Detailed information for compound 1624776

Basic information

Technical information
  • TDR Targets ID: 1624776
  • Name: N-[(3,5-dimethyl-1-phenylpyrazol-4-yl)methyli deneamino]-2-[3-(4-methylphenyl)-4-oxoquinazo lin-2-yl]sulfanylacetamide
  • MW: 522.621 | Formula: C29H26N6O2S
  • H donors: 1 H acceptors: 3 LogP: 5.49 Rotable bonds: 8
    Rule of 5 violations (Lipinski): 2
  • SMILES: O=C(CSc1nc2ccccc2c(=O)n1c1ccc(cc1)C)N/N=C/c1c(C)nn(c1C)c1ccccc1
  • InChi: 1S/C29H26N6O2S/c1-19-13-15-22(16-14-19)34-28(37)24-11-7-8-12-26(24)31-29(34)38-18-27(36)32-30-17-25-20(2)33-35(21(25)3)23-9-5-4-6-10-23/h4-17H,18H2,1-3H3,(H,32,36)/b30-17+
  • InChiKey: OTSGMDXAYRJERX-OCSSWDANSA-N  


Substructure search Similarity search

Network

Hover on a compound node to display the structore

Synonyms

  • N-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyleneamino]-2-[3-(4-methylphenyl)-4-oxo-quinazolin-2-yl]sulfanyl-acetamide
  • N-[(3,5-dimethyl-1-phenyl-4-pyrazolyl)methyleneamino]-2-[[3-(4-methylphenyl)-4-oxo-2-quinazolinyl]thio]acetamide
  • N-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyleneamino]-2-[[4-keto-3-(4-methylphenyl)quinazolin-2-yl]thio]acetamide
  • N-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methylideneamino]-2-[3-(4-methylphenyl)-4-oxo-quinazolin-2-yl]sulfanyl-ethanamide
  • STOCK3S-15765
  • (4-Oxo-3-p-tolyl-3,4-dihydro-quinazolin-2-ylsulfanyl)-acetic acid [1-(3,5-dimethyl-1-phenyl-1H-pyrazol-4-yl)-meth-(E)-ylidene]-hydrazide
  • MLS000590997
  • SMR000217814

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Escherichia coli penicillin-binding protein Starlite/ChEMBL No references
Homo sapiens GNAS complex locus Starlite/ChEMBL No references
Influenza A virus Nonstructural protein 1 Starlite/ChEMBL No references
Homo sapiens autophagy related 4B, cysteine peptidase Starlite/ChEMBL No references
Homo sapiens phospholipase A2, group IB (pancreas) Starlite/ChEMBL No references
Homo sapiens SMAD family member 2 Starlite/ChEMBL No references
Homo sapiens nuclear factor, erythroid 2-like 2 Starlite/ChEMBL No references
Homo sapiens ataxin 2 Starlite/ChEMBL No references
Homo sapiens lamin A/C Starlite/ChEMBL No references
Rattus norvegicus Thioredoxin reductase 1, cytoplasmic Starlite/ChEMBL No references
Homo sapiens aldehyde dehydrogenase 1 family, member A1 Starlite/ChEMBL No references

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Candida albicans aldehyde dehydrogenase Get druggable targets OG5_126638 All targets in OG5_126638
Plasmodium falciparum glutathione reductase Get druggable targets OG5_126785 All targets in OG5_126785
Schistosoma mansoni family C54 unassigned peptidase (C54 family) Get druggable targets OG5_127111 All targets in OG5_127111
Leishmania braziliensis AUT2/APG4/ATG4 cysteine peptidase, putative Get druggable targets OG5_127111 All targets in OG5_127111
Mycobacterium ulcerans aldehyde dehydrogenase Get druggable targets OG5_126638 All targets in OG5_126638
Schistosoma japonicum Aldehyde dehydrogenase X, mitochondrial precursor, putative Get druggable targets OG5_126638 All targets in OG5_126638
Trypanosoma cruzi AUT2/APG4/ATG4 cysteine peptidase, putative Get druggable targets OG5_127111 All targets in OG5_127111
Schistosoma japonicum ko:K07611 lamin, putative Get druggable targets OG5_128723 All targets in OG5_128723
Leishmania mexicana AUT2/APG4/ATG4 cysteine peptidase, putative,cysteine peptidase, Clan CA, family C54, putative Get druggable targets OG5_127111 All targets in OG5_127111
Echinococcus multilocularis Peptidase C54 Get druggable targets OG5_127111 All targets in OG5_127111
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_128723 All targets in OG5_128723
Neospora caninum MGC84926 protein, related Get druggable targets OG5_126785 All targets in OG5_126785
Trypanosoma cruzi trypanothione reductase, putative Get druggable targets OG5_126785 All targets in OG5_126785
Entamoeba histolytica peptidase, C54 family Get druggable targets OG5_127111 All targets in OG5_127111
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_134661 All targets in OG5_134661
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_128723 All targets in OG5_128723
Schistosoma mansoni autophagin-1 (C54 family) Get druggable targets OG5_127111 All targets in OG5_127111
Cryptosporidium hominis thioredoxin reductase 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
Loa Loa (eye worm) intermediate filament protein Get druggable targets OG5_128723 All targets in OG5_128723
Trypanosoma brucei AUT2/APG4/ATG4 cysteine peptidase, putative Get druggable targets OG5_127111 All targets in OG5_127111
Trypanosoma congolense AUT2/APG4/ATG4 cysteine peptidase, putative Get druggable targets OG5_127111 All targets in OG5_127111
Trichomonas vaginalis Clan CA, family C54, ATG4-like cysteine peptidase Get druggable targets OG5_127111 All targets in OG5_127111
Plasmodium knowlesi glutathione reductase, putative Get druggable targets OG5_126785 All targets in OG5_126785
Schistosoma japonicum Lamin-C, putative Get druggable targets OG5_128723 All targets in OG5_128723
Plasmodium vivax thioredoxin reductase, putative Get druggable targets OG5_126785 All targets in OG5_126785
Leishmania infantum trypanothione reductase Get druggable targets OG5_126785 All targets in OG5_126785
Leishmania donovani trypanothione reductase Get druggable targets OG5_126785 All targets in OG5_126785
Loa Loa (eye worm) MH2 domain-containing protein Get druggable targets OG5_131716 All targets in OG5_131716
Trichomonas vaginalis Clan CA, family C54, ATG4-like cysteine peptidase Get druggable targets OG5_127111 All targets in OG5_127111
Mycobacterium ulcerans aldehyde dehydrogenase Get druggable targets OG5_126638 All targets in OG5_126638
Echinococcus granulosus lamin Get druggable targets OG5_128723 All targets in OG5_128723
Echinococcus granulosus cysteine protease atg4b Get druggable targets OG5_127111 All targets in OG5_127111
Schistosoma japonicum Retinal dehydrogenase 1, putative Get druggable targets OG5_126638 All targets in OG5_126638
Echinococcus multilocularis lamin dm0 Get druggable targets OG5_128723 All targets in OG5_128723
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain Get druggable targets OG5_131088 All targets in OG5_131088
Schistosoma mansoni aldehyde dehydrogenase Get druggable targets OG5_126638 All targets in OG5_126638
Cryptosporidium parvum thioredoxin reductase 1 Get druggable targets OG5_126785 All targets in OG5_126785
Toxoplasma gondii thioredoxin reductase Get druggable targets OG5_126785 All targets in OG5_126785
Echinococcus multilocularis cytoplasmic intermediate filament protein Get druggable targets OG5_128723 All targets in OG5_128723
Candida albicans potential protease similar to S. cerevisiae ATG4 (YNL223W) microtubule-binding anchor protein involved in attachment of autophag Get druggable targets OG5_127111 All targets in OG5_127111
Candida albicans similar to S. cerevisiae GLR1 (YPL091W) glutathione oxidoreductase Get druggable targets OG5_126785 All targets in OG5_126785
Leishmania donovani aldehyde dehydrogenase, mitochondrial precursor Get druggable targets OG5_126638 All targets in OG5_126638
Leishmania major aldehyde dehydrogenase, mitochondrial precursor Get druggable targets OG5_126638 All targets in OG5_126638
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_128723 All targets in OG5_128723
Plasmodium berghei thioredoxin reductase, putative Get druggable targets OG5_126785 All targets in OG5_126785
Schistosoma japonicum Aldehyde dehydrogenase, mitochondrial precursor, putative Get druggable targets OG5_126638 All targets in OG5_126638
Echinococcus granulosus guanine nucleotide binding protein Gs subunit Get druggable targets OG5_131088 All targets in OG5_131088
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative Get druggable targets OG5_131088 All targets in OG5_131088
Candida albicans aldehyde dehydrogenase Get druggable targets OG5_126638 All targets in OG5_126638
Plasmodium yoelii glutathione reductase Get druggable targets OG5_126785 All targets in OG5_126785
Leishmania donovani AUT2/APG4/ATG4 cysteine peptidase, putative Get druggable targets OG5_127111 All targets in OG5_127111
Schistosoma japonicum Intermediate filament protein ifa-1, putative Get druggable targets OG5_128723 All targets in OG5_128723
Schistosoma japonicum expressed protein Get druggable targets OG5_128723 All targets in OG5_128723
Plasmodium knowlesi thioredoxin reductase, 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
Echinococcus multilocularis cysteine protease atg4b Get druggable targets OG5_127111 All targets in OG5_127111
Leishmania major AUT2/APG4/ATG4 cysteine peptidase, putative Get druggable targets OG5_127111 All targets in OG5_127111
Candida albicans Mitochondrial aldehyde dehydrogenase Get druggable targets OG5_126638 All targets in OG5_126638
Echinococcus granulosus cytoplasmic intermediate filament protein Get druggable targets OG5_128723 All targets in OG5_128723
Onchocerca volvulus Get druggable targets OG5_128723 All targets in OG5_128723
Trichomonas vaginalis Clan CA, family C54, ATG4-like cysteine peptidase Get druggable targets OG5_127111 All targets in OG5_127111
Echinococcus granulosus guanine nucleotide binding protein Gs subunit Get druggable targets OG5_131088 All targets in OG5_131088
Mycobacterium ulcerans aldehyde dehydrogenase Get druggable targets OG5_126638 All targets in OG5_126638
Loa Loa (eye worm) intermediate filament tail domain-containing protein Get druggable targets OG5_128723 All targets in OG5_128723
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) Get druggable targets OG5_131088 All targets in OG5_131088
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_127111 All targets in OG5_127111
Schistosoma mansoni intermediate filament proteins Get druggable targets OG5_128723 All targets in OG5_128723
Echinococcus multilocularis aldehyde dehydrogenase, mitochondrial Get druggable targets OG5_126638 All targets in OG5_126638
Echinococcus multilocularis thioredoxin glutathione reductase Get druggable targets OG5_126785 All targets in OG5_126785
Brugia malayi glutathione reductase Get druggable targets OG5_126785 All targets in OG5_126785
Mycobacterium tuberculosis Possible penicillin-binding protein Get druggable targets OG5_149948 All targets in OG5_149948
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) Get druggable targets OG5_131088 All targets in OG5_131088
Leishmania braziliensis trypanothione reductase Get druggable targets OG5_126785 All targets in OG5_126785
Trypanosoma congolense trypanothione reductase, putative Get druggable targets OG5_126785 All targets in OG5_126785
Leishmania infantum AUT2/APG4/ATG4 cysteine peptidase, putative Get druggable targets OG5_127111 All targets in OG5_127111
Schistosoma japonicum ko:K04632 guanine nucleotide binding protein (G protein), alpha stimulating, putative Get druggable targets OG5_131088 All targets in OG5_131088
Babesia bovis thiodoxin reductase, putative Get druggable targets OG5_126785 All targets in OG5_126785
Leishmania mexicana trypanothione reductase Get druggable targets OG5_126785 All targets in OG5_126785
Schistosoma mansoni aldehyde dehydrogenase Get druggable targets OG5_126638 All targets in OG5_126638
Echinococcus multilocularis musashi Get druggable targets OG5_128723 All targets in OG5_128723
Schistosoma japonicum ko:K00384 thioredoxin reductase (NADPH) [EC1.8.1.9], 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
Schistosoma japonicum ko:K08342 autophagy-related protein 4, putative Get druggable targets OG5_127111 All targets in OG5_127111
Schistosoma japonicum expressed protein Get druggable targets OG5_128723 All targets in OG5_128723
Brugia malayi Intermediate filament tail domain containing protein Get druggable targets OG5_128723 All targets in OG5_128723
Loa Loa (eye worm) glutathione reductase Get druggable targets OG5_126785 All targets in OG5_126785
Plasmodium falciparum thioredoxin reductase Get druggable targets OG5_126785 All targets in OG5_126785
Onchocerca volvulus Get druggable targets OG5_128723 All targets in OG5_128723
Brugia malayi Peptidase family C54 containing protein Get druggable targets OG5_127111 All targets in OG5_127111
Leishmania mexicana aldehyde dehydrogenase, mitochondrial precursor Get druggable targets OG5_126638 All targets in OG5_126638
Schistosoma japonicum ko:K08342 autophagy-related protein 4, putative Get druggable targets OG5_127111 All targets in OG5_127111
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_128723 All targets in OG5_128723
Trypanosoma brucei trypanothione reductase Get druggable targets OG5_126785 All targets in OG5_126785
Mycobacterium tuberculosis Probable aldehyde dehydrogenase Get druggable targets OG5_126638 All targets in OG5_126638
Trichomonas vaginalis Clan CA, family C54, ATG4-like cysteine peptidase Get druggable targets OG5_127111 All targets in OG5_127111
Echinococcus granulosus Peptidase C54 Get druggable targets OG5_127111 All targets in OG5_127111
Brugia malayi MH2 domain containing protein Get druggable targets OG5_131716 All targets in OG5_131716
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) Get druggable targets OG5_131088 All targets in OG5_131088
Schistosoma japonicum ko:K00128 aldehyde dehydrogenase (NAD+) [EC1.2.1.3], putative Get druggable targets OG5_126638 All targets in OG5_126638
Candida albicans potential protease similar to S. cerevisiae ATG4 (YNL223W) microtubule-binding anchor protein involved in attachment of autophag Get druggable targets OG5_127111 All targets in OG5_127111
Trichomonas vaginalis Clan CA, family C54, ATG4-like cysteine peptidase Get druggable targets OG5_127111 All targets in OG5_127111
Theileria parva thioredoxin reductase, putative Get druggable targets OG5_126785 All targets in OG5_126785
Trypanosoma brucei gambiense peptidase, putative Get druggable targets OG5_127111 All targets in OG5_127111
Mycobacterium tuberculosis NADPH-dependent mycothiol reductase Mtr Get druggable targets OG5_126785 All targets in OG5_126785
Schistosoma mansoni lamin Get druggable targets OG5_128723 All targets in OG5_128723
Echinococcus multilocularis lamin Get druggable targets OG5_128723 All targets in OG5_128723
Neospora caninum hypothetical protein Get druggable targets OG5_126638 All targets in OG5_126638
Leishmania braziliensis aldehyde dehydrogenase, mitochondrial precursor Get druggable targets OG5_126638 All targets in OG5_126638
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit Get druggable targets OG5_131088 All targets in OG5_131088
Echinococcus granulosus lamin dm0 Get druggable targets OG5_128723 All targets in OG5_128723
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_128723 All targets in OG5_128723
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit Get druggable targets OG5_131088 All targets in OG5_131088
Brugia malayi Thioredoxin reductase Get druggable targets OG5_126785 All targets in OG5_126785
Schistosoma mansoni lamin Get druggable targets OG5_128723 All targets in OG5_128723
Loa Loa (eye worm) thioredoxin reductase Get druggable targets OG5_126785 All targets in OG5_126785
Echinococcus granulosus aldehyde dehydrogenase mitochondrial Get druggable targets OG5_126638 All targets in OG5_126638
Loa Loa (eye worm) transcription factor SMAD2 Get druggable targets OG5_131716 All targets in OG5_131716
Echinococcus granulosus intermediate filament protein Get druggable targets OG5_128723 All targets in OG5_128723
Schistosoma mansoni family C54 unassigned peptidase (C54 family) Get druggable targets OG5_127111 All targets in OG5_127111
Echinococcus granulosus thioredoxin glutathione reductase Get druggable targets OG5_126785 All targets in OG5_126785
Leishmania infantum aldehyde dehydrogenase, mitochondrial precursor Get druggable targets OG5_126638 All targets in OG5_126638
Plasmodium yoelii thioredoxin reductase Get druggable targets OG5_126785 All targets in OG5_126785
Toxoplasma gondii aldehyde dehydrogenase Get druggable targets OG5_126638 All targets in OG5_126638
Onchocerca volvulus Phospholipase A2 homolog Get druggable targets OG5_134661 All targets in OG5_134661
Candida albicans similar to S. cerevisiae GLR1 (YPL091W) glutathione oxidoreductase Get druggable targets OG5_126785 All targets in OG5_126785
Plasmodium berghei glutathione reductase, putative Get druggable targets OG5_126785 All targets in OG5_126785
Neospora caninum Glutathione reductase, related Get druggable targets OG5_126785 All targets in OG5_126785
Brugia malayi intermediate filament protein Get druggable targets OG5_128723 All targets in OG5_128723
Candida albicans Mitochondrial aldehyde dehydrogenase Get druggable targets OG5_126638 All targets in OG5_126638
By sequence similarity to non orthologous known druggable targets
Species Potential target Known druggable target Length Alignment span Identity
Toxoplasma gondii pyruvate dehydrogenase complex subunit PDH-E3II Thioredoxin reductase 1, cytoplasmic   499 aa 448 aa 27.2 %
Leishmania infantum dihydrolipoamide dehydrogenase, putative Thioredoxin reductase 1, cytoplasmic   499 aa 466 aa 20.6 %
Leishmania major 2-oxoglutarate dehydrogenase, e3 component, lipoamidedehydrogenase-like protein Thioredoxin reductase 1, cytoplasmic   499 aa 454 aa 25.3 %
Plasmodium knowlesi dihydrolipoyl dehydrogenase, mitochondrial, putative Thioredoxin reductase 1, cytoplasmic   499 aa 462 aa 25.8 %
Plasmodium vivax dihydrolipoyl dehydrogenase, apicoplast, putative Thioredoxin reductase 1, cytoplasmic   499 aa 518 aa 24.9 %
Trypanosoma congolense dihydrolipoamide dehydrogenase, putative Thioredoxin reductase 1, cytoplasmic   499 aa 492 aa 23.2 %
Plasmodium knowlesi dihydrolipoyl dehydrogenase, apicoplast, putative Thioredoxin reductase 1, cytoplasmic   499 aa 519 aa 23.7 %
Trypanosoma congolense dihydrolipoamide dehydrogenase, putative Thioredoxin reductase 1, cytoplasmic   499 aa 492 aa 23.2 %
Leishmania donovani acetoin dehydrogenase e3 component-like protein Thioredoxin reductase 1, cytoplasmic   499 aa 497 aa 24.1 %
Leishmania braziliensis 2-oxoglutarate dehydrogenase, e3 component, lipoamidedehydrogenase-like protein Thioredoxin reductase 1, cytoplasmic   499 aa 450 aa 25.6 %
Plasmodium falciparum thioredoxin reductase Thioredoxin reductase 1, cytoplasmic   499 aa 511 aa 45.2 %
Leishmania major acetoin dehydrogenase e3 component-like protein Thioredoxin reductase 1, cytoplasmic   499 aa 497 aa 24.1 %
Trypanosoma congolense dihydrolipoamide dehydrogenase, point mutation, putative Thioredoxin reductase 1, cytoplasmic   499 aa 489 aa 22.7 %
Leishmania infantum acetoin dehydrogenase e3 component-like protein Thioredoxin reductase 1, cytoplasmic   499 aa 497 aa 24.1 %
Leishmania mexicana acetoin dehydrogenase e3 component-like protein Thioredoxin reductase 1, cytoplasmic   499 aa 499 aa 24.4 %
Onchocerca volvulus Thioredoxin reductase 1, cytoplasmic   499 aa 499 aa 57.3 %
Plasmodium vivax dihydrolipoyl dehydrogenase, mitochondrial, putative Thioredoxin reductase 1, cytoplasmic   499 aa 460 aa 25.4 %
Neospora caninum Dihydrolipoyl dehydrogenase (EC 1.8.1.4), related Thioredoxin reductase 1, cytoplasmic   499 aa 464 aa 24.8 %
Leishmania braziliensis dihydrolipoamide dehydrogenase Thioredoxin reductase 1, cytoplasmic   499 aa 488 aa 21.9 %
Leishmania mexicana 2-oxoglutarate dehydrogenase, e3 component, lipoamidedehydrogenase-like protein Thioredoxin reductase 1, cytoplasmic   499 aa 452 aa 25.7 %
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative Thioredoxin reductase 1, cytoplasmic   499 aa 489 aa 22.9 %
Trypanosoma congolense dihydrolipoamide dehydrogenase, point mutation Thioredoxin reductase 1, cytoplasmic   499 aa 489 aa 22.5 %
Plasmodium yoelii dihydrolipoamide dehydrogenase Thioredoxin reductase 1, cytoplasmic   499 aa 465 aa 27.5 %
Plasmodium falciparum glutathione reductase Thioredoxin reductase 1, cytoplasmic   499 aa 500 aa 32.2 %
Neospora caninum glutathione reductase, putative Thioredoxin reductase 1, cytoplasmic   499 aa 492 aa 32.7 %
Neospora caninum hypothetical protein Thioredoxin reductase 1, cytoplasmic   499 aa 448 aa 27.0 %
Trypanosoma brucei dihydrolipoamide dehydrogenase, point mutation Thioredoxin reductase 1, cytoplasmic   499 aa 490 aa 23.5 %
Leishmania braziliensis acetoin dehydrogenase e3 component-like protein Thioredoxin reductase 1, cytoplasmic   499 aa 499 aa 22.8 %
Trypanosoma brucei gambiense dihydrolipoamide dehydrogenase, point mutation,acetoin dehydrogenase e3 component, putative Thioredoxin reductase 1, cytoplasmic   499 aa 490 aa 23.3 %
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative Thioredoxin reductase 1, cytoplasmic   499 aa 483 aa 23.0 %
Plasmodium falciparum dihydrolipoyl dehydrogenase, mitochondrial Thioredoxin reductase 1, cytoplasmic   499 aa 465 aa 27.3 %
Brugia malayi MH2 domain containing protein SMAD family member 2 467 aa 405 aa 31.6 %
Mycobacterium tuberculosis Hypothetical protein Nonstructural protein 1   230 aa 202 aa 23.8 %
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative Thioredoxin reductase 1, cytoplasmic   499 aa 483 aa 23.0 %
Plasmodium berghei dihydrolipoyl dehydrogenase, apicoplast, putative Thioredoxin reductase 1, cytoplasmic   499 aa 539 aa 22.3 %
Plasmodium falciparum dihydrolipoyl dehydrogenase, apicoplast Thioredoxin reductase 1, cytoplasmic   499 aa 506 aa 23.7 %
Plasmodium yoelii dihydrolipoamide dehydrogenase Thioredoxin reductase 1, cytoplasmic   499 aa 540 aa 23.3 %
Mycobacterium tuberculosis Succinate-semialdehyde dehydrogenase [NADP+] dependent (SSDH) GabD1 aldehyde dehydrogenase 1 family, member A1 501 aa 456 aa 33.3 %
Leishmania donovani dihydrolipoamide dehydrogenase, putative Thioredoxin reductase 1, cytoplasmic   499 aa 466 aa 20.6 %
Trypanosoma brucei gambiense dihydrolipoamide dehydrogenase, putative Thioredoxin reductase 1, cytoplasmic   499 aa 491 aa 23.6 %
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative Thioredoxin reductase 1, cytoplasmic   499 aa 489 aa 22.7 %
Trypanosoma brucei dihydrolipoamide dehydrogenase Thioredoxin reductase 1, cytoplasmic   499 aa 492 aa 23.4 %
Trypanosoma brucei gambiense dihydrolipoamide dehydrogenase, putative,acetoin dehydrogenase e3 component, putative Thioredoxin reductase 1, cytoplasmic   499 aa 491 aa 23.2 %
Plasmodium berghei dihydrolipoyl dehydrogenase, mitochondrial, putative Thioredoxin reductase 1, cytoplasmic   499 aa 465 aa 26.9 %
Schistosoma mansoni GTP-binding protein alpha subunit gna GNAS complex locus 394 aa 450 aa 28.7 %
Trypanosoma congolense dihydrolipoamide dehydrogenase, point mutation Thioredoxin reductase 1, cytoplasmic   499 aa 489 aa 22.3 %
Toxoplasma gondii NADPH-glutathione reductase Thioredoxin reductase 1, cytoplasmic   499 aa 529 aa 31.8 %
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Mycobacterium tuberculosis Probable multifunctional mycocerosic acid synthase membrane-associated Mas 0.0535 0.5394 0.6929
Mycobacterium tuberculosis Probable dehydrogenase 0.013 0.0953 0.1224
Mycobacterium leprae DIHYDROLIPOAMIDE DEHYDROGENASE LPD (LIPOAMIDE REDUCTASE (NADH)) (LIPOYL DEHYDROGENASE) (DIHYDROLIPOYL DEHYDROGENASE) (DIAPHORASE 0.0145 0.1113 0.1429
Toxoplasma gondii type I fatty acid synthase, putative 0.0535 0.5394 1
Mycobacterium tuberculosis Probable reductase 0.013 0.0953 0.1224
Mycobacterium leprae Probable polyketide synthase Pks1 0.0535 0.5394 0.6929
Mycobacterium ulcerans aldehyde dehydrogenase 0.0073 0.0328 0.0421
Brugia malayi oxidoreductase, short chain dehydrogenase/reductase family protein 0.0051 0.0081 0.0081
Echinococcus multilocularis thioredoxin glutathione reductase 0.0057 0.015 0.1647
Plasmodium falciparum 3-oxoacyl-acyl-carrier protein synthase I/II 0.0126 0.091 1
Mycobacterium tuberculosis Probable polyketide synthase Pks1 0.0362 0.3494 0.4488
Brugia malayi Beta-ketoacyl synthase, N-terminal domain containing protein 0.0503 0.5051 0.5051
Loa Loa (eye worm) hypothetical protein 0.0528 0.5318 0.6037
Mycobacterium tuberculosis Peptide synthetase MbtE (peptide synthase) 0.0051 0.0081 0.0104
Mycobacterium tuberculosis Probable polyketide beta-ketoacyl synthase Pks4 0.0077 0.0371 0.0476
Mycobacterium tuberculosis Polyketide synthetase MbtC (polyketide synthase) 0.0173 0.1423 0.1828
Mycobacterium ulcerans Type I modular polyketide synthase 0.0503 0.5051 0.6488
Toxoplasma gondii acyl carrier protein ACP 0.0051 0.0081 0.015
Brugia malayi Phospholipase A2 family protein 0.0111 0.0743 0.0743
Brugia malayi acyl carrier protein, mitochondrial precursor, putative 0.0051 0.0081 0.0081
Echinococcus multilocularis NADH dehydrogenase 0.0051 0.0081 0.0892
Mycobacterium ulcerans fatty acid synthase Fas 0.0158 0.1259 0.1617
Mycobacterium leprae PROBABLE FATTY ACID SYNTHASE FAS (FATTY ACID SYNTHETASE) 0.0158 0.1259 0.1617
Echinococcus granulosus NADH dehydrogenase 0.0051 0.0081 0.0892
Mycobacterium tuberculosis Phenolpthiocerol synthesis type-I polyketide synthase PpsD 0.0503 0.5051 0.6488
Mycobacterium leprae PROBABLE THIOESTERASE TESA 0.0419 0.4129 0.5304
Loa Loa (eye worm) phosphopantetheine attachment site family protein 0.0051 0.0081 0.0092
Mycobacterium tuberculosis Polyketide synthase Pks13 0.0752 0.7784 1
Mycobacterium ulcerans thioesterase TesA 0.0419 0.4129 0.5304
Loa Loa (eye worm) fatty acid synthase 0.0497 0.4977 0.565
Mycobacterium ulcerans non-ribosomal peptide synthetase 0.0051 0.0081 0.0104
Mycobacterium ulcerans hypothetical protein 0.0051 0.0081 0.0104
Loa Loa (eye worm) transcription factor SMAD2 0.0144 0.1106 0.1255
Echinococcus granulosus cysteine protease atg4b 0.0071 0.0305 0.335
Brugia malayi AMP-binding enzyme family protein 0.047 0.4687 0.4687
Echinococcus granulosus acyl carrier protein mitochondrial 0.0051 0.0081 0.0892
Mycobacterium tuberculosis Hypothetical protein 0.0152 0.1188 0.1526
Plasmodium vivax hypothetical protein, conserved 0.0072 0.0315 0.346
Toxoplasma gondii aldehyde dehydrogenase 0.0073 0.0328 0.0608
Loa Loa (eye worm) hypothetical protein 0.0077 0.0371 0.0421
Mycobacterium ulcerans aldehyde dehydrogenase 0.0073 0.0328 0.0421
Brugia malayi Thioredoxin reductase 0.0057 0.015 0.015
Entamoeba histolytica acyl-CoA synthetase, putative 0.0051 0.0081 0.2664
Mycobacterium tuberculosis Probable polyketide synthase Pks7 0.0535 0.5394 0.6929
Mycobacterium tuberculosis Acyl carrier protein (ACP) MbtL 0.0051 0.0081 0.0104
Trypanosoma cruzi beta-ketoacyl synthase family protein, putative 0.0126 0.091 1
Mycobacterium leprae Polyketide synthase Pks13 0.0752 0.7784 1
Mycobacterium leprae PHENOLPTHIOCEROL SYNTHESIS TYPE-I POLYKETIDE SYNTHASE PPSA 0.0503 0.5051 0.6488
Echinococcus multilocularis AMP dependent ligase 0.0051 0.0081 0.0892
Mycobacterium leprae PROBABLE POLYKETIDE BETA-KETOACYL SYNTHASE PKS4 0.0077 0.0371 0.0476
Treponema pallidum acyl carrier protein 0.0051 0.0081 0.5
Loa Loa (eye worm) glutathione reductase 0.0057 0.015 0.017
Echinococcus multilocularis 3 oxoacyl (acyl carrier protein) synthase 0.0126 0.091 1
Schistosoma mansoni methyltransferase-related 0.0152 0.1188 0.7803
Mycobacterium tuberculosis Probable polyketide synthase Pks9 0.0286 0.2665 0.3424
Schistosoma mansoni aldehyde dehydrogenase 0.0073 0.0328 0.2155
Trichomonas vaginalis conserved hypothetical protein 0.0152 0.1188 1
Echinococcus granulosus aldehyde dehydrogenase mitochondrial 0.0073 0.0328 0.3604
Trichomonas vaginalis Clan CA, family C54, ATG4-like cysteine peptidase 0.0071 0.0305 0.2565
Leishmania major hypothetical protein, conserved 0.0152 0.1188 1
Mycobacterium leprae PROBABLE NADH DEHYDROGENASE NDH 0.013 0.0953 0.1224
Loa Loa (eye worm) MH2 domain-containing protein 0.0144 0.1106 0.1255
Mycobacterium ulcerans peptide synthetase Nrp (peptide synthase) 0.0051 0.0081 0.0104
Mycobacterium tuberculosis Probable membrane bound polyketide synthase Pks6 0.0752 0.7784 1
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0055 0.0129 0.085
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0055 0.0129 0.1422
Onchocerca volvulus 0.0876 0.9144 0.9638
Trichomonas vaginalis Clan CA, family C54, ATG4-like cysteine peptidase 0.0071 0.0305 0.2565
Mycobacterium ulcerans fatty-acid-CoA ligase FadD9 0.0051 0.0081 0.0104
Plasmodium vivax 3-oxoacyl-[acyl-carrier-protein] synthase i/ii, putative 0.0126 0.091 1
Chlamydia trachomatis 3-oxoacyl-ACP synthase 0.0126 0.091 1
Mycobacterium tuberculosis NADPH-dependent mycothiol reductase Mtr 0.0057 0.015 0.0192
Wolbachia endosymbiont of Brugia malayi 3-oxoacyl-ACP synthase 0.0126 0.091 1
Plasmodium falciparum conserved Plasmodium protein, unknown function 0.0072 0.0315 0.2822
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0043 0 0.0002
Echinococcus multilocularis Acyl carrier protein, mitochondrial 0.0051 0.0081 0.0892
Mycobacterium ulcerans non-ribosomal peptide synthetase MbtE 0.0051 0.0081 0.0104
Schistosoma mansoni family C54 unassigned peptidase (C54 family) 0.0071 0.0305 0.2003
Leishmania major trypanothione reductase 0.0057 0.015 0.1259
Trypanosoma brucei beta-ketoacyl-ACP synthase 0.0126 0.091 1
Onchocerca volvulus Fatty acid synthase homolog 0.0907 0.9487 1
Mycobacterium tuberculosis Phenolpthiocerol synthesis type-I polyketide synthase PpsA 0.0503 0.5051 0.6488
Loa Loa (eye worm) hypothetical protein 0.0282 0.262 0.2974
Mycobacterium tuberculosis Probable polyketide beta-ketoacyl synthase Pks3 0.0077 0.0371 0.0476
Mycobacterium ulcerans phenolpthiocerol synthesis type-I polyketide synthase PpsE 0.0333 0.3178 0.4083
Trypanosoma brucei AUT2/APG4/ATG4 cysteine peptidase, putative 0.0071 0.0305 0.3347
Entamoeba histolytica acyl-CoA synthetase, putative 0.0051 0.0081 0.2664
Plasmodium vivax acyl carrier protein, putative 0.0051 0.0081 0.0889
Mycobacterium tuberculosis Probable polyketide synthase Pks8 0.0412 0.4043 0.5194
Loa Loa (eye worm) hypothetical protein 0.0077 0.0371 0.0421
Mycobacterium ulcerans acyl carrier protein 0.0051 0.0081 0.0104
Echinococcus multilocularis cysteine protease atg4b 0.0071 0.0305 0.335
Brugia malayi Methyltransferase-like protein 4 0.0152 0.1188 0.1188
Mycobacterium ulcerans polyketide synthase Pks13 0.0752 0.7784 1
Brugia malayi glutathione reductase 0.0057 0.015 0.015
Mycobacterium leprae conserved hypothetical protein 0.0051 0.0081 0.0104
Mycobacterium tuberculosis Phenyloxazoline synthase MbtB (phenyloxazoline synthetase) 0.047 0.4687 0.6021
Loa Loa (eye worm) AMP-binding enzyme family protein 0.047 0.4687 0.5321
Mycobacterium tuberculosis Phenolpthiocerol synthesis type-I polyketide synthase PpsE 0.0077 0.0371 0.0476
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0055 0.0129 0.0147
Toxoplasma gondii type I fatty acid synthase 0.0077 0.0371 0.0687
Trichomonas vaginalis Clan CA, family C54, ATG4-like cysteine peptidase 0.0071 0.0305 0.2565
Trypanosoma cruzi trypanothione reductase, putative 0.0057 0.015 0.1644
Mycobacterium ulcerans polyketide synthase MbtD 0.0155 0.1222 0.157
Loa Loa (eye worm) acyl carrier protein 0.0231 0.2065 0.2344
Mycobacterium tuberculosis NAD(P)H quinone reductase LpdA 0.0145 0.1113 0.1429
Mycobacterium ulcerans non-ribosomal peptide synthetase MbtF 0.0051 0.0081 0.0104
Mycobacterium ulcerans acyl carrier protein 0.0051 0.0081 0.0104
Mycobacterium ulcerans Type I modular polyketide synthase 0.0503 0.5051 0.6488
Mycobacterium leprae PHENOLPTHIOCEROL SYNTHESIS TYPE-I POLYKETIDE SYNTHASE PPSC 0.0535 0.5394 0.6929
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0055 0.0129 0.085
Mycobacterium ulcerans polyketide synthase Pks9 0.0333 0.3178 0.4083
Onchocerca volvulus 0.047 0.4687 0.4941
Schistosoma mansoni aldehyde dehydrogenase 0.0073 0.0328 0.2155
Mycobacterium tuberculosis Meromycolate extension acyl carrier protein AcpM 0.0051 0.0081 0.0104
Mycobacterium tuberculosis Putative ferredoxin reductase 0.013 0.0953 0.1224
Mycobacterium ulcerans phenolpthiocerol synthesis type-I polyketide synthase PpsD 0.0503 0.5051 0.6488
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0055 0.0129 0.0129
Mycobacterium tuberculosis Peptide synthetase MbtF (peptide synthase) 0.0051 0.0081 0.0104
Onchocerca volvulus Acyl carrier protein, mitochondrial homolog 0.0051 0.0081 0.0085
Mycobacterium leprae PHENOLPTHIOCEROL SYNTHESIS TYPE-I POLYKETIDE SYNTHASE PPSE 0.0333 0.3178 0.4083
Mycobacterium ulcerans polyketide synthase MbtC 0.0126 0.091 0.1169
Brugia malayi Beta-ketoacyl synthase, N-terminal domain containing protein 0.0126 0.091 0.091
Entamoeba histolytica peptidase, C54 family 0.0071 0.0305 1
Mycobacterium ulcerans phenolpthiocerol synthesis type-I polyketide synthase PpsA 0.0405 0.397 0.51
Toxoplasma gondii 3-oxoacyl-acyl-carrier protein synthase I/II, putative 0.0126 0.091 0.1687
Brugia malayi Phosphopantetheine attachment site family protein 0.0051 0.0081 0.0081
Loa Loa (eye worm) thioredoxin reductase 0.0057 0.015 0.017
Mycobacterium tuberculosis Polyketide synthase Pks12 0.0535 0.5394 0.6929
Loa Loa (eye worm) hypothetical protein 0.0846 0.8809 1
Mycobacterium ulcerans 3-oxoacyl-(acyl carrier protein) synthase II 0.0126 0.091 0.1169
Mycobacterium tuberculosis Probable fatty acid synthase Fas (fatty acid synthetase) 0.0158 0.1259 0.1617
Mycobacterium tuberculosis P-hydroxybenzoyl-AMP ligase FadD22 0.0051 0.0081 0.0104
Toxoplasma gondii beta-ketoacyl synthase, N-terminal domain-containing protein 0.0327 0.3109 0.5763
Mycobacterium ulcerans Type I modular polyketide synthase 0.0503 0.5051 0.6488
Echinococcus granulosus 3 oxoacyl acyl carrier protein synthase 0.0126 0.091 1
Echinococcus granulosus thioredoxin glutathione reductase 0.0057 0.015 0.1647
Mycobacterium tuberculosis Probable nitrite reductase [NAD(P)H] large subunit [FAD flavoprotein] NirB 0.013 0.0953 0.1224
Schistosoma mansoni acyl carrier protein 0.0051 0.0081 0.0534
Plasmodium vivax thioredoxin reductase, putative 0.0057 0.015 0.1644
Mycobacterium ulcerans polyketide synthase 0.0535 0.5394 0.6929
Mycobacterium leprae PHENOLPTHIOCEROL SYNTHESIS TYPE-I POLYKETIDE SYNTHASE PPSB 0.0405 0.397 0.51
Leishmania major AUT2/APG4/ATG4 cysteine peptidase, putative 0.0071 0.0305 0.2565
Mycobacterium ulcerans multifunctional mycocerosic acid synthase membrane-associated Mas 0.0535 0.5394 0.6929
Trypanosoma brucei Acyl carrier protein, mitochondrial 0.0051 0.0081 0.0889
Mycobacterium tuberculosis Probable polyketide synthase Pks5 0.0488 0.4881 0.627
Onchocerca volvulus Phospholipase A2 homolog 0.0528 0.5318 0.5606
Mycobacterium tuberculosis Probable aldehyde dehydrogenase 0.0073 0.0328 0.0421
Mycobacterium tuberculosis Conserved hypothetical protein 0.0051 0.0081 0.0104
Brugia malayi AMP-binding enzyme family protein 0.0155 0.1222 0.1222
Onchocerca volvulus Phospholipase A2 homolog 0.0111 0.0743 0.0783
Trichomonas vaginalis Clan CA, family C54, ATG4-like cysteine peptidase 0.0071 0.0305 0.2565
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0055 0.0129 0.1422
Mycobacterium ulcerans phenyloxazoline synthase MbtB 0.0051 0.0081 0.0104
Plasmodium falciparum glutathione reductase 0.0057 0.015 0.0829
Mycobacterium tuberculosis Polyketide synthase Pks2 0.0488 0.4881 0.627
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0055 0.0129 0.085
Mycobacterium ulcerans polyketide synthase 0.0503 0.5051 0.6488
Mycobacterium tuberculosis Probable oxidoreductase 0.0145 0.1113 0.1429
Onchocerca volvulus 0.0051 0.0081 0.0085
Mycobacterium ulcerans 3-oxoacyl-(acyl carrier protein) synthase II 0.0126 0.091 0.1169
Mycobacterium leprae PHENOLPTHIOCEROL SYNTHESIS TYPE-I POLYKETIDE SYNTHASE PPSD 0.0503 0.5051 0.6488
Mycobacterium leprae Probable fatty-acid-CoA synthetase FadD22 (fatty-acid-CoA ligase) (fatty-acid-CoA synthase) 0.0051 0.0081 0.0104
Echinococcus multilocularis Peptidase C54 0.0071 0.0305 0.335
Echinococcus granulosus AMP dependent ligase 0.0051 0.0081 0.0892
Toxoplasma gondii AMP-binding enzyme domain-containing protein 0.0254 0.2316 0.4294
Mycobacterium ulcerans phenolpthiocerol synthesis type-I polyketide synthase PpsB 0.0405 0.397 0.51
Loa Loa (eye worm) acyl carrier protein 0.0051 0.0081 0.0092
Trypanosoma cruzi AUT2/APG4/ATG4 cysteine peptidase, putative 0.0071 0.0305 0.3347
Mycobacterium ulcerans aldehyde dehydrogenase 0.0073 0.0328 0.0421
Mycobacterium tuberculosis Probable peptide synthetase Nrp (peptide synthase) 0.0051 0.0081 0.0104
Loa Loa (eye worm) hypothetical protein 0.0071 0.0305 0.0346
Schistosoma mansoni hypothetical protein 0.0051 0.0081 0.0534
Mycobacterium tuberculosis Probable acyl carrier protein AcpA (ACP) 0.0051 0.0081 0.0104
Mycobacterium tuberculosis Probable membrane NADH dehydrogenase NdhA 0.013 0.0953 0.1224
Echinococcus multilocularis aldehyde dehydrogenase, mitochondrial 0.0073 0.0328 0.3604
Toxoplasma gondii type I fatty acid synthase, putative 0.0358 0.3458 0.641
Leishmania major beta-ketoacyl synthase family protein, putative,3-oxoacyl-acyl carrier protein synthase ii, putative 0.0126 0.091 0.7661
Loa Loa (eye worm) beta-ketoacyl synthase domain-containing protein 0.0126 0.091 0.1033
Trypanosoma brucei trypanothione reductase 0.0057 0.015 0.1644
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0055 0.0129 0.1422
Leishmania major aldehyde dehydrogenase, mitochondrial precursor 0.0073 0.0328 0.2759
Giardia lamblia Methyltransferase like 2 0.0152 0.1188 0.5
Mycobacterium leprae Probable fatty-acid-CoA ligase FadD9 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0051 0.0081 0.0104
Schistosoma mansoni family C54 unassigned peptidase (C54 family) 0.0071 0.0305 0.2003
Leishmania major acyl carrier protein, putative 0.0051 0.0081 0.0681
Echinococcus granulosus beta LACTamase domain containing family member 0.0043 0 0.0004
Schistosoma mansoni 3-oxoacyl-[ACP] synthase 0.0126 0.091 0.5979
Plasmodium falciparum thioredoxin reductase 0.0057 0.015 0.0829
Mycobacterium ulcerans acyl-CoA synthetase 0.0051 0.0081 0.0104
Mycobacterium tuberculosis Phenolpthiocerol synthesis type-I polyketide synthase PpsB 0.0077 0.0371 0.0476
Mycobacterium leprae Probable multifunctional mycocerosic acid synthase membrane associated enzyme Mas 0.0535 0.5394 0.6929
Toxoplasma gondii thioredoxin reductase 0.0057 0.015 0.0277
Mycobacterium ulcerans thioesterase 0.0419 0.4129 0.5304
Mycobacterium tuberculosis Polyketide synthetase MbtD (polyketide synthase) 0.0155 0.1222 0.157
Trichomonas vaginalis Clan CA, family C54, ATG4-like cysteine peptidase 0.0071 0.0305 0.2565
Mycobacterium tuberculosis Conserved protein 0.0152 0.1188 0.1526
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD9 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0051 0.0081 0.0104
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0055 0.0129 0.1422
Brugia malayi Peptidase family C54 containing protein 0.0071 0.0305 0.0305
Trypanosoma cruzi Acyl carrier protein, mitochondrial, putative 0.0051 0.0081 0.0889
Echinococcus granulosus Peptidase C54 0.0071 0.0305 0.335
Brugia malayi MH2 domain containing protein 0.0144 0.1106 0.1106
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0043 0 0.0002
Echinococcus multilocularis beta LACTamase domain containing family member 0.0043 0 0.0004
Mycobacterium tuberculosis Probable polyketide synthase Pks15 0.0204 0.1758 0.2258
Schistosoma mansoni autophagin-1 (C54 family) 0.0071 0.0305 0.2003
Mycobacterium tuberculosis Dihydrolipoamide dehydrogenase LpdC (lipoamide reductase (NADH)) (lipoyl dehydrogenase) (dihydrolipoyl dehydrogenase) (diaphoras 0.0145 0.1113 0.1429
Trypanosoma cruzi beta-ketoacyl synthase family protein, putative 0.0126 0.091 1
Mycobacterium tuberculosis Possible penicillin-binding protein 0.0278 0.2573 0.3305
Mycobacterium tuberculosis Phenolpthiocerol synthesis type-I polyketide synthase PpsC 0.0503 0.5051 0.6488
Mycobacterium tuberculosis Probable polyketide synthase Pks17 0.0123 0.0874 0.1122
Mycobacterium tuberculosis Probable thioesterase TesA 0.0419 0.4129 0.5304
Mycobacterium ulcerans phenolpthiocerol synthesis type-I polyketide synthase PpsC 0.0535 0.5394 0.6929
Loa Loa (eye worm) hypothetical protein 0.0111 0.0743 0.0843
Plasmodium vivax glutathione reductase, putative 0.0057 0.015 0.1644
Mycobacterium tuberculosis Probable NADH dehydrogenase Ndh 0.013 0.0953 0.1224

Activities

Activity type Activity value Assay description Source Reference
IC50 (functional) = 1.86 uM PUBCHEM_BIOASSAY: Dose response counterscreen of uHTS hits for ATG4B inhibitors in a Phospholipase A2 assay. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID504462, AID504475] ChEMBL. No reference
IC50 (functional) = 14.2 uM PUBCHEM_BIOASSAY: Dose response confirmation of the uHTS fluorescent assay for identification of inhibitors of ATG4B. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID504462, AID504475] ChEMBL. No reference
IC50 (functional) > 66 uM PUBCHEM_BIOASSAY: Dose-response secondary confirmation of microRNA-mediated mRNA deacetylation inhibitors by fluorescence polarization assay using Cy5 labeled peptide. (Class of assay: confirmatory) ChEMBL. No reference
IC50 (functional) > 66 uM PUBCHEM_BIOASSAY: Dose-response confirmation of microRNA-mediated mRNA deacetylation inhibitors by fluorescence polarization assay. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) = 0.1 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) = 0.7079 um PUBCHEM_BIOASSAY: qHTS Inhibitors of AmpC Beta-Lactamase (assay with detergent). (Class of assay: confirmatory) [Related pubchem assays: 1002 (Confirmation Concentration-Response Assay for Inhibitors of AmpC Beta-Lactamase (assay with detergent)), 585 (Promiscuous and Specific Inhibitors of AmpC Beta-Lactamase (assay without detergent) - a screen old NIH MLSMR collection), 584 (Promiscuous and Specific Inhibitors of AmpC Beta-Lactamase (assay with detergent) - a screen of the old NIH MLSMR collection), 1003 (Confirmation Cuvette-Based Assay for Inhibitors of AmpC Beta-Lactamase (assay with detergent))] ChEMBL. No reference
Potency (functional) 1.4125 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) 1.7783 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) 2.2387 uM PubChem BioAssay. qHTS for Inhibitors of ATXN expression. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) = 3.1623 um PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Influenza NS1 Protein Function. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) = 3.9811 um PUBCHEM_BIOASSAY: qHTS Assay for Modulators of Lamin A Splicing. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 8.1995 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) 11.2202 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) 11.2202 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) 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) 23.1093 uM PUBCHEM_BIOASSAY: qHTS screen for small molecules that inhibit ELG1-dependent DNA repair in human embryonic kidney (HEK293T) cells expressing luciferase-tagged ELG1. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID493107, AID493125] ChEMBL. No reference
Potency (functional) 39.8107 uM PubChem BioAssay. qHTS for Inhibitors of WRN Helicase. (Class of assay: confirmatory) ChEMBL. No reference

Phenotypes

Whole-cell/tissue/organism interactions

Species name Source Reference Is orphan
Homo sapiens ChEMBL23
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.

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