4566 0.4566
Mycobacterium leprae Possible oxidoreductase 0.0278 0.284 0.284
Entamoeba histolytica prolyl oligopeptidase family protein 0.0055 0.0499 0.0499
Echinococcus multilocularis dipeptidyl aminopeptidaseprotein 0.0595 0.6162 0.6162
Plasmodium vivax oxidoreductase, aldo/keto reductase domain containing protein 0.0278 0.284 0.3799
Onchocerca volvulus 0.0961 1 1
Trypanosoma brucei prolyl oligopeptidase, putative 0.0055 0.0499 0.0499
Leishmania major prostaglandin f synthase, putative 0.0961 1 1
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD5 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0018 0.0111 0.0111
Echinococcus multilocularis aldo keto reductase 0.0961 1 1
Trypanosoma brucei aldo/keto reductase, putative 0.0278 0.284 0.284
Leishmania major 4-coumarate:coa ligase-like protein 0.0026 0.019 0.019
Mycobacterium ulcerans acyl-CoA synthetase 0.0026 0.019 0.019
Schistosoma mansoni pol-related 0.0961 1 1
Trichomonas vaginalis aldo-keto reductase, putative 0.0961 1 1
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.005 0.044 0.044
Trypanosoma brucei prostaglandin f synthase 0.0961 1 1
Trichomonas vaginalis aldo/keto reductase, putative 0.0961 1 1
Onchocerca volvulus Dipeptidyl peptidase family member 1 homolog 0.0595 0.6162 0.6162
Echinococcus multilocularis aldo keto reductase 0.0961 1 1
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.005 0.044 0.044
Echinococcus multilocularis cpg binding protein 0.0033 0.0266 0.0266
Echinococcus multilocularis histone lysine N methyltransferase MLL3 0.001 0.0022 0.0022
Mycobacterium tuberculosis Probable peptidase 0.0055 0.0499 0.0499
Toxoplasma gondii dipeptidyl peptidase iv (dpp iv) n-terminal region domain-containing protein 0.0234 0.2372 0.2372
Leishmania major oligopeptidase B-like protein,serine peptidase, clan SC, family S9A-like protein 0.0055 0.0499 0.0499
Mycobacterium tuberculosis Fatty-acid-AMP ligase FadD30 (fatty-acid-AMP synthetase) (fatty-acid-AMP synthase) 0.0019 0.0122 0.0122
Loa Loa (eye worm) hypothetical protein 0.0164 0.1637 0.1637
Echinococcus granulosus Niemann Pick C1 protein 0.0155 0.1545 0.1545
Plasmodium vivax beta-ketoacyl-acyl carrier protein synthase III precursor, putative 0.072 0.7476 1
Trichomonas vaginalis aldo-keto reductase, putative 0.0961 1 1
Plasmodium vivax hypothetical protein, conserved 0.0055 0.0499 0.0667
Mycobacterium ulcerans hypothetical protein 0.0026 0.019 0.019
Onchocerca volvulus 0.0961 1 1
Schistosoma mansoni hypothetical protein 0.0183 0.1845 0.1845
Leishmania major aldo/keto reductase, putative,aldo/keto reductase family-like protein 0.0278 0.284 0.284
Echinococcus granulosus acylamino acid releasing enzyme 0.0055 0.0499 0.0499
Mycobacterium ulcerans oxidoreductase 0.0961 1 1
Trichomonas vaginalis aldo/keto reductase, putative 0.0961 1 1
Trichomonas vaginalis aldo-keto reductase, putative 0.0961 1 1
Loa Loa (eye worm) hypothetical protein 0.0108 0.1058 0.1058
Trypanosoma cruzi oligopeptidase b 0.0055 0.0499 0.0499
Trichomonas vaginalis dihydrodiol dehydrogenase, putative 0.0961 1 1
Toxoplasma gondii hypothetical protein 0.0055 0.0499 0.0499
Echinococcus granulosus dnaJ subfamily B 0.0443 0.4566 0.4566
Echinococcus multilocularis aldo keto reductase family 1, member B4 0.0961 1 1
Leishmania major aldehyde reductase, putative,oxidoreductase, putative 0.0961 1 1
Brugia malayi Niemann-Pick C1 protein precursor 0.0108 0.1058 0.1058
Schistosoma mansoni hypothetical protein 0.0045 0.0391 0.0391
Echinococcus granulosus histone lysine N methyltransferase MLL3 0.0008 0.0002 0.0002
Trichomonas vaginalis dihydrodiol dehydrogenase, putative 0.0961 1 1
Brugia malayi oxidoreductase, aldo/keto reductase family protein 0.0961 1 1
Mycobacterium ulcerans fatty-acid-CoA ligase 0.0019 0.0122 0.0122
Entamoeba histolytica fatty acid elongase, putative 0.0094 0.0902 0.0902
Plasmodium falciparum acyl-CoA synthetase 0.0019 0.0122 0.0163
Onchocerca volvulus 0.0164 0.1637 0.1637
Entamoeba histolytica hypothetical protein, conserved 0.0055 0.0499 0.0499
Onchocerca volvulus 0.0961 1 1
Mycobacterium ulcerans 3-oxoacyl-ACP synthase 0.072 0.7476 0.7476
Onchocerca volvulus 0.0031 0.0247 0.0247
Brugia malayi prolyl oligopeptidase family protein 0.0055 0.0499 0.0499
Loa Loa (eye worm) oxidoreductase 0.0961 1 1
Trichomonas vaginalis conserved hypothetical protein 0.0046 0.0409 0.0409
Echinococcus multilocularis dnaJ subfamily B 0.0443 0.4566 0.4566
Echinococcus multilocularis prolyl endopeptidase 0.0055 0.0499 0.0499
Trypanosoma cruzi prolyl endopeptidase 0.0055 0.0499 0.0499
Entamoeba histolytica aldose reductase, putative 0.0961 1 1
Onchocerca volvulus 0.0026 0.019 0.019
Brugia malayi AMP-binding enzyme family protein 0.0026 0.019 0.019
Mycobacterium tuberculosis Probable chain -fatty-acid-CoA ligase FadD13 (fatty-acyl-CoA synthetase) 0.0026 0.019 0.019
Entamoeba histolytica fatty acid elongase, putative 0.0094 0.0902 0.0902
Brugia malayi AMP-binding enzyme family protein 0.0026 0.019 0.019
Entamoeba histolytica Niemann-Pick C1 protein, putative 0.0108 0.1058 0.1058
Loa Loa (eye worm) hypothetical protein 0.0055 0.0499 0.0499
Echinococcus granulosus aldo keto reductase family 1 member B4 0.0961 1 1
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.005 0.044 0.044
Plasmodium falciparum aldo-keto reductase, putative 0.0278 0.284 0.3799
Echinococcus granulosus aldo keto reductase family 1 member B4 0.0961 1 1
Loa Loa (eye worm) hypothetical protein 0.0046 0.0409 0.0409
Entamoeba histolytica alcohol dehydrogenase, putative 0.0278 0.284 0.284
Trichomonas vaginalis aldo-keto reductase, putative 0.0961 1 1
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.005 0.044 0.044
Schistosoma mansoni dipeptidyl-peptidase 9 (S09 family) 0.0282 0.2881 0.2881
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0008 0.0002 0.0002
Echinococcus multilocularis aldo keto reductase family 1, member B4 0.0961 1 1
Plasmodium falciparum beta-ketoacyl-ACP synthase III 0.072 0.7476 1
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD3 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0018 0.0111 0.0111
Brugia malayi prolyl oligopeptidase family protein 0.0595 0.6162 0.6162
Brugia malayi CHE-14 protein 0.0046 0.0409 0.0409
Trichomonas vaginalis aldo-keto reductase, putative 0.0278 0.284 0.284
Trichomonas vaginalis aldo-keto reductase, putative 0.0278 0.284 0.284
Schistosoma mansoni hypothetical protein 0.0045 0.0391 0.0391
Mycobacterium tuberculosis Probable oxidoreductase 0.0961 1 1
Schistosoma mansoni prolyl oligopeptidase (S09 family) 0.0055 0.0499 0.0499
Echinococcus multilocularis protein patched 0.0046 0.0409 0.0409
Echinococcus multilocularis voltage gated potassium channel subunit 0.0278 0.284 0.284
Echinococcus multilocularis geminin 0.0183 0.1845 0.1845
Trypanosoma cruzi hypothetical protein, conserved 0.0055 0.0499 0.0499

Activities

Activity type Activity value Assay description Source Reference
Potency (functional) 29.0929 uM PUBCHEM_BIOASSAY: Nrf2 qHTS screen for inhibitors. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID493153, AID493163, AID504648] ChEMBL. No reference
Potency (functional) 29.9349 uM PubChem BioAssay. qHTS for Inhibitors of PLK1-PDB (polo-like kinase 1 - polo-box domain): Primary Screen. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 89.1251 uM PUBCHEM_BIOASSAY: qHTS for Inhibitors of Polymerase Eta. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID588636] ChEMBL. No reference

Phenotypes

Whole-cell/tissue/organism interactions

We have no records of whole-cell/tissue assays done with this compound What does this mean?

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

Annotated phenotypes:

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

External resources for this compound

Bibliographic References

No literature references available for this target.

If you have references for this compound, please enter them in a user comment (below) or Contact us.