Detailed information for compound 1427472

Basic information

Technical information
  • TDR Targets ID: 1427472
  • Name: N-(2-fluorophenyl)-4-(4,4,6-trimethyl-2-sulfa nylidene-1,3-diazinan-1-yl)butanamide
  • MW: 337.455 | Formula: C17H24FN3OS
  • H donors: 1 H acceptors: 1 LogP: 2.63 Rotable bonds: 6
    Rule of 5 violations (Lipinski): 1
  • SMILES: O=C(Nc1ccccc1F)CCCN1C(C)CC(N=C1S)(C)C
  • InChi: 1S/C17H24FN3OS/c1-12-11-17(2,3)20-16(23)21(12)10-6-9-15(22)19-14-8-5-4-7-13(14)18/h4-5,7-8,12H,6,9-11H2,1-3H3,(H,19,22)(H,20,23)
  • InChiKey: WCPDRYKBJXGLCQ-UHFFFAOYSA-N  


Substructure search Similarity search

Network

Hover on a compound node to display the structore

Synonyms

  • N-(2-fluorophenyl)-4-(4,4,6-trimethyl-2-thioxo-hexahydropyrimidin-1-yl)butanamide
  • N-(2-fluorophenyl)-4-(4,4,6-trimethyl-2-thioxo-1-hexahydropyrimidinyl)butanamide
  • N-(2-fluorophenyl)-4-(4,4,6-trimethyl-2-thioxo-hexahydropyrimidin-1-yl)butyramide
  • SMR000307846
  • MLS000729569
  • N-(2-fluorophenyl)-4-(4,4,6-trimethyl-2-thioxotetrahydropyrimidin-1(2H)-yl)butanamide

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens lamin A/C Starlite/ChEMBL No references
Mus musculus RAR-related orphan receptor gamma Starlite/ChEMBL No references

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Loa Loa (eye worm) hypothetical protein 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 granulosus cytoplasmic intermediate filament protein Get druggable targets OG5_128723 All targets in OG5_128723
Echinococcus multilocularis cytoplasmic intermediate filament protein Get druggable targets OG5_128723 All targets in OG5_128723
Loa Loa (eye worm) intermediate filament tail domain-containing protein Get druggable targets OG5_128723 All targets in OG5_128723
Echinococcus granulosus lamin Get druggable targets OG5_128723 All targets in OG5_128723
Schistosoma japonicum Lamin-C, putative Get druggable targets OG5_128723 All targets in OG5_128723
Schistosoma japonicum Intermediate filament protein ifa-1, putative 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 granulosus lamin dm0 Get druggable targets OG5_128723 All targets in OG5_128723
Schistosoma japonicum ko:K07611 lamin, putative Get druggable targets OG5_128723 All targets in OG5_128723
Echinococcus granulosus intermediate filament protein Get druggable targets OG5_128723 All targets in OG5_128723
Schistosoma mansoni lamin Get druggable targets OG5_128723 All targets in OG5_128723
Echinococcus multilocularis lamin dm0 Get druggable targets OG5_128723 All targets in OG5_128723
Schistosoma japonicum expressed protein Get druggable targets OG5_128723 All targets in OG5_128723
Echinococcus multilocularis musashi Get druggable targets OG5_128723 All targets in OG5_128723
Onchocerca volvulus Get druggable targets OG5_128723 All targets in OG5_128723
Loa Loa (eye worm) intermediate filament protein Get druggable targets OG5_128723 All targets in OG5_128723
Brugia malayi intermediate filament protein Get druggable targets OG5_128723 All targets in OG5_128723
Schistosoma japonicum expressed protein 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
Brugia malayi Intermediate filament tail domain containing protein Get druggable targets OG5_128723 All targets in OG5_128723
Onchocerca volvulus 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
Schistosoma mansoni intermediate filament proteins Get druggable targets OG5_128723 All targets in OG5_128723
Echinococcus multilocularis lamin Get druggable targets OG5_128723 All targets in OG5_128723
Schistosoma mansoni lamin Get druggable targets OG5_128723 All targets in OG5_128723
By sequence similarity to non orthologous known druggable targets
No druggable targets predicted by sequence similarity
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Loa Loa (eye worm) hypothetical protein 0.001 0.0061 0.0061
Loa Loa (eye worm) nuclear hormone receptor family member nhr-40 0.0012 0.0107 0.0107
Trichomonas vaginalis Citrate lyase beta chain, putative 0.0024 0.0331 0.0523
Brugia malayi steroid hormone receptor 0.0012 0.0107 0.0107
Schistosoma mansoni GTP-binding protein (q) alpha-11 subunit gna11 0.0008 0.0019 0.0048
Loa Loa (eye worm) nuclear Hormone Receptor family member 0.0012 0.0107 0.0107
Loa Loa (eye worm) hypothetical protein 0.001 0.0061 0.0061
Echinococcus multilocularis tyrosine protein kinase ABL1 0.0209 0.3969 1
Echinococcus granulosus FTZ F1 alpha 0.0012 0.0107 0.0269
Trypanosoma cruzi hypothetical protein, conserved 0.0206 0.3896 1
Loa Loa (eye worm) intermediate filament protein 0.0033 0.0506 0.0506
Schistosoma mansoni FTZ-F1 nuclear receptor-like protein 0.0012 0.0107 0.0273
Mycobacterium tuberculosis Adenosylmethionine-8-amino-7-oxononanoate aminotransferase BioA 0.0313 0.6002 1
Loa Loa (eye worm) hypothetical protein 0.0008 0.0019 0.0019
Schistosoma mansoni paired box protein pax-6 0.001 0.0061 0.0157
Schistosoma mansoni hypothetical protein 0.0012 0.0095 0.0242
Brugia malayi Steroid receptor seven-up type 2 0.0012 0.0107 0.0107
Brugia malayi Nuclear hormone receptor family member nhr-3 0.0012 0.0107 0.0107
Echinococcus multilocularis citrate lyase subunit beta protein 0.0024 0.0331 0.0835
Onchocerca volvulus 0.0033 0.0506 0.0488
Echinococcus granulosus Aminotransferase class III 0.0044 0.074 0.1863
Echinococcus multilocularis expressed protein 0.0008 0.0019 0.0047
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.018 0.339 0.8541
Echinococcus granulosus paired box gene 3/7 (eyeless, eyegone, twin of eyeless) 0.001 0.0061 0.0155
Brugia malayi Nuclear hormone receptor family member nhr-14 0.0012 0.0107 0.0107
Echinococcus multilocularis ornithine aminotransferase 0.0044 0.074 0.1863
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.018 0.339 0.8541
Loa Loa (eye worm) hypothetical protein 0.0016 0.0175 0.0175
Schistosoma mansoni GTP-binding protein (I) alpha subunit gnai 0.0008 0.0019 0.0048
Schistosoma mansoni GTP-binding protein (I) alpha-2 subunit gnai2 0.0008 0.0019 0.0048
Schistosoma mansoni nuclear hormone receptor 0.0012 0.0107 0.0273
Echinococcus multilocularis guanine nucleotide binding protein (G protein) 0.0008 0.0019 0.0047
Schistosoma mansoni GTP-binding protein (I) alpha-2 subunit gnai2 0.0008 0.0019 0.0048
Onchocerca volvulus Retinal homeobox protein Rx homolog 0.001 0.0061 0.0043
Schistosoma mansoni nuclear receptor 2DBD-gamma 0.0012 0.0107 0.0273
Echinococcus multilocularis ornithine aminotransferase 0.0044 0.074 0.1863
Onchocerca volvulus 0.001 0.0061 0.0043
Schistosoma mansoni GTP-binding protein alpha subunit 0.0008 0.0019 0.0048
Schistosoma mansoni nuclear hormone receptor nor-1/nor-2 0.0012 0.0107 0.0273
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.018 0.339 0.339
Schistosoma mansoni intermediate filament proteins 0.0033 0.0506 0.1294
Brugia malayi ecdysteroid receptor 0.0012 0.0107 0.0107
Echinococcus multilocularis guanine nucleotide binding protein subunit 0.0008 0.0019 0.0047
Plasmodium vivax ornithine aminotransferase, putative 0.0044 0.074 1
Echinococcus granulosus paired box protein pax 1 0.001 0.0061 0.0155
Brugia malayi intermediate filament protein 0.0033 0.0506 0.0506
Loa Loa (eye worm) hypothetical protein 0.0008 0.0019 0.0019
Schistosoma mansoni paired box protein pax-6 0.001 0.0061 0.0157
Brugia malayi Tyrosine-protein kinase abl-1 0.0127 0.2354 0.2354
Brugia malayi paired box pox-meso protein 0.001 0.0061 0.0061
Echinococcus multilocularis lamin 0.0033 0.0506 0.1274
Schistosoma mansoni GTP-binding protein alpha subunit gna 0.0008 0.0019 0.0048
Brugia malayi photoreceptor-specific nuclear receptor 0.0012 0.0107 0.0107
Loa Loa (eye worm) hypothetical protein 0.0012 0.0107 0.0107
Echinococcus multilocularis guanine nucleotide binding protein subunit 0.0008 0.0019 0.0047
Loa Loa (eye worm) hypothetical protein 0.001 0.0061 0.0061
Schistosoma mansoni lamin 0.0033 0.0506 0.1294
Echinococcus granulosus intermediate filament protein 0.0033 0.0506 0.1274
Schistosoma mansoni trimeric G-protein alpha o subunit 0.0008 0.0019 0.0048
Echinococcus granulosus Nuclear hormone receptor family member nhr 41 0.0012 0.0107 0.0269
Onchocerca volvulus 0.0012 0.0107 0.0088
Trypanosoma cruzi PAB1-binding protein , putative 0.0026 0.0374 0.012
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.018 0.339 0.339
Echinococcus multilocularis Nuclear hormone receptor family member nhr 41 0.0012 0.0107 0.0269
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0012 0.0107 0.0107
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0012 0.0107 0.0107
Echinococcus granulosus Ataxin 2 N terminaldomain containing protein 0.0012 0.0095 0.0239
Loa Loa (eye worm) hypothetical protein 0.0079 0.1423 0.1423
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.018 0.339 0.8669
Brugia malayi Guanine nucleotide-binding protein alpha-3 subunit, putative 0.0008 0.0019 0.0019
Brugia malayi hypothetical protein 0.0008 0.0019 0.0019
Brugia malayi 'Paired box' domain containing protein 0.001 0.0061 0.0061
Brugia malayi guanine nucleotide-binding protein alpha-7 subunit, putative 0.0008 0.0019 0.0019
Loa Loa (eye worm) hypothetical protein 0.0015 0.0164 0.0164
Echinococcus multilocularis ecdysone induced protein 78C 0.0012 0.0107 0.0269
Loa Loa (eye worm) intermediate filament tail domain-containing protein 0.0033 0.0506 0.0506
Trypanosoma brucei hypothetical protein, conserved 0.0206 0.3896 1
Mycobacterium ulcerans L-lysine aminotransferase 0.0044 0.074 0.072
Brugia malayi guanine nucleotide-binding protein alpha-3 subunit, putative 0.0008 0.0019 0.0019
Brugia malayi 4-aminobutyrate aminotransferase, mitochondrial precursor 0.0044 0.074 0.074
Loa Loa (eye worm) cytoplasmic intermediate filament protein 0.0017 0.0209 0.0209
Brugia malayi GTP-binding regulatory protein alpha chain - starfish, putative 0.0008 0.0019 0.0019
Brugia malayi Nuclear hormone receptor family member nhr-49 0.0012 0.0107 0.0107
Echinococcus granulosus lamin 0.0033 0.0506 0.1274
Mycobacterium tuberculosis Probable acetylornithine aminotransferase ArgD 0.0044 0.074 0.072
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.018 0.339 0.8541
Loa Loa (eye worm) G protein alpha subunit 3 0.0008 0.0019 0.0019
Schistosoma mansoni RAR-like nuclear receptor 0.0012 0.0107 0.0273
Schistosoma mansoni thyroid hormone receptor 0.0012 0.0107 0.0273
Onchocerca volvulus Steroid hormone receptor family member cnr14 homolog 0.0012 0.0107 0.0088
Loa Loa (eye worm) heterotrimeric G protein alpha subunit 0.0008 0.0019 0.0019
Schistosoma mansoni GTP-binding protein (q) alpha-11 subunit gna11 0.0008 0.0019 0.0048
Loa Loa (eye worm) paired box protein 0.001 0.0061 0.0061
Onchocerca volvulus 0.0033 0.0506 0.0488
Loa Loa (eye worm) hypothetical protein 0.0015 0.0164 0.0164
Schistosoma mansoni coup transcription factor 0.0012 0.0107 0.0273
Mycobacterium ulcerans ornithine aminotransferase RocD1 and RocD2 0.0044 0.074 0.072
Loa Loa (eye worm) nuclear hormone receptor family member nhr-14 0.0012 0.0107 0.0107
Brugia malayi Guanine nucleotide-binding protein alpha-12 subunit, putative 0.0008 0.0019 0.0019
Schistosoma mansoni retinoic acid receptor RXR 0.0012 0.0107 0.0273
Plasmodium falciparum ornithine aminotransferase 0.0044 0.074 1
Brugia malayi guanine nucleotide-binding protein G(o), alpha subunit, putative 0.0008 0.0019 0.0019
Schistosoma mansoni steroid hormone receptor ad4bp 0.0012 0.0107 0.0273
Loa Loa (eye worm) guanine nucleotide-binding protein alpha-6 subunit 0.0008 0.0019 0.0019
Loa Loa (eye worm) hypothetical protein 0.0012 0.0107 0.0107
Brugia malayi Nuclear hormone receptor family member nhr-1 0.0012 0.0107 0.0107
Onchocerca volvulus Protein ultraspiracle homolog 0.0012 0.0107 0.0088
Echinococcus multilocularis Ataxin 2, N terminal,domain containing protein 0.0012 0.0095 0.0239
Loa Loa (eye worm) nuclear hormone receptor family member nhr-49 0.0012 0.0107 0.0107
Brugia malayi Nuclear hormone receptor family member nhr-41 0.0012 0.0107 0.0107
Brugia malayi Gooseberry protein 0.001 0.0061 0.0061
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0012 0.0107 0.0269
Brugia malayi Guanine nucleotide-binding protein alpha-3 subunit, putative 0.0008 0.0019 0.0019
Brugia malayi Nuclear hormone receptor-like 1 0.0012 0.0107 0.0107
Loa Loa (eye worm) hypothetical protein 0.0008 0.0019 0.0019
Echinococcus multilocularis FTZ F1 alpha 0.0012 0.0107 0.0269
Loa Loa (eye worm) hypothetical protein 0.0012 0.0107 0.0107
Schistosoma mansoni tyrosine kinase 0.0206 0.391 1
Echinococcus granulosus guanine nucleotide binding protein G protein 0.0008 0.0019 0.0047
Echinococcus granulosus guanine nucleotide binding protein subunit 0.0008 0.0019 0.0047
Schistosoma mansoni ornithine--oxo-acid transaminase 0.0044 0.074 0.1891
Schistosoma mansoni lamin 0.0033 0.0506 0.1294
Brugia malayi hypothetical protein 0.0017 0.0195 0.0195
Trypanosoma cruzi hypothetical protein, conserved 0.0206 0.3896 1
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.018 0.339 0.8669
Loa Loa (eye worm) hypothetical protein 0.0008 0.0019 0.0019
Echinococcus multilocularis paired box protein pax 6 0.001 0.0061 0.0155
Echinococcus multilocularis COUP TF:Svp nuclear hormone receptor 0.0012 0.0107 0.0269
Brugia malayi 'Paired box' domain containing protein 0.001 0.0061 0.0061
Mycobacterium ulcerans glutamate-1-semialdehyde aminotransferase 0.0044 0.074 0.072
Entamoeba histolytica G protein alpha subunit, putative 0.0008 0.0019 0.5
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0012 0.0107 0.0269
Mycobacterium ulcerans hypothetical protein 0.0313 0.6002 1
Schistosoma mansoni photoreceptor-specific nuclear receptor related 0.0012 0.0107 0.0273
Echinococcus multilocularis paired box protein pax 6 0.001 0.0061 0.0155
Loa Loa (eye worm) hypothetical protein 0.0008 0.0019 0.0019
Mycobacterium ulcerans 4-aminobutyrate aminotransferase 0.0044 0.074 0.072
Toxoplasma gondii ornithine aminotransferase, mitochondrial precursor, putative 0.0044 0.074 1
Loa Loa (eye worm) hypothetical protein 0.0012 0.0107 0.0107
Mycobacterium tuberculosis Probable ornithine aminotransferase (N-terminus part) RocD1 (ornithine--oxo-acid aminotransferase) 0.0044 0.074 0.072
Echinococcus multilocularis paired box protein pax 1 0.001 0.0061 0.0155
Brugia malayi Intermediate filament tail domain containing protein 0.0033 0.0506 0.0506
Echinococcus granulosus hepatocyte nuclear factor 4 alpha 0.0012 0.0107 0.0269
Brugia malayi Guanine nucleotide-binding protein alpha-6 subunit, putative 0.0008 0.0019 0.0019
Loa Loa (eye worm) nuclear hormone receptor family member nhr-1 0.0012 0.0107 0.0107
Mycobacterium ulcerans adenosylmethionine-8-amino-7-oxononanoate aminotransferase 0.0313 0.6002 1
Brugia malayi paired box protein 0.001 0.0061 0.0061
Echinococcus granulosus lamin dm0 0.0033 0.0506 0.1274
Mycobacterium tuberculosis Probable aminotransferase 0.0313 0.6002 1
Mycobacterium leprae PROBABLE ADENOSYLMETHIONINE-8-AMINO-7-OXONONANOATE AMINOTRANSFERASE BIOA 0.0313 0.6002 1
Schistosoma mansoni GTP-binding protein alpha subunit 0.0008 0.0019 0.0048
Echinococcus multilocularis hepatocyte nuclear factor 4 alpha 0.0012 0.0107 0.0269
Onchocerca volvulus 0.001 0.0061 0.0043
Loa Loa (eye worm) steroid hormone receptor 0.0012 0.0107 0.0107
Schistosoma mansoni thyroid hormone receptor 0.0012 0.0107 0.0273
Leishmania major hypothetical protein, conserved 0.0206 0.3896 1
Brugia malayi G-protein alpha subunit 0.0008 0.0019 0.0019
Echinococcus granulosus FTZ F1 nuclear receptor protein 0.0012 0.0107 0.0269
Loa Loa (eye worm) hypothetical protein 0.0032 0.0494 0.0494
Onchocerca volvulus Bile acid receptor homolog 0.0012 0.0107 0.0088
Echinococcus granulosus ecdysone induced protein 78C 0.0012 0.0107 0.0269
Loa Loa (eye worm) hypothetical protein 0.0012 0.0107 0.0107
Brugia malayi vab-3 gene. 0.001 0.0061 0.0061
Echinococcus multilocularis FTZ F1 nuclear receptor protein 0.0012 0.0107 0.0269
Echinococcus granulosus paired box protein pax 6 0.001 0.0061 0.0155
Schistosoma mansoni GTP-binding protein (I) alpha-1subunit gnai1 0.0008 0.0019 0.0048
Echinococcus granulosus COUP TF:Svp nuclear hormone receptor 0.0012 0.0107 0.0269
Echinococcus multilocularis paired box protein pax 6 0.001 0.0061 0.0155
Echinococcus granulosus citrate lyase subunit beta protein 0.0024 0.0331 0.0835
Schistosoma mansoni paired box protein pax-6 0.001 0.0061 0.0157
Brugia malayi Nuclear hormone receptor family member nhr-40 0.0012 0.0107 0.0107
Wolbachia endosymbiont of Brugia malayi acetylornithine transaminase protein 0.0044 0.074 0.5
Mycobacterium ulcerans acetylornithine aminotransferase 0.0044 0.074 0.072
Leishmania major hypothetical protein, conserved 0.0026 0.0374 0.012
Echinococcus multilocularis thyroid hormone receptor alpha 0.0012 0.0107 0.0269
Loa Loa (eye worm) nuclear hormone receptor family member nhr-31 0.0012 0.0107 0.0107
Onchocerca volvulus 0.0517 1 1
Brugia malayi hypothetical protein 0.0026 0.0374 0.0374
Schistosoma mansoni GTP-binding protein alpha subunit gna 0.0008 0.0019 0.0048
Loa Loa (eye worm) nuclear hormone receptor family member nhr-41 0.0012 0.0107 0.0107
Echinococcus multilocularis tyrosine protein kinase Abl 0.0085 0.1539 0.3879
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0012 0.0107 0.0269
Echinococcus granulosus guanine nucleotide binding protein subunit 0.0008 0.0019 0.0047
Brugia malayi cytoplasmic intermediate filament protein 0.0017 0.0209 0.0209
Chlamydia trachomatis glutamate-1-semialdehyde-2,1-aminomutase 0.0044 0.074 0.5
Echinococcus multilocularis Aminotransferase class III 0.0044 0.074 0.1863
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0012 0.0107 0.0107
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0012 0.0107 0.0107
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0012 0.0107 0.0269
Echinococcus multilocularis gtp binding protein (I) alpha 1subunit 0.0008 0.0019 0.0047
Brugia malayi guanine nucleotide-binding protein G-o protein alpha subunit 0.0008 0.0019 0.0019
Echinococcus granulosus guanine nucleotide binding protein G protein 0.0008 0.0019 0.0047
Mycobacterium tuberculosis Probable glutamate-1-semialdehyde 2,1-aminomutase HemL (GSA) (glutamate-1-semialdehyde aminotransferase) (GSA-at) 0.0044 0.074 0.072
Trichomonas vaginalis acetylornithine aminotransferase, putative 0.0313 0.6002 1
Schistosoma mansoni GTP-binding protein (I) alpha-1subunit gnai1 0.0008 0.0019 0.0048
Echinococcus granulosus paired box protein pax 6 0.001 0.0061 0.0155
Echinococcus multilocularis musashi 0.0033 0.0506 0.1274
Brugia malayi Nuclear hormone receptor family member nhr-31 0.0012 0.0107 0.0107
Echinococcus granulosus expressed protein 0.0008 0.0019 0.0047
Mycobacterium tuberculosis Probable L-lysine-epsilon aminotransferase Lat (L-lysine aminotransferase) (lysine 6-aminotransferase) 0.0044 0.074 0.072
Mycobacterium ulcerans 4-aminobutyrate aminotransferase 0.0044 0.074 0.072
Loa Loa (eye worm) pax transcription factor protein 2 0.0517 1 1
Trypanosoma cruzi PAB1-binding protein , putative 0.0026 0.0374 0.012
Loa Loa (eye worm) hypothetical protein 0.0026 0.0374 0.0374
Echinococcus granulosus ornithine aminotransferase 0.0044 0.074 0.1863
Loa Loa (eye worm) hypothetical protein 0.0012 0.0107 0.0107
Echinococcus multilocularis guanine nucleotide binding protein (G protein) 0.0008 0.0019 0.0047
Echinococcus granulosus cytoplasmic intermediate filament protein 0.0016 0.0175 0.0442
Loa Loa (eye worm) vab-3 0.001 0.0061 0.0061
Echinococcus granulosus gtp binding protein I alpha 1subunit 0.0008 0.0019 0.0047
Loa Loa (eye worm) hypothetical protein 0.0012 0.0107 0.0107
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.018 0.339 0.8541
Brugia malayi Tyrosine-protein kinase abl-1 0.0085 0.1539 0.1539
Echinococcus granulosus tyrosine protein kinase ABL1 0.0209 0.3969 1
Loa Loa (eye worm) GTP-binding regulatory protein alpha chain 0.0008 0.0019 0.0019
Brugia malayi 'Paired box' domain containing protein 0.001 0.0061 0.0061
Loa Loa (eye worm) guanine nucleotide-binding protein alpha-12 subunit 0.0008 0.0019 0.0019
Schistosoma mansoni retinoid-x-receptor (RXR) 0.0012 0.0107 0.0273
Brugia malayi nuclear hormone receptor 0.0012 0.0107 0.0107
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0012 0.0107 0.0107
Echinococcus granulosus retinoic acid receptor rxr beta a 0.0012 0.0107 0.0269
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.018 0.339 0.8669
Echinococcus multilocularis cytoplasmic intermediate filament protein 0.0016 0.0175 0.0442
Schistosoma mansoni GTP-binding protein (I) alpha-2 subunit gnai2 0.0008 0.0019 0.0048
Schistosoma mansoni paired box protein pax-1-related 0.001 0.0061 0.0157
Brugia malayi nuclear receptor NHR-88 0.0012 0.0107 0.0107
Schistosoma mansoni Tr4/Tr2 (homologue) 0.0012 0.0107 0.0273
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0012 0.0107 0.0107
Loa Loa (eye worm) hypothetical protein 0.0012 0.0107 0.0107
Loa Loa (eye worm) TK/ABL protein kinase 0.0209 0.3969 0.3969
Loa Loa (eye worm) hypothetical protein 0.0033 0.0506 0.0506
Loa Loa (eye worm) hypothetical protein 0.001 0.0061 0.0061
Echinococcus multilocularis lamin dm0 0.0033 0.0506 0.1274

Activities

Activity type Activity value Assay description Source Reference
Potency (functional) = 0.0032 um PUBCHEM_BIOASSAY: qHTS Assay for Modulators of Lamin A Splicing. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) = 17.7828 um PUBCHEM_BIOASSAY: qHTS for inhibitors of ROR gamma transcriptional activity. (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) 89.1251 uM PUBCHEM_BIOASSAY: qHTS for Inhibitors of Polymerase Iota. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID588623] ChEMBL. No reference
Potency (functional) = 100 um PUBCHEM_BIOASSAY: qHTS Assay for the Inhibitors of Schistosoma Mansoni Peroxiredoxins. (Class of assay: confirmatory) [Related pubchem assays: 1011 (Confirmation Concentration-Response Assay for Inhibitors of the Schistosoma mansoni Redox Cascade ), 448 (Schistosoma Mansoni Peroxiredoxins (Prx2) and thioredoxin glutathione reductase (TGR) coupled assay)] ChEMBL. No reference

Phenotypes

Whole-cell/tissue/organism interactions

Species name Source Reference Is orphan
Plasmodium falciparum ChEMBL23

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

Annotated phenotypes:

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

External resources for this compound

Bibliographic References

No literature references available for this target.

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