Detailed information for compound 1330067

Basic information

Technical information
  • TDR Targets ID: 1330067
  • Name: 2-methyl-6-(naphthalen-1-ylamino)oxane-3,4,5- triol
  • MW: 289.326 | Formula: C16H19NO4
  • H donors: 4 H acceptors: 3 LogP: 1.52 Rotable bonds: 2
    Rule of 5 violations (Lipinski): 1
  • SMILES: OC1C(OC(C(C1O)O)C)Nc1cccc2c1cccc2
  • InChi: 1S/C16H19NO4/c1-9-13(18)14(19)15(20)16(21-9)17-12-8-4-6-10-5-2-3-7-11(10)12/h2-9,13-20H,1H3
  • InChiKey: RENWKKKXUKFSRO-UHFFFAOYSA-N  


Substructure search Similarity search

Network

Hover on a compound node to display the structore

Synonyms

  • 2-methyl-6-(1-naphthylamino)tetrahydropyran-3,4,5-triol
  • Oprea1_472152
  • MLS000107020
  • CBDivE_008196
  • SMR000111394
  • EU-0067194

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens SUMO1/sentrin specific peptidase 6 Starlite/ChEMBL No references
Giardia intestinalis Putative fructose-1,6-bisphosphate aldolase Starlite/ChEMBL No references
Rattus norvegicus Thioredoxin reductase 1, cytoplasmic Starlite/ChEMBL No references
Homo sapiens SUMO/sentrin specific peptidase family member 8 Starlite/ChEMBL No references
Homo sapiens apoptotic peptidase activating factor 1 Starlite/ChEMBL No references
Homo sapiens SUMO1/sentrin specific peptidase 7 Starlite/ChEMBL No references
Homo sapiens Wolf-Hirschhorn syndrome candidate 1 Starlite/ChEMBL No references
Homo sapiens caspase 3, apoptosis-related cysteine peptidase Starlite/ChEMBL No references

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Echinococcus granulosus caspase 3 Get druggable targets OG5_130238 All targets in OG5_130238
Schistosoma japonicum expressed protein Get druggable targets OG5_130029 All targets in OG5_130029
Brugia malayi glutathione reductase Get druggable targets OG5_126785 All targets in OG5_126785
Candida albicans one of three potential ubiquitin-like protein-specific protease genes Get druggable targets OG5_129942 All targets in OG5_129942
Trypanosoma congolense trypanothione reductase, putative Get druggable targets OG5_126785 All targets in OG5_126785
Trichomonas vaginalis Clan CE, family C48, Ulp1-like cysteine peptidase Get druggable targets OG5_129942 All targets in OG5_129942
Plasmodium falciparum thioredoxin reductase Get druggable targets OG5_126785 All targets in OG5_126785
Plasmodium knowlesi glutathione reductase, putative Get druggable targets OG5_126785 All targets in OG5_126785
Plasmodium yoelii thioredoxin reductase Get druggable targets OG5_126785 All targets in OG5_126785
Echinococcus multilocularis sentrin specific protease 7 Get druggable targets OG5_131076 All targets in OG5_131076
Plasmodium yoelii glutathione reductase Get druggable targets OG5_126785 All targets in OG5_126785
Echinococcus multilocularis sentrin specific protease 8 Get druggable targets OG5_129942 All targets in OG5_129942
Echinococcus multilocularis caspase 3 Get druggable targets OG5_130238 All targets in OG5_130238
Trichomonas vaginalis fructose-bisphosphate aldolase, putative Get druggable targets OG5_129214 All targets in OG5_129214
Candida albicans similar to S. cerevisiae GLR1 (YPL091W) glutathione oxidoreductase Get druggable targets OG5_126785 All targets in OG5_126785
Echinococcus multilocularis thioredoxin glutathione reductase Get druggable targets OG5_126785 All targets in OG5_126785
Cryptosporidium parvum thioredoxin reductase 1 Get druggable targets OG5_126785 All targets in OG5_126785
Echinococcus granulosus caspase Get druggable targets OG5_130238 All targets in OG5_130238
Trichomonas vaginalis fructose-bisphosphate aldolase, putative Get druggable targets OG5_129214 All targets in OG5_129214
Entamoeba histolytica Ulp1 protease family, C-terminal catalytic domain containing protein Get druggable targets OG5_129942 All targets in OG5_129942
Plasmodium berghei glutathione reductase, putative Get druggable targets OG5_126785 All targets in OG5_126785
Schistosoma mansoni caspase-7 (C14 family) Get druggable targets OG5_130238 All targets in OG5_130238
Echinococcus granulosus thioredoxin glutathione reductase Get druggable targets OG5_126785 All targets in OG5_126785
Plasmodium vivax thioredoxin reductase, putative Get druggable targets OG5_126785 All targets in OG5_126785
Schistosoma japonicum ko:K02187 caspase 3, apoptosis-related cysteine protease, putative Get druggable targets OG5_130238 All targets in OG5_130238
Trichomonas vaginalis fructose-bisphosphate aldolase, putative Get druggable targets OG5_129214 All targets in OG5_129214
Schistosoma japonicum ko:K08596 sentrin-specific protease 7, putative Get druggable targets OG5_131076 All targets in OG5_131076
Trichomonas vaginalis fructose-bisphosphate aldolase, putative Get druggable targets OG5_129214 All targets in OG5_129214
Plasmodium berghei thioredoxin reductase, putative Get druggable targets OG5_126785 All targets in OG5_126785
Entamoeba histolytica Ulp1 protease family, C-terminal catalytic domain containing protein Get druggable targets OG5_131076 All targets in OG5_131076
Candida albicans one of three potential ubiquitin-like protein-specific protease genes Get druggable targets OG5_129942 All targets in OG5_129942
Leishmania infantum trypanothione reductase Get druggable targets OG5_126785 All targets in OG5_126785
Echinococcus granulosus expressed conserved protein Get druggable targets OG5_131076 All targets in OG5_131076
Cryptosporidium parvum protein with 4 PHD domains plus a SET domain and associated cysteine cluster at the C-terminus Get druggable targets OG5_130029 All targets in OG5_130029
Giardia lamblia Fructose-bisphosphate aldolase Get druggable targets OG5_129214 All targets in OG5_129214
Mycobacterium tuberculosis NADPH-dependent mycothiol reductase Mtr Get druggable targets OG5_126785 All targets in OG5_126785
Echinococcus multilocularis expressed conserved protein Get druggable targets OG5_131076 All targets in OG5_131076
Trichomonas vaginalis Clan CE, family C48, Ulp1-like cysteine peptidase Get druggable targets OG5_129942 All targets in OG5_129942
Echinococcus multilocularis caspase Get druggable targets OG5_130238 All targets in OG5_130238
Leishmania mexicana trypanothione reductase Get druggable targets OG5_126785 All targets in OG5_126785
Schistosoma japonicum Histone-lysine N-methyltransferase NSD3, putative Get druggable targets OG5_130029 All targets in OG5_130029
Toxoplasma gondii thioredoxin reductase Get druggable targets OG5_126785 All targets in OG5_126785
Schistosoma japonicum ko:K05302 histone-lysine N-methyltransferase [EC2.1.1.43], putative Get druggable targets OG5_130029 All targets in OG5_130029
Schistosoma mansoni caspase-3 (C14 family) Get druggable targets OG5_130238 All targets in OG5_130238
Trichomonas vaginalis fructose-bisphosphate aldolase, putative Get druggable targets OG5_129214 All targets in OG5_129214
Theileria parva thioredoxin reductase, putative Get druggable targets OG5_126785 All targets in OG5_126785
Brugia malayi Ulp1 protease family, C-terminal catalytic domain containing protein Get druggable targets OG5_129942 All targets in OG5_129942
Cryptosporidium hominis hypothetical protein Get druggable targets OG5_130029 All targets in OG5_130029
Echinococcus multilocularis histone lysine N methyltransferase NSD3 Get druggable targets OG5_130029 All targets in OG5_130029
Trichomonas vaginalis Sentrin-specific protease, putative Get druggable targets OG5_129942 All targets in OG5_129942
Loa Loa (eye worm) thioredoxin reductase Get druggable targets OG5_126785 All targets in OG5_126785
Echinococcus granulosus sentrin specific protease 8 Get druggable targets OG5_129942 All targets in OG5_129942
Echinococcus granulosus sentrin specific protease 7 Get druggable targets OG5_131076 All targets in OG5_131076
Cryptosporidium hominis thioredoxin reductase Get druggable targets OG5_126785 All targets in OG5_126785
Neospora caninum hypothetical protein Get druggable targets OG5_129942 All targets in OG5_129942
Brugia malayi Thioredoxin reductase Get druggable targets OG5_126785 All targets in OG5_126785
Leishmania braziliensis trypanothione reductase Get druggable targets OG5_126785 All targets in OG5_126785
Trichomonas vaginalis Clan CE, family C48, Ulp1-like cysteine peptidase Get druggable targets OG5_129942 All targets in OG5_129942
Trypanosoma brucei trypanothione reductase Get druggable targets OG5_126785 All targets in OG5_126785
Schistosoma mansoni family C48 unassigned peptidase (C48 family) Get druggable targets OG5_129942 All targets in OG5_129942
Treponema pallidum fructose-bisphosphate aldolase Get druggable targets OG5_129214 All targets in OG5_129214
Neospora caninum Glutathione reductase, related Get druggable targets OG5_126785 All targets in OG5_126785
Trypanosoma cruzi hypothetical protein Get druggable targets OG5_129942 All targets in OG5_129942
Neospora caninum MGC84926 protein, related Get druggable targets OG5_126785 All targets in OG5_126785
Schistosoma mansoni family C48 unassigned peptidase (C48 family) Get druggable targets OG5_131076 All targets in OG5_131076
Echinococcus multilocularis caspase 3, apoptosis cysteine peptidase Get druggable targets OG5_130238 All targets in OG5_130238
Schistosoma mansoni SET domain protein Get druggable targets OG5_130029 All targets in OG5_130029
Schistosoma japonicum ko:K08597 sentrin-specific protease 8, putative Get druggable targets OG5_129942 All targets in OG5_129942
Trichomonas vaginalis fructose-bisphosphate aldolase, putative Get druggable targets OG5_129214 All targets in OG5_129214
Candida albicans similar to S. cerevisiae GLR1 (YPL091W) glutathione oxidoreductase Get druggable targets OG5_126785 All targets in OG5_126785
Entamoeba histolytica fructose-1,6-bisphosphate aldolase, putative Get druggable targets OG5_129214 All targets in OG5_129214
Plasmodium knowlesi thioredoxin reductase, putative Get druggable targets OG5_126785 All targets in OG5_126785
Schistosoma japonicum ko:K04397 caspase 7, apoptosis-related cysteine protease, putative Get druggable targets OG5_130238 All targets in OG5_130238
Trypanosoma cruzi trypanothione reductase, putative Get druggable targets OG5_126785 All targets in OG5_126785
Entamoeba histolytica fructose-1,6-bisphosphate aldolase, putative Get druggable targets OG5_129214 All targets in OG5_129214
Loa Loa (eye worm) Ulp1 protease Get druggable targets OG5_129942 All targets in OG5_129942
Trichomonas vaginalis fructose-bisphosphate aldolase, putative Get druggable targets OG5_129214 All targets in OG5_129214
Echinococcus granulosus histone lysine N methyltransferase NSD3 Get druggable targets OG5_130029 All targets in OG5_130029
Babesia bovis thiodoxin reductase, putative Get druggable targets OG5_126785 All targets in OG5_126785
Trypanosoma brucei gambiense trypanothione reductase, putative Get druggable targets OG5_126785 All targets in OG5_126785
Plasmodium vivax glutathione reductase, putative Get druggable targets OG5_126785 All targets in OG5_126785
Echinococcus granulosus caspase 3 apoptosis cysteine peptidase Get druggable targets OG5_130238 All targets in OG5_130238
Schistosoma japonicum ko:K00384 thioredoxin reductase (NADPH) [EC1.8.1.9], putative Get druggable targets OG5_126785 All targets in OG5_126785
Leishmania major trypanothione reductase Get druggable targets OG5_126785 All targets in OG5_126785
Plasmodium falciparum glutathione reductase Get druggable targets OG5_126785 All targets in OG5_126785
Loa Loa (eye worm) glutathione reductase Get druggable targets OG5_126785 All targets in OG5_126785
Trichomonas vaginalis fructose-bisphosphate aldolase, putative Get druggable targets OG5_129214 All targets in OG5_129214
Leishmania donovani trypanothione reductase Get druggable targets OG5_126785 All targets in OG5_126785
By sequence similarity to non orthologous known druggable targets
Species Potential target Known druggable target Length Alignment span Identity
Plasmodium falciparum sentrin-specific protease 1 SUMO/sentrin specific peptidase family member 8 212 aa 197 aa 23.4 %
Plasmodium berghei dihydrolipoyl dehydrogenase, mitochondrial, putative Thioredoxin reductase 1, cytoplasmic   499 aa 465 aa 26.9 %
Trypanosoma congolense dihydrolipoamide dehydrogenase, putative Thioredoxin reductase 1, cytoplasmic   499 aa 492 aa 23.2 %
Plasmodium falciparum thioredoxin reductase Thioredoxin reductase 1, cytoplasmic   499 aa 511 aa 45.2 %
Plasmodium falciparum dihydrolipoyl dehydrogenase, mitochondrial Thioredoxin reductase 1, cytoplasmic   499 aa 465 aa 27.3 %
Toxoplasma gondii NADPH-glutathione reductase Thioredoxin reductase 1, cytoplasmic   499 aa 529 aa 31.8 %
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative Thioredoxin reductase 1, cytoplasmic   499 aa 483 aa 23.0 %
Leishmania donovani acetoin dehydrogenase e3 component-like protein Thioredoxin reductase 1, cytoplasmic   499 aa 497 aa 24.1 %
Trypanosoma brucei dihydrolipoamide dehydrogenase, point mutation Thioredoxin reductase 1, cytoplasmic   499 aa 490 aa 23.5 %
Mycobacterium leprae Probable fructose bisphosphate aldolase Fba Putative fructose-1,6-bisphosphate aldolase   323 aa 361 aa 25.8 %
Trypanosoma congolense dihydrolipoamide dehydrogenase, putative Thioredoxin reductase 1, cytoplasmic   499 aa 492 aa 23.2 %
Plasmodium falciparum glutathione reductase Thioredoxin reductase 1, cytoplasmic   499 aa 500 aa 32.2 %
Plasmodium berghei dihydrolipoyl dehydrogenase, apicoplast, putative Thioredoxin reductase 1, cytoplasmic   499 aa 539 aa 22.3 %
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative Thioredoxin reductase 1, cytoplasmic   499 aa 489 aa 22.9 %
Plasmodium yoelii dihydrolipoamide dehydrogenase Thioredoxin reductase 1, cytoplasmic   499 aa 465 aa 27.5 %
Trypanosoma brucei gambiense dihydrolipoamide dehydrogenase, putative,acetoin dehydrogenase e3 component, putative Thioredoxin reductase 1, cytoplasmic   499 aa 491 aa 23.2 %
Leishmania braziliensis dihydrolipoamide dehydrogenase Thioredoxin reductase 1, cytoplasmic   499 aa 488 aa 21.9 %
Plasmodium knowlesi dihydrolipoyl dehydrogenase, apicoplast, putative Thioredoxin reductase 1, cytoplasmic   499 aa 519 aa 23.7 %
Trypanosoma brucei dihydrolipoamide dehydrogenase Thioredoxin reductase 1, cytoplasmic   499 aa 492 aa 23.4 %
Toxoplasma gondii pyruvate dehydrogenase complex subunit PDH-E3II Thioredoxin reductase 1, cytoplasmic   499 aa 448 aa 27.2 %
Candida albicans fructose-bisphosphate aldolase Putative fructose-1,6-bisphosphate aldolase   323 aa 358 aa 22.6 %
Plasmodium falciparum dihydrolipoyl dehydrogenase, apicoplast Thioredoxin reductase 1, cytoplasmic   499 aa 506 aa 23.7 %
Neospora caninum Dihydrolipoyl dehydrogenase (EC 1.8.1.4), related Thioredoxin reductase 1, cytoplasmic   499 aa 464 aa 24.8 %
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative Thioredoxin reductase 1, cytoplasmic   499 aa 483 aa 23.0 %
Leishmania braziliensis 2-oxoglutarate dehydrogenase, e3 component, lipoamidedehydrogenase-like protein Thioredoxin reductase 1, cytoplasmic   499 aa 450 aa 25.6 %
Leishmania braziliensis acetoin dehydrogenase e3 component-like protein Thioredoxin reductase 1, cytoplasmic   499 aa 499 aa 22.8 %
Trypanosoma brucei gambiense dihydrolipoamide dehydrogenase, putative Thioredoxin reductase 1, cytoplasmic   499 aa 491 aa 23.6 %
Plasmodium vivax dihydrolipoyl dehydrogenase, mitochondrial, putative Thioredoxin reductase 1, cytoplasmic   499 aa 460 aa 25.4 %
Leishmania donovani dihydrolipoamide dehydrogenase, putative Thioredoxin reductase 1, cytoplasmic   499 aa 466 aa 20.6 %
Neospora caninum glutathione reductase, putative Thioredoxin reductase 1, cytoplasmic   499 aa 492 aa 32.7 %
Leishmania mexicana acetoin dehydrogenase e3 component-like protein Thioredoxin reductase 1, cytoplasmic   499 aa 499 aa 24.4 %
Mycobacterium ulcerans fructose-bisphosphate aldolase Putative fructose-1,6-bisphosphate aldolase   323 aa 361 aa 26.9 %
Trypanosoma congolense dihydrolipoamide dehydrogenase, point mutation Thioredoxin reductase 1, cytoplasmic   499 aa 489 aa 22.5 %
Leishmania infantum acetoin dehydrogenase e3 component-like protein Thioredoxin reductase 1, cytoplasmic   499 aa 497 aa 24.1 %
Leishmania mexicana 2-oxoglutarate dehydrogenase, e3 component, lipoamidedehydrogenase-like protein Thioredoxin reductase 1, cytoplasmic   499 aa 452 aa 25.7 %
Plasmodium yoelii dihydrolipoamide dehydrogenase Thioredoxin reductase 1, cytoplasmic   499 aa 540 aa 23.3 %
Trypanosoma brucei gambiense dihydrolipoamide dehydrogenase, point mutation,acetoin dehydrogenase e3 component, putative Thioredoxin reductase 1, cytoplasmic   499 aa 490 aa 23.3 %
Brugia malayi Cell death protein 3 precursor caspase 3, apoptosis-related cysteine peptidase 277 aa 253 aa 38.7 %
Leishmania major 2-oxoglutarate dehydrogenase, e3 component, lipoamidedehydrogenase-like protein Thioredoxin reductase 1, cytoplasmic   499 aa 454 aa 25.3 %
Mycobacterium tuberculosis Probable fructose-bisphosphate aldolase Fba Putative fructose-1,6-bisphosphate aldolase   323 aa 361 aa 25.5 %
Onchocerca volvulus Thioredoxin reductase 1, cytoplasmic   499 aa 499 aa 57.3 %
Neospora caninum hypothetical protein Thioredoxin reductase 1, cytoplasmic   499 aa 448 aa 27.0 %
Trypanosoma congolense dihydrolipoamide dehydrogenase, point mutation, putative Thioredoxin reductase 1, cytoplasmic   499 aa 489 aa 22.7 %
Candida albicans fructose-bisphosphate aldolase Putative fructose-1,6-bisphosphate aldolase   323 aa 358 aa 22.6 %
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative Thioredoxin reductase 1, cytoplasmic   499 aa 489 aa 22.7 %
Leishmania infantum dihydrolipoamide dehydrogenase, putative Thioredoxin reductase 1, cytoplasmic   499 aa 466 aa 20.6 %
Trypanosoma congolense dihydrolipoamide dehydrogenase, point mutation Thioredoxin reductase 1, cytoplasmic   499 aa 489 aa 22.3 %
Plasmodium knowlesi dihydrolipoyl dehydrogenase, mitochondrial, putative Thioredoxin reductase 1, cytoplasmic   499 aa 462 aa 25.8 %
Leishmania major acetoin dehydrogenase e3 component-like protein Thioredoxin reductase 1, cytoplasmic   499 aa 497 aa 24.1 %
Plasmodium vivax dihydrolipoyl dehydrogenase, apicoplast, putative Thioredoxin reductase 1, cytoplasmic   499 aa 518 aa 24.9 %
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0019 0.007 0.007
Brugia malayi Nuclear hormone receptor family member nhr-3 0.0019 0.007 0.007
Brugia malayi Nuclear hormone receptor family member nhr-31 0.0019 0.007 0.007
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0044 0.045 0.0384
Echinococcus multilocularis inositol monophosphatase 1 0.004 0.0384 0.0317
Trypanosoma cruzi myo-inositol-1(or 4)-monophosphatase 1, putative 0.004 0.0384 0.2205
Mycobacterium tuberculosis Probable fructose-bisphosphate aldolase Fba 0.0172 0.2383 1
Onchocerca volvulus 0.0037 0.0344 0.3618
Echinococcus granulosus nuclear receptor co repressor related ncor 0.0298 0.4283 0.4242
Mycobacterium ulcerans peptide amidase, GatA 0.0082 0.1013 0.4053
Plasmodium vivax hypothetical protein, conserved 0.0032 0.0264 0.1982
Trypanosoma brucei SUMO1/Ulp2, putative 0.0047 0.0486 0.4356
Plasmodium falciparum metacaspase-like protein 0.0032 0.0264 0.1982
Schistosoma mansoni caspase-3 (C14 family) 0.012 0.159 0.1531
Trypanosoma cruzi PAB1-binding protein , putative 0.0024 0.015 0.0509
Trypanosoma brucei fatty-acid amide hydrolase, putative 0.0082 0.1013 1
Echinococcus granulosus muscleblind protein 0.0162 0.2221 0.2167
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0353 0.5109 1
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0044 0.045 0.0384
Leishmania major hypothetical protein, conserved 0.0082 0.1013 1
Echinococcus granulosus caspase 3 apoptosis cysteine peptidase 0.012 0.159 0.1531
Loa Loa (eye worm) Ulp1 protease 0.0111 0.1462 0.1402
Schistosoma mansoni family C48 unassigned peptidase (C48 family) 0.0047 0.0486 0.0419
Leishmania major hypothetical protein, conserved 0.0024 0.015 0.0754
Trichomonas vaginalis conserved hypothetical protein 0.0032 0.0264 0.0368
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0353 0.5109 1
Loa Loa (eye worm) hypothetical protein 0.0677 1 1
Echinococcus multilocularis muscleblind protein 1 0.0162 0.2221 0.2167
Schistosoma mansoni hypothetical protein 0.0037 0.0344 0.0276
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0353 0.5109 1
Trypanosoma cruzi cysteine peptidase, Clan CA, family C48, putative 0.0047 0.0486 0.2943
Schistosoma mansoni subfamily C14A unassigned peptidase (C14 family) 0.0032 0.0264 0.0196
Echinococcus granulosus caspase 0.012 0.159 0.1531
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0019 0.007 0.007
Entamoeba histolytica Ulp1 protease family, C-terminal catalytic domain containing protein 0.0047 0.0486 0.0216
Trichomonas vaginalis Clan CE, family C48, Ulp1-like cysteine peptidase 0.0047 0.0486 0.0809
Toxoplasma gondii ICE family protease (caspase) p20 domain-containing protein 0.0032 0.0264 0.3287
Trypanosoma cruzi trypanothione reductase, putative 0.0057 0.0643 0.4075
Trichomonas vaginalis Clan CE, family C48, Ulp1-like cysteine peptidase 0.0047 0.0486 0.0809
Echinococcus multilocularis apoptotic protease activating factor 1 0.0037 0.0344 0.0276
Chlamydia trachomatis deubiquitinase/deneddylase Dub1 0.0047 0.0486 0.4356
Trichomonas vaginalis Clan CE, family C48, Ulp1-like cysteine peptidase 0.0047 0.0486 0.0809
Trypanosoma cruzi PAB1-binding protein , putative 0.0024 0.015 0.0509
Echinococcus granulosus sentrin specific protease 8 0.0111 0.1462 0.1402
Plasmodium vivax metacaspase 1, putative 0.0032 0.0264 0.1982
Echinococcus multilocularis caspase 3 0.0088 0.1106 0.1044
Mycobacterium tuberculosis Probable amidase AmiA2 (aminohydrolase) 0.0082 0.1013 0.4053
Wolbachia endosymbiont of Brugia malayi aspartyl/glutamyl-tRNA amidotransferase subunit A 0.0082 0.1013 1
Brugia malayi mucosa associated lymphoid tissue lymphoma translocation protein 1 0.0032 0.0264 0.0264
Trypanosoma brucei trypanothione reductase 0.0057 0.0643 0.6031
Mycobacterium tuberculosis Putative ferredoxin reductase 0.013 0.1747 0.7238
Trichomonas vaginalis Clan CD, family C14, metacaspase-like cysteine peptidase 0.0032 0.0264 0.0368
Echinococcus granulosus caspase 2 0.0069 0.0828 0.0763
Brugia malayi Thioredoxin reductase 0.0057 0.0643 0.0643
Brugia malayi Muscleblind-like protein 0.0162 0.2221 0.2221
Toxoplasma gondii ICE family protease (caspase) p20 domain-containing protein 0.0032 0.0264 0.3287
Toxoplasma gondii Ulp1 protease family, C-terminal catalytic domain-containing protein 0.0047 0.0486 0.7223
Trichomonas vaginalis myo inositol monophosphatase, putative 0.004 0.0384 0.0606
Loa Loa (eye worm) hypothetical protein 0.0162 0.2221 0.2167
Trichomonas vaginalis conserved hypothetical protein 0.0032 0.0264 0.0368
Brugia malayi Nuclear hormone receptor family member nhr-14 0.0019 0.007 0.007
Brugia malayi Inositol-1 0.004 0.0384 0.0384
Trichomonas vaginalis Clan CD, family C14, metacaspase-like cysteine peptidase 0.0032 0.0264 0.0368
Giardia lamblia Sentrin specific protease, putative 0.0047 0.0486 0.0809
Mycobacterium leprae PROBABLE NADH DEHYDROGENASE NDH 0.013 0.1747 0.6914
Echinococcus multilocularis sentrin specific protease 8 0.0111 0.1462 0.1402
Giardia lamblia Fructose-bisphosphate aldolase 0.0353 0.5109 1
Trichomonas vaginalis Clan CD, family C14, metacaspase-like cysteine peptidase 0.0032 0.0264 0.0368
Echinococcus multilocularis fatty acid amide hydrolase 1 0.0082 0.1013 0.095
Echinococcus multilocularis caspase 0.012 0.159 0.1531
Schistosoma mansoni amidase 0.0677 1 1
Trypanosoma brucei metacaspase MCA2 0.0032 0.0264 0.1982
Trichomonas vaginalis conserved hypothetical protein 0.0032 0.0264 0.0368
Echinococcus multilocularis glutamyl tRNA(Gln) amidotransferase subunit A 0.0082 0.1013 0.095
Mycobacterium ulcerans amidase 0.0082 0.1013 0.4053
Treponema pallidum fructose-bisphosphate aldolase 0.0353 0.5109 1
Plasmodium falciparum glutathione reductase 0.0057 0.0643 0.6031
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0353 0.5109 1
Mycobacterium tuberculosis Inositol-1-monophosphatase SuhB 0.0036 0.0321 0.1048
Trichomonas vaginalis conserved hypothetical protein 0.0047 0.0486 0.0809
Schistosoma mansoni family C48 unassigned peptidase (C48 family) 0.0111 0.1462 0.1402
Loa Loa (eye worm) hypothetical protein 0.0162 0.2221 0.2167
Echinococcus multilocularis nuclear receptor co repressor related (ncor) 0.0298 0.4283 0.4242
Loa Loa (eye worm) hypothetical protein 0.0032 0.0264 0.0196
Brugia malayi Steroid receptor seven-up type 2 0.0019 0.007 0.007
Brugia malayi Ulp1 protease family, C-terminal catalytic domain containing protein 0.0047 0.0486 0.0486
Brugia malayi Nuclear hormone receptor family member nhr-1 0.0019 0.007 0.007
Trichomonas vaginalis conserved hypothetical protein 0.0032 0.0264 0.0368
Trypanosoma cruzi metacaspase, putative 0.0032 0.0264 0.1339
Leishmania major SUMO1/Ulp2, putative,cysteine peptidase, Clan CA, family C48, putative 0.0047 0.0486 0.4356
Toxoplasma gondii Ulp1 protease family, C-terminal catalytic domain-containing protein 0.0047 0.0486 0.7223
Loa Loa (eye worm) amidase 0.0082 0.1013 0.095
Echinococcus multilocularis neuropeptide receptor A26 0.0502 0.7356 0.7337
Trypanosoma cruzi metacaspase, putative 0.0032 0.0264 0.1339
Echinococcus granulosus inositol monophosphatase 1 0.004 0.0384 0.0317
Loa Loa (eye worm) hypothetical protein 0.0047 0.0486 0.0419
Echinococcus multilocularis histone lysine N methyltransferase NSD3 0.004 0.0378 0.0311
Leishmania major metacaspase, putative 0.0032 0.0264 0.1982
Brugia malayi Ulp1 protease family, C-terminal catalytic domain containing protein 0.0111 0.1462 0.1462
Mycobacterium tuberculosis Probable oxidoreductase 0.0145 0.1966 0.819
Mycobacterium ulcerans aspartyl/glutamyl-tRNA amidotransferase subunit A 0.0082 0.1013 0.4053
Mycobacterium tuberculosis Probable amidase AmiB2 (aminohydrolase) 0.0082 0.1013 0.4053
Toxoplasma gondii ICE family protease (caspase) p20 domain-containing protein 0.0032 0.0264 0.3287
Plasmodium falciparum ataxin-2 like protein, putative 0.0024 0.015 0.0754
Brugia malayi hypothetical protein 0.0016 0.0019 0.0019
Brugia malayi nuclear receptor NHR-88 0.0019 0.007 0.007
Echinococcus granulosus neuropeptide s receptor 0.0502 0.7356 0.7337
Mycobacterium tuberculosis NAD(P)H quinone reductase LpdA 0.0145 0.1966 0.819
Plasmodium falciparum glutamyl-tRNA(Gln) amidotransferase subunit A 0.0082 0.1013 1
Brugia malayi glutathione reductase 0.0057 0.0643 0.0643
Echinococcus multilocularis caspase 3, apoptosis cysteine peptidase 0.012 0.159 0.1531
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0044 0.045 0.0384
Mycobacterium tuberculosis Probable dehydrogenase 0.013 0.1747 0.7238
Trypanosoma cruzi metacaspase 5, putative 0.0032 0.0264 0.1339
Loa Loa (eye worm) amidase 0.0082 0.1013 0.095
Plasmodium falciparum thioredoxin reductase 0.0057 0.0643 0.6031
Brugia malayi putative amidase 0.0082 0.1013 0.1013
Trypanosoma brucei Metacaspase-4 0.0032 0.0264 0.1982
Trichomonas vaginalis Clan CE, family C48, Ulp1-like cysteine peptidase 0.0047 0.0486 0.0809
Schistosoma mansoni dihydrolipoamide dehydrogenase 0.002 0.0079 0.001
Mycobacterium tuberculosis NADPH-dependent mycothiol reductase Mtr 0.0057 0.0643 0.2445
Mycobacterium tuberculosis Probable amidase AmiC (aminohydrolase) 0.0082 0.1013 0.4053
Mycobacterium ulcerans amidase 0.0082 0.1013 0.4053
Mycobacterium ulcerans amidase 0.0082 0.1013 0.4053
Brugia malayi Cell death protein 3 precursor 0.0069 0.0828 0.0828
Trypanosoma cruzi SUMO1/Ulp2, putative 0.0047 0.0486 0.2943
Toxoplasma gondii Ulp1 protease family, C-terminal catalytic domain-containing protein 0.0047 0.0486 0.7223
Brugia malayi Nuclear hormone receptor-like 1 0.0019 0.007 0.007
Trichomonas vaginalis Clan CD, family C14, metacaspase-like cysteine peptidase 0.0032 0.0264 0.0368
Entamoeba histolytica fructose-1,6-bisphosphate aldolase, putative 0.0353 0.5109 1
Brugia malayi Ulp1 protease family, C-terminal catalytic domain containing protein 0.0047 0.0486 0.0486
Echinococcus multilocularis sentrin specific protease 7 0.021 0.2944 0.2894
Echinococcus granulosus neuropeptide receptor A26 0.0502 0.7356 0.7337
Plasmodium vivax sentrin-specific protease 2, putative 0.0047 0.0486 0.4356
Echinococcus granulosus apoptotic protease activating factor 1 0.0037 0.0344 0.0276
Treponema pallidum aspartyl/glutamyl-tRNA amidotransferase subunit A 0.0082 0.1013 0.1857
Leishmania major myo-inositol-1(or 4)-monophosphatase 1, putative 0.004 0.0384 0.3263
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0353 0.5109 1
Mycobacterium tuberculosis Probable membrane NADH dehydrogenase NdhA 0.013 0.1747 0.7238
Trichomonas vaginalis conserved hypothetical protein 0.0032 0.0264 0.0368
Echinococcus multilocularis caspase 8 0.0032 0.0264 0.0196
Mycobacterium ulcerans amidase 0.0082 0.1013 0.4053
Echinococcus multilocularis fatty acid amide hydrolase 1 0.0677 1 1
Echinococcus granulosus histone lysine N methyltransferase NSD3 0.004 0.0378 0.0311
Loa Loa (eye worm) Ulp1 protease 0.0047 0.0486 0.0419
Trypanosoma brucei inositol-1(or 4)-monophosphatase 1, putative 0.004 0.0384 0.3263
Wolbachia endosymbiont of Brugia malayi fructose-1,6-bisphosphatase 0.004 0.0384 0.3263
Onchocerca volvulus 0.0047 0.0486 0.5494
Trichomonas vaginalis myo inositol monophosphatase, putative 0.004 0.0384 0.0606
Brugia malayi Amidase family protein 0.0082 0.1013 0.1013
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0044 0.045 0.045
Echinococcus granulosus fatty acid amide hydrolase 1 0.0677 1 1
Loa Loa (eye worm) hypothetical protein 0.0047 0.0486 0.0419
Trypanosoma cruzi hypothetical protein 0.0111 0.1462 1
Mycobacterium ulcerans extragenic suppressor protein SuhB 0.004 0.0384 0.1323
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0044 0.045 0.0384
Loa Loa (eye worm) hypothetical protein 0.0069 0.0828 0.0763
Trypanosoma brucei metacaspase 0.0032 0.0264 0.1982
Trichomonas vaginalis Clan CD, family C14, metacaspase-like cysteine peptidase 0.0032 0.0264 0.0368
Echinococcus multilocularis expressed conserved protein 0.0163 0.2238 0.2184
Mycobacterium leprae Probable fructose bisphosphate aldolase Fba 0.0172 0.2383 1
Plasmodium vivax thioredoxin reductase, putative 0.0057 0.0643 0.6031
Mycobacterium tuberculosis Probable amidase AmiD (acylamidase) (acylase) 0.0082 0.1013 0.4053
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0019 0.007 0.007
Mycobacterium tuberculosis Possible amidase (aminohydrolase) 0.0082 0.1013 0.4053
Trichomonas vaginalis Clan CE, family C48, Ulp1-like cysteine peptidase 0.0111 0.1462 0.2748
Schistosoma mansoni fatty-acid amide hydrolase 0.0082 0.1013 0.095
Echinococcus granulosus thioredoxin glutathione reductase 0.0057 0.0643 0.0577
Trichomonas vaginalis Clan CE, family C48, Ulp1-like cysteine peptidase 0.0047 0.0486 0.0809
Toxoplasma gondii thioredoxin reductase 0.0057 0.0643 1
Echinococcus granulosus sentrin specific protease 7 0.021 0.2944 0.2894
Brugia malayi dihydrolipoyl dehydrogenase, mitochondrial precursor, putative 0.002 0.0079 0.0079
Echinococcus multilocularis caspase 2 0.0069 0.0828 0.0763
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0044 0.045 0.0384
Trichomonas vaginalis Clan CE, family C48, Ulp1-like cysteine peptidase 0.0047 0.0486 0.0809
Echinococcus granulosus caspase 3 0.0088 0.1106 0.1044
Trichomonas vaginalis Sentrin-specific protease, putative 0.0111 0.1462 0.2748
Trichomonas vaginalis Clan CD, family C14, metacaspase-like cysteine peptidase 0.0032 0.0264 0.0368
Brugia malayi steroid hormone receptor 0.0019 0.007 0.007
Brugia malayi Nuclear hormone receptor family member nhr-40 0.0019 0.007 0.007
Brugia malayi photoreceptor-specific nuclear receptor 0.0275 0.3927 0.3927
Schistosoma mansoni inositol monophosphatase 0.004 0.0384 0.0317
Trypanosoma cruzi myo-inositol-1(or 4)-monophosphatase 1, putative 0.004 0.0384 0.2205
Echinococcus multilocularis thioredoxin glutathione reductase 0.0057 0.0643 0.0577
Mycobacterium ulcerans fructose-bisphosphate aldolase 0.0172 0.2383 1
Toxoplasma gondii inositol(myo)-1(or 4)-monophosphatase 2, putative 0.004 0.0384 0.5411
Echinococcus multilocularis sentrin specific protease 1 0.0047 0.0486 0.0419
Schistosoma mansoni caspase-7 (C14 family) 0.0069 0.0828 0.0763
Schistosoma mansoni inositol monophosphatase 0.004 0.0384 0.0317
Plasmodium falciparum ataxin-2 like protein, putative 0.0024 0.015 0.0754
Loa Loa (eye worm) hypothetical protein 0.0047 0.0486 0.0419
Toxoplasma gondii LsmAD domain-containing protein 0.0024 0.015 0.125
Echinococcus multilocularis dihydrolipoamide dehydrogenase 0.002 0.0079 0.001
Echinococcus multilocularis fatty acid amide hydrolase 1 0.0677 1 1
Loa Loa (eye worm) glutathione reductase 0.0057 0.0643 0.0577
Trypanosoma cruzi metacaspase, putative 0.0032 0.0264 0.1339
Plasmodium vivax ataxin-2 like protein, putative 0.0024 0.015 0.0754
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0353 0.5109 1
Schistosoma mansoni family C48 unassigned peptidase (C48 family) 0.021 0.2944 0.2894
Entamoeba histolytica Ulp1 protease family, C-terminal catalytic domain containing protein 0.0047 0.0486 0.0216
Leishmania major trypanothione reductase 0.0057 0.0643 0.6031
Onchocerca volvulus Cell death protein 3 homolog 0.0069 0.0828 1
Loa Loa (eye worm) hypothetical protein 0.0037 0.0344 0.0276
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0353 0.5109 1
Trichomonas vaginalis Clan CD, family C14, metacaspase-like cysteine peptidase 0.0032 0.0264 0.0368
Trypanosoma cruzi metacaspase, putative 0.0032 0.0264 0.1339
Trypanosoma brucei PAB1-binding protein , putative 0.0024 0.015 0.0754
Entamoeba histolytica Ulp1 protease family, C-terminal catalytic domain containing protein 0.0047 0.0486 0.0216
Chlamydia trachomatis deubiquitinase/deneddylase Dub2 0.0047 0.0486 0.4356
Entamoeba histolytica fructose-1,6-bisphosphate aldolase, putative 0.0353 0.5109 1
Trichomonas vaginalis inositol monophosphatase, putative 0.004 0.0384 0.0606
Trypanosoma cruzi amidase, putative 0.0082 0.1013 0.6757
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0044 0.045 0.0384
Trichomonas vaginalis conserved hypothetical protein 0.0032 0.0264 0.0368
Chlamydia trachomatis glutamyl-tRNA(Gln) amidotransferase subunit A 0.0082 0.1013 1
Schistosoma mansoni caspase-7 (C14 family) 0.012 0.159 0.1531
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0019 0.007 0.007
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0353 0.5109 1
Echinococcus granulosus fatty acid amide hydrolase 1 0.0677 1 1
Plasmodium falciparum metacaspase 1 0.0032 0.0264 0.1982
Echinococcus granulosus sentrin specific protease 1 0.0047 0.0486 0.0419
Mycobacterium tuberculosis Probable nitrite reductase [NAD(P)H] large subunit [FAD flavoprotein] NirB 0.013 0.1747 0.7238
Plasmodium falciparum sentrin-specific protease 1 0.0047 0.0486 0.4356
Loa Loa (eye worm) hypothetical protein 0.0024 0.015 0.0081
Echinococcus granulosus glutamyl tRNAGln amidotransferase subunit A 0.0082 0.1013 0.095
Schistosoma mansoni family C48 unassigned peptidase (C48 family) 0.0047 0.0486 0.0419
Trypanosoma cruzi metacaspase 5, putative 0.0032 0.0264 0.1339
Entamoeba histolytica Ulp1 protease family, C-terminal catalytic domain containing protein 0.0111 0.1462 0.228
Mycobacterium leprae PROBABLE GLUTAMYL-TRNA(GLN) AMIDOTRANSFERASE (SUBUNIT A) GATA (Glu-ADT SUBUNIT A) 0.0082 0.1013 0.3357
Echinococcus multilocularis neuropeptide s receptor 0.0502 0.7356 0.7337
Schistosoma mansoni SET domain protein 0.004 0.0378 0.0311
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0044 0.045 0.0384
Loa Loa (eye worm) hypothetical protein 0.0275 0.3927 0.3884
Brugia malayi nuclear hormone receptor 0.0019 0.007 0.007
Trypanosoma brucei metacaspase 5, putative 0.0032 0.0264 0.1982
Mycobacterium tuberculosis Probable NADH dehydrogenase Ndh 0.013 0.1747 0.7238
Echinococcus granulosus caspase 8 0.0032 0.0264 0.0196
Brugia malayi Nuclear hormone receptor family member nhr-41 0.0019 0.007 0.007
Loa Loa (eye worm) thioredoxin reductase 0.0057 0.0643 0.0577
Mycobacterium leprae DIHYDROLIPOAMIDE DEHYDROGENASE LPD (LIPOAMIDE REDUCTASE (NADH)) (LIPOYL DEHYDROGENASE) (DIHYDROLIPOYL DEHYDROGENASE) (DIAPHORASE 0.0145 0.1966 0.7978
Plasmodium vivax glutathione reductase, putative 0.0057 0.0643 0.6031
Entamoeba histolytica Ulp1 protease family, C-terminal catalytic domain containing protein 0.021 0.2944 0.5418
Mycobacterium tuberculosis Probable reductase 0.013 0.1747 0.7238
Brugia malayi Nuclear hormone receptor family member nhr-49 0.0019 0.007 0.007
Brugia malayi ecdysteroid receptor 0.0019 0.007 0.007
Schistosoma mansoni glutamyl-tRNA(Gln) amidotransferase subunit A 0.0082 0.1013 0.095
Mycobacterium tuberculosis Dihydrolipoamide dehydrogenase LpdC (lipoamide reductase (NADH)) (lipoyl dehydrogenase) (dihydrolipoyl dehydrogenase) (diaphoras 0.0145 0.1966 0.819
Trichomonas vaginalis Clan CE, family C48, Ulp1-like cysteine peptidase 0.0111 0.1462 0.2748
Brugia malayi Amidase family protein 0.0082 0.1013 0.1013
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0019 0.007 0.007
Trichomonas vaginalis Clan CD, family C14, metacaspase-like cysteine peptidase 0.0032 0.0264 0.0368
Mycobacterium leprae PROBABLE AMIDASE AMIC (AMINOHYDROLASE) 0.0082 0.1013 0.3357
Trichomonas vaginalis Clan CD, family C14, metacaspase-like cysteine peptidase 0.0032 0.0264 0.0368
Schistosoma mansoni fatty-acid amide hydrolase 0.0677 1 1
Trichomonas vaginalis sentrin/sumo-specific protease, senp8, putative 0.0047 0.0486 0.0809
Brugia malayi hypothetical protein 0.0024 0.015 0.015
Echinococcus multilocularis muscleblind protein 0.0162 0.2221 0.2167
Echinococcus granulosus expressed conserved protein 0.0163 0.2238 0.2184
Trypanosoma brucei metacaspase MCA3 0.0032 0.0264 0.1982
Trypanosoma cruzi amidase, putative 0.0082 0.1013 0.6757
Plasmodium vivax glutamyl-tRNA(Gln) amidotransferase subunit A, putative 0.0082 0.1013 1
Mycobacterium ulcerans amidase 0.0082 0.1013 0.4053
Brugia malayi Ulp1 protease family, C-terminal catalytic domain containing protein 0.0047 0.0486 0.0486
Brugia malayi hypothetical protein 0.0037 0.0344 0.0344
Echinococcus granulosus dihydrolipoamide dehydrogenase 0.002 0.0079 0.001
Loa Loa (eye worm) inositol-1 0.004 0.0384 0.0317
Echinococcus granulosus fatty acid amide hydrolase 1 0.0082 0.1013 0.095
Entamoeba histolytica Ulp1 protease family, C-terminal catalytic domain containing protein 0.0047 0.0486 0.0216
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0019 0.007 0.007
Plasmodium vivax sentrin-specific protease 1, putative 0.0047 0.0486 0.4356
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0044 0.045 0.0384
Trichomonas vaginalis Clan CE, family C48, Ulp1-like cysteine peptidase 0.0111 0.1462 0.2748

Activities

Activity type Activity value Assay description Source Reference
AC50 (binding) 9.24 uM PubChem BioAssay. Development of Small Molecule Probes of the Histone Methyltransferase, NSD2 Measured in Biochemical System Using Plate Reader - 7053-01_Inhibitor_Dose_CherryPick_Activity. (Class of assay: confirmatory) ChEMBL. No reference
AC50 (functional) = 127.887 uM PUBCHEM_BIOASSAY: HSF-1 induced GFP reporter and Doxycycline induced RFP reporter Measured in Cell-Based System Using Plate Reader - 2038-03_Inhibitor_DoseNoFile_CherryPick_Activity_Set3. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID2118] ChEMBL. No reference
AC50 (functional) > 380 uM PUBCHEM_BIOASSAY: Fluorescence Cell-Free Homogeneous Secondary Screen to Identify Inhibitors of DnaB-Intein Splicing Activity. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID2223, AID489010, AID492950] ChEMBL. No reference
AC50 (functional) > 380 uM PUBCHEM_BIOASSAY: Fluorescence Cell-Free Homogeneous Secondary Screen to Identify Non-Covalent Inhibitors of RecA-Intein Splicing Activity. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID2223, AID489010, AID492950] ChEMBL. No reference
EC50 (functional) = 75.1 uM PUBCHEM_BIOASSAY: Fluorescence Cell-Free Homogeneous Dose Retest to Identify Inhibitors of RecA-Intein Splicing Activity. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID2097, AID2223, AID489010, AID492950] ChEMBL. No reference
EC50 (functional) > 195 um PUBCHEM_BIOASSAY: Luminescence Cell-Based Dose Confirmation HTS to Identify Inhibitors of Heat Shock Factor 1 (HSF1). (Class of assay: confirmatory) [Related pubchem assays: 2118 (Project Summary), 2098 (Primary HTS)] ChEMBL. No reference
IC50 (functional) = 3.63 uM PUBCHEM_BIOASSAY: Dose Response confirmation of uHTS for inhibitors of Sentrin-specific protease 6 (SENP6) using a Luminescent assay. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID2575, AID2582, AID2599] ChEMBL. No reference
IC50 (functional) = 6.06 uM PUBCHEM_BIOASSAY: Dose Response confirmation of uHTS for inhibitors of Sentrin-specific protease 8 (SENP8) using a Luminescent assay. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID2540, AID2575, AID2582, AID434986] ChEMBL. No reference
IC50 (functional) = 7.53 uM PUBCHEM_BIOASSAY: Dose Response confirmation of uHTS for inhibitors of Sentrin-specific protease 7 (SENP7) using a Luminescent assay. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID434973, AID434986] ChEMBL. No reference
IC50 (functional) = 9.4 uM PUBCHEM_BIOASSAY: Dose Response confirmation of inhibitors of Sentrin-specific proteases (SENPs) using a Caspase-3 Selectivity assay. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID2540, AID2599, AID434973, AID489001] ChEMBL. No reference
IC50 (functional) = 14.8 uM PUBCHEM_BIOASSAY: Dose response confirmation of uHTS hits for Apaf-1 in a Fluorescent assay. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID489030, AID492945] ChEMBL. No reference
IC50 (functional) > 100 uM PUBCHEM_BIOASSAY: Dose Response validation of Inhibitors of Apaf-1 using a Fluorescent Interference Counterscreen assay. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID489030, AID492945] ChEMBL. No reference
Potency (functional) 3.1623 uM PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Mammalian Selenoprotein Thioredoxin Reductase 1 (TrxR1): qHTS. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488771] ChEMBL. No reference
Potency (functional) 4.1475 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) = 7.9245 um PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Fructose-1,6-bisphosphate Aldolase from Giardia Lamblia. (Class of assay: confirmatory) [Related pubchem assays: 2472, 2464 ] ChEMBL. No reference
Potency (functional) 10 uM PUBCHEM_BIOASSAY: qHTS for Inhibitors of TGF-b: Cytotox Counterscreen. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID588855, AID588860] ChEMBL. No reference
Potency (functional) 22.3872 uM PubChem BioAssay. Inhibitors of USP1/UAF1: Primary Screen. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) = 25.1189 um PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Human Jumonji Domain Containing 2E (JMJD2E). (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) = 25.1189 um PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of HADH2 (Hydroxyacyl-Coenzyme A Dehydrogenase, Type II). (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 25.1189 uM PUBCHEM_BIOASSAY: qHTS for Inhibitors of TGF-b. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID588856, AID588860] ChEMBL. No reference
Potency (functional) = 28.1838 um PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Aldehyde Dehydrogenase 1 (ALDH1A1). (Class of assay: confirmatory) [Related pubchem assays: 1030 (qHTS Validation Assay for Inhibitors of aldehyde dehydrogenase 1 (ALDH1A1))] ChEMBL. No reference
Potency (functional) 28.1838 uM PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Histone Lysine Methyltransferase G9a. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID504404] ChEMBL. No reference
Potency (functional) = 31.6228 um PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of HSD17B4, hydroxysteroid (17-beta) dehydrogenase 4. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) = 31.6228 um PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of HPGD (15-Hydroxyprostaglandin Dehydrogenase). (Class of assay: confirmatory) [Related pubchem assays: 2429 (Confirmation qHTS Assay for Inhibitors of HPGD (15-Hydroxyprostaglandin Dehydrogenase)), 2407 (Probe Development Summary for Inhibitors of HPGD (15-Hydroxyprostaglandin Dehydrogenase)), 2427 (Thermal Shift Assay for Inhibitors of HPGD (15-Hydroxyprostaglandin Dehydrogenase))] ChEMBL. No reference
Potency (functional) 35.4813 uM PUBCHEM_BIOASSAY: qHTS for Inhibitors of Polymerase Iota. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID588623] ChEMBL. No reference
Potency (functional) 44.6684 uM PUBCHEM_BIOASSAY: qHTS Assay for Substrates of Mammalian Selenoprotein Thioredoxin Reductase 1 (TrxR1): qHTS. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488771] ChEMBL. No reference

Phenotypes

Whole-cell/tissue/organism interactions

Species name Source Reference Is orphan
Plasmodium falciparum ChEMBL23
Homo sapiens 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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