Detailed information for compound 1570456

Basic information

Technical information
  • TDR Targets ID: 1570456
  • Name: 5-[(4-fluorophenyl)methylsulfonylmethyl]-N-[2 -(4-methylphenyl)ethyl]furan-2-carboxamide
  • MW: 415.478 | Formula: C22H22FNO4S
  • H donors: 1 H acceptors: 3 LogP: 3.72 Rotable bonds: 9
    Rule of 5 violations (Lipinski): 1
  • SMILES: Cc1ccc(cc1)CCNC(=O)c1ccc(o1)CS(=O)(=O)Cc1ccc(cc1)F
  • InChi: 1S/C22H22FNO4S/c1-16-2-4-17(5-3-16)12-13-24-22(25)21-11-10-20(28-21)15-29(26,27)14-18-6-8-19(23)9-7-18/h2-11H,12-15H2,1H3,(H,24,25)
  • InChiKey: NRCBHBIYTRDZEX-UHFFFAOYSA-N  

Network

Hover on a compound node to display the structore

Synonyms

  • 5-[(4-fluorophenyl)methylsulfonylmethyl]-N-[2-(4-methylphenyl)ethyl]-2-furancarboxamide
  • 5-[(4-fluorobenzyl)sulfonylmethyl]-N-[2-(4-methylphenyl)ethyl]-2-furamide

Targets

Known targets for this compound

No curated genes were found associated with this compound

Predicted pathogen targets for this compound

By orthology
No druggable targets predicted by orthology data
By sequence similarity to non orthologous known druggable targets
No druggable targets predicted by sequence similarity

Obtained from network model

Ranking Plot


Putative Targets List


Species Potential target Raw Global Species
Loa Loa (eye worm) histone deacetylase 3 0.0265 0.1423 0.844
Echinococcus multilocularis protoporphyrinogen oxidase 0.0044 0.0161 0.0495
Toxoplasma gondii histone deacetylase HDAC4 0.0131 0.0656 0.0608
Trichomonas vaginalis rotamase, putative 0.0032 0.0089 0.0388
Plasmodium vivax acyl-CoA synthetase, putative 0.0035 0.0105 0.0054
Toxoplasma gondii histone lysine-specific demethylase 0.0044 0.0161 0.011
Echinococcus multilocularis BC026374 protein (S09 family) 0.0022 0.0035 0.0055
Mycobacterium ulcerans 3-phosphoshikimate 1-carboxyvinyltransferase 0.0293 0.1584 0.1554
Mycobacterium ulcerans flavin-containing monoamine oxidase AofH 0.063 0.351 0.3487
Trypanosoma cruzi hypothetical protein, conserved 0.003 0.008 0.0175
Trypanosoma cruzi histone deacetylase, putative 0.0131 0.0656 0.37
Loa Loa (eye worm) hypothetical protein 0.0046 0.0171 0.0987
Brugia malayi ecdysteroid receptor 0.002 0.002 0.0083
Trypanosoma brucei histone deacetylase 3 0.0311 0.1685 1
Schistosoma mansoni amine oxidase 0.0044 0.0161 0.0495
Chlamydia trachomatis protoporphyrinogen oxidase 0.0044 0.0161 0.0081
Plasmodium vivax replication factor C subunit 1, putative 0.003 0.008 0.0029
Brugia malayi Nuclear hormone receptor family member nhr-41 0.002 0.002 0.0083
Echinococcus multilocularis histone deacetylase 1 0.0265 0.1423 0.4929
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0051 0.0197 0.1137
Schistosoma mansoni BC026374 protein (S09 family) 0.0022 0.0035 0.0055
Brugia malayi latrophilin 2 splice variant baaae 0.0035 0.0105 0.0591
Loa Loa (eye worm) carboxylesterase 0.0133 0.0667 0.394
Loa Loa (eye worm) CMGC/CDK/CDC2 protein kinase 0.0042 0.0149 0.0856
Mycobacterium ulcerans 3-dehydroquinate synthase 0.0114 0.056 0.0526
Echinococcus granulosus expressed protein 0.0033 0.0094 0.0298
Echinococcus multilocularis histone deacetylase 0.0311 0.1685 0.5848
Echinococcus granulosus replication factor c subunit 1 0.003 0.008 0.0254
Trypanosoma cruzi histone deacetylase 1, putative 0.0265 0.1423 0.8397
Loa Loa (eye worm) hypothetical protein 0.0035 0.0105 0.0589
Brugia malayi Nuclear hormone receptor family member nhr-25 0.002 0.002 0.0083
Trypanosoma cruzi FHA domain containing protein, putative 0.003 0.008 0.0175
Echinococcus granulosus histone deacetylase 6 0.0311 0.1685 0.5367
Leishmania major histone deacetylase, putative 0.0265 0.1423 0.8397
Loa Loa (eye worm) carboxylesterase 0.0022 0.0035 0.0177
Mycobacterium leprae PROBABLE FATTY-ACID-CoA LIGASE FADD7 (FATTY-ACID-CoA SYNTHETASE) (FATTY-ACID-CoA SYNTHASE) 0.0046 0.0171 0.0191
Trichomonas vaginalis conserved hypothetical protein 0.0028 0.0065 0.0214
Loa Loa (eye worm) hypothetical protein 0.0046 0.0171 0.0987
Echinococcus granulosus macrophage colony stimulating factor 1 receptor 0.0565 0.314 1
Echinococcus multilocularis replication factor c subunit 1 0.003 0.008 0.0211
Echinococcus multilocularis nibrin 0.003 0.008 0.0211
Trypanosoma brucei BRCA1 C Terminus (BRCT) domain containing protein, putative 0.003 0.008 0.0175
Loa Loa (eye worm) acetylcholinesterase 1 0.0133 0.0667 0.394
Echinococcus multilocularis cyclin dependent kinase 0.0042 0.0149 0.0456
Loa Loa (eye worm) hypothetical protein 0.0035 0.0105 0.0589
Echinococcus granulosus histone deacetylase 6 0.0311 0.1685 0.5367
Schistosoma mansoni neuroligin 3 (S09 family) 0.0022 0.0035 0.0055
Brugia malayi nuclear hormone receptor 0.002 0.002 0.0083
Leishmania major 4-coumarate:coa ligase-like protein 0.0046 0.0171 0.0737
Echinococcus granulosus BC026374 protein S09 family 0.0022 0.0035 0.0113
Schistosoma mansoni histone deacetylase 0.0265 0.1423 0.4929
Loa Loa (eye worm) hypothetical protein 0.012 0.0596 0.3513
Schistosoma mansoni serine/threonine protein kinase 0.0042 0.0149 0.0456
Schistosoma mansoni histone deacetylase 0.0265 0.1423 0.4929
Brugia malayi hypothetical protein 0.0025 0.0051 0.0271
Plasmodium falciparum conserved Plasmodium protein, unknown function 0.0044 0.0161 0.011
Toxoplasma gondii histone deacetylase HDAC3 0.0265 0.1423 0.1379
Trypanosoma cruzi histone deacetylase, putative 0.0311 0.1685 1
Echinococcus granulosus cyclin dependent kinase 0.0042 0.0149 0.0476
Loa Loa (eye worm) hypothetical protein 0.002 0.002 0.0083
Loa Loa (eye worm) hypothetical protein 0.003 0.008 0.0441
Onchocerca volvulus 0.0022 0.0035 0.0247
Loa Loa (eye worm) hypothetical protein 0.018 0.0936 0.5541
Mycobacterium leprae 3-dehydroquinate synthase AroB 0.0114 0.056 0.0999
Chlamydia trachomatis dehyroquinate synthase 0.0114 0.056 0.0484
Mycobacterium leprae probable 3-phosphoshikimate 1-carboxyvinyl transferase AroA (5-ENOLPYRUVYLSHIKIMATE-3-PHOSPHATE SYNTHASE) (EPSP SYNTHASE) (EPSPS 0.0293 0.1584 0.3131
Trichomonas vaginalis histone deacetylase, putative 0.0265 0.1423 1
Echinococcus granulosus histone deacetylase 7 0.0311 0.1685 0.5367
Trichomonas vaginalis conserved hypothetical protein 0.003 0.008 0.032
Loa Loa (eye worm) hypothetical protein 0.0035 0.0105 0.0589
Loa Loa (eye worm) hypothetical protein 0.0022 0.0035 0.0177
Loa Loa (eye worm) histone deacetylase 11 0.0131 0.0656 0.387
Trichomonas vaginalis CMGC family protein kinase 0.0042 0.0149 0.0822
Plasmodium vivax histone deacetylase, putative 0.0131 0.0656 0.0608
Plasmodium vivax hypothetical protein, conserved 0.0044 0.0161 0.011
Brugia malayi ATP dependent DNA ligase C terminal region family protein 0.003 0.008 0.0441
Onchocerca volvulus 0.0048 0.0183 0.2575
Loa Loa (eye worm) hypothetical protein 0.0044 0.0161 0.0922
Loa Loa (eye worm) hypothetical protein 0.002 0.002 0.0083
Mycobacterium ulcerans flavin-containing monoamine oxidase AofH 0.063 0.351 0.3487
Mycobacterium leprae Chorismate synthase AroF (5-enolpyruvylshikimate-3-phosphate phospholyase). 0.087 0.4884 1
Toxoplasma gondii histone deacetylase HDAC1 0.0311 0.1685 0.1643
Echinococcus multilocularis histone deacetylase 6 0.0311 0.1685 0.5848
Schistosoma mansoni histone deacetylase 1 2 3 0.0131 0.0656 0.2233
Echinococcus multilocularis lysine specific histone demethylase 1A 0.0044 0.0161 0.0495
Brugia malayi Protein kinase domain containing protein 0.0042 0.0149 0.0856
Leishmania major cell division protein kinase 2,cdc2-related kinase 0.0042 0.0149 0.0602
Loa Loa (eye worm) hypothetical protein 0.0044 0.0161 0.0922
Plasmodium vivax histone deacetylase 2, putative 0.0311 0.1685 0.1643
Entamoeba histolytica acyl-CoA synthetase, putative 0.0046 0.0171 0.0683
Loa Loa (eye worm) hypothetical protein 0.0022 0.0035 0.0177
Chlamydia trachomatis phosphoshikimate 1-carboxyl vinyltransferase 0.0293 0.1584 0.1516
Trichomonas vaginalis histone deacetylase, putative 0.0265 0.1423 1
Loa Loa (eye worm) hypothetical protein 0.002 0.002 0.0083
Onchocerca volvulus 0.0046 0.0171 0.2387
Echinococcus granulosus histone deacetylase 3 0.0265 0.1423 0.4533
Toxoplasma gondii peptidylprolyl isomerase 0.0032 0.0089 0.0038
Plasmodium vivax histone deacetylase, putative 0.0311 0.1685 0.1643
Brugia malayi Carboxylesterase family protein 0.0022 0.0035 0.0177
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0139 0.07 0.4134
Loa Loa (eye worm) hypothetical protein 0.0133 0.0667 0.394
Loa Loa (eye worm) hypothetical protein 0.0042 0.0147 0.0841
Schistosoma mansoni DNA ligase IV 0.003 0.008 0.0211
Echinococcus granulosus carboxylesterase 5A 0.0133 0.0667 0.2126
Trypanosoma brucei histone deacetylase 1 0.0265 0.1423 0.8397
Mycobacterium ulcerans protoporphyrinogen oxidase 0.0044 0.0161 0.0126
Echinococcus granulosus histone deacetylase 1 0.0265 0.1423 0.4533
Mycobacterium ulcerans monoamine oxidase 0.0044 0.0161 0.0126
Brugia malayi histone deacetylase 11 0.0131 0.0656 0.387
Loa Loa (eye worm) CMGC/CDK/CDK5 protein kinase 0.0042 0.0149 0.0856
Brugia malayi Pax transcription activation domain interacting protein 0.003 0.008 0.0441
Brugia malayi Carboxylesterase family protein 0.0022 0.0035 0.0177
Mycobacterium ulcerans dehydrogenase 0.0044 0.0161 0.0126
Loa Loa (eye worm) hypothetical protein 0.0022 0.0035 0.0177
Echinococcus granulosus cyclin dependent kinase 5 0.0042 0.0149 0.0476
Loa Loa (eye worm) hypothetical protein 0.002 0.002 0.0083
Loa Loa (eye worm) heterochromatin protein 1 0.007 0.0306 0.1786
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0139 0.07 0.2389
Toxoplasma gondii cell-cycle-associated protein kinase CDK, putative 0.0042 0.0149 0.0099
Trichomonas vaginalis conserved hypothetical protein 0.0028 0.0065 0.0214
Loa Loa (eye worm) hypothetical protein 0.002 0.002 0.0083
Echinococcus multilocularis expressed protein 0.0033 0.0094 0.026
Loa Loa (eye worm) nuclear hormone receptor family member nhr-14 0.002 0.002 0.0083
Loa Loa (eye worm) hypothetical protein 0.0044 0.0161 0.0922
Echinococcus multilocularis carboxylesterase 5A 0.0133 0.0667 0.2275
Plasmodium falciparum histone deacetylase, putative 0.0311 0.1685 0.1643
Loa Loa (eye worm) hypothetical protein 0.0186 0.0971 0.5748
Echinococcus granulosus histone deacetylase 0.0311 0.1685 0.5367
Leishmania major UDP-galactopyranose mutase 0.0044 0.0161 0.067
Entamoeba histolytica cell division protein kinase 2, putative 0.0042 0.0149 0.0519
Onchocerca volvulus 0.0022 0.0035 0.0247
Brugia malayi photoreceptor-specific nuclear receptor 0.002 0.002 0.0083
Trypanosoma cruzi BRCA1 C Terminus (BRCT) domain containing protein, putative 0.003 0.008 0.0175
Trypanosoma cruzi histone deacetylase, putative 0.0131 0.0656 0.37
Echinococcus granulosus chromobox protein 1 0.007 0.0306 0.0973
Trypanosoma cruzi histone deacetylase 1, putative 0.0265 0.1423 0.8397
Schistosoma mansoni hypothetical protein 0.0035 0.0105 0.0299
Plasmodium vivax lysine-specific histone demethylase 1, putative 0.0044 0.0161 0.011
Plasmodium falciparum chorismate synthase 0.1764 1 1
Mycobacterium ulcerans oxidoreductase 0.0044 0.0161 0.0126
Trypanosoma cruzi hypothetical protein, conserved 0.003 0.008 0.0175
Echinococcus multilocularis histone deacetylase 6 0.0311 0.1685 0.5848
Loa Loa (eye worm) hypothetical protein 0.003 0.008 0.0441
Loa Loa (eye worm) nuclear hormone receptor family member nhr-41 0.002 0.002 0.0083
Brugia malayi Nuclear hormone receptor family member nhr-3 0.002 0.002 0.0083
Mycobacterium ulcerans acyl-CoA synthetase 0.0046 0.0171 0.0137
Loa Loa (eye worm) hypothetical protein 0.0252 0.1346 0.798
Echinococcus multilocularis para nitrobenzyl esterase 0.0022 0.0035 0.0055
Leishmania major histone deacetylase, putative 0.0311 0.1685 1
Brugia malayi chromobox protein homolog 3 0.0039 0.013 0.0743
Mycobacterium tuberculosis Probable chain -fatty-acid-CoA ligase FadD13 (fatty-acyl-CoA synthetase) 0.0046 0.0171 0.0281
Echinococcus multilocularis neuroligin 0.0022 0.0035 0.0055
Brugia malayi AMP-binding enzyme family protein 0.0046 0.0171 0.0987
Giardia lamblia Histone deacetylase 0.0265 0.1423 1
Loa Loa (eye worm) hypothetical protein 0.0022 0.0035 0.0177
Echinococcus granulosus retinoic acid receptor rxr beta a 0.002 0.002 0.0063
Loa Loa (eye worm) MH2 domain-containing protein 0.0119 0.059 0.3481
Brugia malayi hypothetical protein 0.012 0.0596 0.3513
Brugia malayi Histone deacetylase family protein 0.0311 0.1685 1
Loa Loa (eye worm) hypothetical protein 0.003 0.008 0.0441
Leishmania major histone deacetylase, putative 0.0311 0.1685 1
Toxoplasma gondii histone deacetylase HDAC5 0.0131 0.0656 0.0608
Mycobacterium tuberculosis Probable flavin-containing monoamine oxidase AofH (amine oxidase) (MAO) 0.0585 0.3256 0.6643
Toxoplasma gondii histone deacetylase HDAC2 0.0265 0.1423 0.1379
Schistosoma mansoni chromobox protein 0.007 0.0306 0.1004
Echinococcus granulosus lysine specific histone demethylase 1A 0.0044 0.0161 0.0511
Schistosoma mansoni topbp1 0.003 0.008 0.0211
Brugia malayi Histone deacetylase family protein 0.0311 0.1685 1
Trypanosoma cruzi peptidyl-prolyl cis-trans isomerase 0.0032 0.0089 0.0233
Loa Loa (eye worm) hypothetical protein 0.0048 0.0183 0.1058
Mycobacterium ulcerans chorismate synthase 0.1764 1 1
Loa Loa (eye worm) histone deacetylase 7A 0.0311 0.1685 1
Schistosoma mansoni cyclin-dependent kinase 5 activator 0.0252 0.1346 0.4657
Echinococcus granulosus ecdysone induced protein 78C 0.002 0.002 0.0063
Brugia malayi Carboxylesterase family protein 0.0022 0.0035 0.0177
Brugia malayi Carboxylesterase family protein 0.0133 0.0667 0.394
Brugia malayi histone deacetylase 1 (HD1) 0.0265 0.1423 0.844
Toxoplasma gondii histone lysine-specific demethylase LSD1/BHC110/KDMA1A 0.0044 0.0161 0.011
Mycobacterium ulcerans fatty-acid-CoA ligase 0.0046 0.0171 0.0137
Echinococcus granulosus acetylcholinesterase 0.0133 0.0667 0.2126
Entamoeba histolytica acyl-CoA synthetase, putative 0.0046 0.0171 0.0683
Brugia malayi Heterochromatin protein 1 0.007 0.0306 0.1786
Brugia malayi Calcitonin receptor-like protein seb-1 0.0051 0.0197 0.1137
Schistosoma mansoni rotamase 0.0033 0.0094 0.026
Echinococcus granulosus COUP TF:Svp nuclear hormone receptor 0.002 0.002 0.0063
Schistosoma mansoni family S9 non-peptidase homologue (S09 family) 0.0022 0.0035 0.0055
Echinococcus granulosus lysine specific histone demethylase 1A 0.0044 0.0161 0.0511
Brugia malayi MH2 domain containing protein 0.0119 0.059 0.3481
Loa Loa (eye worm) hypothetical protein 0.002 0.002 0.0083
Toxoplasma gondii shikimate dehydrogenase substrate binding domain-containing protein 0.0293 0.1584 0.1541
Trichomonas vaginalis chromobox protein, putative 0.007 0.0306 0.1948
Loa Loa (eye worm) hypothetical protein 0.0044 0.0161 0.0922
Schistosoma mansoni family S9 non-peptidase homologue (S09 family) 0.0022 0.0035 0.0055
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD2 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0046 0.0171 0.0281
Mycobacterium tuberculosis Fatty-acid-AMP ligase FadD30 (fatty-acid-AMP synthetase) (fatty-acid-AMP synthase) 0.0035 0.0105 0.0143
Mycobacterium ulcerans fatty-acid-CoA ligase 0.0035 0.0105 0.0069
Mycobacterium ulcerans NAD-dependent DNA ligase LigA 0.003 0.008 0.0045
Brugia malayi Carboxylesterase family protein 0.0133 0.0667 0.394
Onchocerca volvulus Heterochromatin protein 1 homolog 0.0039 0.013 0.1741
Onchocerca volvulus 0.003 0.008 0.0944
Echinococcus multilocularis histone deacetylase 7 0.0311 0.1685 0.5848
Trichomonas vaginalis replication factor C large subunit, putative 0.003 0.008 0.032
Mycobacterium leprae PROBABLE FATTY-ACID-CoA LIGASE FADD2 (FATTY-ACID-CoA SYNTHETASE) (FATTY-ACID-CoA SYNTHASE) 0.0046 0.0171 0.0191
Chlamydia trachomatis acylglycerophosphoethanolamine acyltransferase 0.0035 0.0105 0.0025
Echinococcus multilocularis cyclin dependent kinase 1 0.0042 0.0149 0.0456
Entamoeba histolytica acyl-coA synthetase, putative 0.0046 0.0171 0.0683
Toxoplasma gondii ATPase, AAA family protein 0.003 0.008 0.0029
Loa Loa (eye worm) transcription factor SMAD2 0.0119 0.059 0.3481
Trichomonas vaginalis RNA polymerase II ctd phosphatase, putative 0.003 0.008 0.032
Loa Loa (eye worm) hypothetical protein 0.0131 0.0656 0.387
Trypanosoma cruzi cdc2-related kinase 1 0.0042 0.0149 0.0602
Trichomonas vaginalis chromobox protein, putative 0.0042 0.0147 0.0807
Mycobacterium tuberculosis Conserved hypothetical protein 0.0044 0.0161 0.0258
Entamoeba histolytica cell division protein kinase 2, putative 0.0042 0.0149 0.0519
Schistosoma mansoni histone deacetylase 4 5 0.0311 0.1685 0.5848
Brugia malayi Uncharacterized hematopoietic stem/progenitor cells protein MDS029 0.0107 0.0521 0.307
Loa Loa (eye worm) hypothetical protein 0.0051 0.0197 0.1137
Brugia malayi steroid hormone receptor 0.002 0.002 0.0083
Brugia malayi hypothetical protein 0.003 0.008 0.0441
Brugia malayi Pin1-type peptidyl-prolyl cis-trans isomerase, BmPin1 0.0033 0.0094 0.0524
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD3 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0033 0.0094 0.0121
Plasmodium falciparum protein kinase 5 0.0042 0.0149 0.0099
Echinococcus multilocularis cyclin dependent kinase 5 0.0042 0.0149 0.0456
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0139 0.07 0.2389
Trichomonas vaginalis conserved hypothetical protein 0.003 0.008 0.032
Loa Loa (eye worm) hypothetical protein 0.0025 0.0051 0.0271
Echinococcus granulosus neuroligin 0.0022 0.0035 0.0113
Loa Loa (eye worm) hypothetical protein 0.0044 0.0161 0.0922
Loa Loa (eye worm) hypothetical protein 0.0133 0.0667 0.394
Trypanosoma brucei histone deacetylase 2 0.0131 0.0656 0.37
Brugia malayi Carboxylesterase family protein 0.0022 0.0035 0.0177
Onchocerca volvulus Heterochromatin protein 1 homolog 0.0042 0.0147 0.2008
Onchocerca volvulus 0.0022 0.0035 0.0247
Echinococcus granulosus nibrin 0.003 0.008 0.0254
Schistosoma mansoni 3-dehydroquinate synthase 0.0114 0.056 0.1896
Echinococcus multilocularis cyclin dependent kinase 5 activator 1 0.0252 0.1346 0.4657
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.002 0.002 0.0083
Plasmodium falciparum protoporphyrinogen oxidase 0.0044 0.0161 0.011
Plasmodium vivax protoporphyrinogen oxidase, putative 0.0044 0.0161 0.011
Brugia malayi hypothetical protein 0.0044 0.0161 0.0922
Trichomonas vaginalis conserved hypothetical protein 0.003 0.008 0.032
Schistosoma mansoni family S9 non-peptidase homologue (S09 family) 0.0022 0.0035 0.0055
Brugia malayi hypothetical protein 0.003 0.008 0.0441
Brugia malayi topoisomerase 0.003 0.008 0.0441
Plasmodium vivax chorismate synthase 0.1764 1 1
Schistosoma mansoni serine/threonine protein kinase 0.0042 0.0149 0.0456
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0051 0.0197 0.1137
Onchocerca volvulus Histone deacetylase 10 homolog 0.0131 0.0656 1
Loa Loa (eye worm) nuclear hormone receptor family member nhr-49 0.002 0.002 0.0083
Mycobacterium leprae PROBABLE PROTOPORPHYRINOGEN OXIDASE HEMY (PROTOPORPHYRINOGEN-IX OXIDASE) (PROTOPORPHYRINOGENASE) (PPO) 0.0044 0.0161 0.0168
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD7 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0033 0.0094 0.0121
Onchocerca volvulus 0.0031 0.0082 0.0982
Echinococcus granulosus geminin 0.0518 0.2868 0.9133
Brugia malayi nuclear receptor NHR-88 0.002 0.002 0.0083
Trichomonas vaginalis histone deacetylase 1, 2 ,3, putative 0.0265 0.1423 1
Brugia malayi Nuclear hormone receptor family member nhr-40 0.002 0.002 0.0083
Echinococcus granulosus tumor protein p63 0.033 0.1797 0.5722
Brugia malayi Nuclear hormone receptor family member nhr-1 0.002 0.002 0.0083
Loa Loa (eye worm) steroid hormone receptor 0.002 0.002 0.0083
Trichomonas vaginalis histone deacetylase 1, 2 ,3, putative 0.0265 0.1423 1
Loa Loa (eye worm) hypothetical protein 0.0022 0.0035 0.0177
Brugia malayi Nuclear hormone receptor-like 1 0.002 0.002 0.0083
Echinococcus multilocularis cyclin dependent kinase 1 0.0042 0.0149 0.0456
Loa Loa (eye worm) hypothetical protein 0.0044 0.0161 0.0922
Loa Loa (eye worm) hypothetical protein 0.002 0.002 0.0083
Schistosoma mansoni Protoporphyrinogen oxidase chloroplast/mitochondrial precursor 0.0044 0.0161 0.0495
Mycobacterium tuberculosis Probable chorismate synthase AroF (5-enolpyruvylshikimate-3-phosphate phospholyase) 0.087 0.4884 1
Mycobacterium ulcerans long-chain-fatty-acid-CoA ligase 0.0046 0.0171 0.0137
Loa Loa (eye worm) hypothetical protein 0.0022 0.0035 0.0177
Mycobacterium tuberculosis Possible oxidoreductase 0.0044 0.0161 0.0258
Trypanosoma brucei cdc2-related kinase 1 0.0042 0.0149 0.0602
Brugia malayi AMP-binding enzyme family protein 0.0046 0.0171 0.0987
Trichomonas vaginalis conserved hypothetical protein 0.0039 0.013 0.0685
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0139 0.07 0.2389
Mycobacterium ulcerans long-chain-fatty-acid--CoA ligase 0.0046 0.0171 0.0137
Trichomonas vaginalis histone deacetylase, putative 0.0265 0.1423 1
Loa Loa (eye worm) hypothetical protein 0.0035 0.0105 0.0589
Loa Loa (eye worm) hypothetical protein 0.0035 0.0105 0.0589
Trichomonas vaginalis chromobox protein, putative 0.007 0.0306 0.1948
Loa Loa (eye worm) hypothetical protein 0.003 0.008 0.0441
Mycobacterium ulcerans acyl-CoA synthetase 0.0046 0.0171 0.0137
Schistosoma mansoni CDGSH-type Zn finger-containing protein-like protein 0.0268 0.1439 0.4985
Brugia malayi Nuclear hormone receptor family member nhr-49 0.002 0.002 0.0083
Plasmodium vivax histone deacetylase 1, putative 0.0265 0.1423 0.1379
Schistosoma mansoni family S9 non-peptidase homologue (S09 family) 0.0133 0.0667 0.2275
Loa Loa (eye worm) hypothetical protein 0.0046 0.0171 0.0987
Echinococcus granulosus nuclear receptor 2DBD gamma 0.002 0.002 0.0063
Schistosoma mansoni amine oxidase 0.0044 0.0161 0.0495
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD35 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0033 0.0094 0.0121
Chlamydia trachomatis UDP-N-acetylglucosamine 1-carboxyvinyltransferase 0.0179 0.0931 0.0858
Giardia lamblia Kinase, CMGC CDK 0.0042 0.0149 0.0519
Loa Loa (eye worm) Pin1-type peptidyl-prolyl cis-trans isomerase 0.0033 0.0094 0.0524
Brugia malayi Nuclear hormone receptor family member nhr-31 0.002 0.002 0.0083
Trichomonas vaginalis chromobox protein, putative 0.0042 0.0147 0.0807
Schistosoma mansoni hypothetical protein 0.0518 0.2868 1
Onchocerca volvulus 0.0107 0.0521 0.7887
Plasmodium vivax protein kinase Crk2 0.0042 0.0149 0.0099
Schistosoma mansoni histone deacetylase hda2 0.0131 0.0656 0.2233
Echinococcus granulosus FTZ F1 nuclear receptor protein 0.002 0.002 0.0063
Schistosoma mansoni gliotactin 0.0022 0.0035 0.0055
Echinococcus multilocularis tumor protein p63 0.033 0.1797 0.6239
Echinococcus granulosus Nuclear hormone receptor family member nhr 41 0.002 0.002 0.0063
Trichomonas vaginalis histone deacetylase, putative 0.0265 0.1423 1
Echinococcus granulosus nuclear receptor 2DBD gamma 0.002 0.002 0.0063
Mycobacterium ulcerans hypothetical protein 0.0046 0.0171 0.0137
Loa Loa (eye worm) nuclear hormone receptor family member nhr-40 0.002 0.002 0.0083
Trichomonas vaginalis conserved hypothetical protein 0.003 0.008 0.032
Schistosoma mansoni chromosome transmission fidelity factor 0.003 0.008 0.0211
Brugia malayi histone deacetylase 3 (HD3) 0.0265 0.1423 0.844
Trypanosoma cruzi cdc2-related kinase 3 0.0042 0.0149 0.0602
Schistosoma mansoni histone deacetylase 4 5 0.0311 0.1685 0.5848
Loa Loa (eye worm) nuclear hormone receptor family member nhr-31 0.002 0.002 0.0083
Entamoeba histolytica peptidyl-prolyl cis-trans isomerase, putative 0.0032 0.0089 0.0071
Mycobacterium ulcerans acyl-CoA synthetase 0.0046 0.0171 0.0137
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0139 0.07 0.2389
Loa Loa (eye worm) nuclear Hormone Receptor family member 0.002 0.002 0.0083
Echinococcus granulosus 5'partial|cyclin dependent kinase 1 0.0042 0.0149 0.0476
Trichomonas vaginalis chromosome transmission fidelity factor, putative 0.003 0.008 0.032
Loa Loa (eye worm) hypothetical protein 0.012 0.0596 0.3513
Loa Loa (eye worm) carboxylesterase 0.0022 0.0035 0.0177
Toxoplasma gondii poly(ADP-ribose) polymerase catalytic domain-containing protein 0.003 0.008 0.0029
Loa Loa (eye worm) hypothetical protein 0.0107 0.0521 0.307
Trypanosoma brucei peptidyl-prolyl cis-trans isomerase/rotamase, putative 0.0032 0.0089 0.0233
Leishmania major 4-coumarate:coa ligase-like protein 0.0046 0.0171 0.0737
Loa Loa (eye worm) histone deacetylase 1 0.0265 0.1423 0.844
Leishmania major peptidyl-prolyl cis-trans isomerase/rotamase, putative,PPIase, putative 0.0032 0.0089 0.0233
Loa Loa (eye worm) hypothetical protein 0.002 0.002 0.0083
Brugia malayi Nuclear hormone receptor family member nhr-25 0.002 0.002 0.0083
Trypanosoma cruzi cdc2-related kinase 3 0.0042 0.0149 0.0602
Trichomonas vaginalis histone deacetylase, putative 0.0265 0.1423 1
Brugia malayi hypothetical protein 0.0022 0.0035 0.0177
Echinococcus granulosus acetylcholinesterase 0.0133 0.0667 0.2126
Mycobacterium ulcerans UDP-N-acetylglucosamine 1-carboxyvinyltransferase 0.0179 0.0931 0.0899
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0139 0.07 0.2389
Loa Loa (eye worm) nuclear hormone receptor family member nhr-1 0.002 0.002 0.0083
Trichomonas vaginalis conserved hypothetical protein 0.0039 0.013 0.0685
Trypanosoma cruzi histone deacetylase, putative 0.0311 0.1685 1
Schistosoma mansoni acetylcholinesterase 0.0022 0.0035 0.0055
Echinococcus multilocularis acetylcholinesterase 0.0133 0.0667 0.2275
Mycobacterium tuberculosis 3-dehydroquinate synthase AroB 0.0114 0.056 0.1081
Trichomonas vaginalis RNA polymerase II ctd phosphatase, putative 0.003 0.008 0.032
Echinococcus multilocularis histone deacetylase 6 0.0317 0.172 0.597
Loa Loa (eye worm) hypothetical protein 0.0035 0.0105 0.0591
Brugia malayi Nuclear hormone receptor family member nhr-14 0.002 0.002 0.0083
Trichomonas vaginalis conserved hypothetical protein 0.003 0.008 0.032
Schistosoma mansoni histone deacetylase hda2 0.0317 0.172 0.597
Trypanosoma brucei cdc2-related kinase 3 0.0042 0.0149 0.0602
Echinococcus granulosus histone deacetylase 8 0.0131 0.0656 0.2088
Trypanosoma brucei histone deacetylase, putative 0.0311 0.1685 1
Loa Loa (eye worm) hypothetical protein 0.003 0.008 0.0441
Echinococcus multilocularis chromobox protein 1 0.007 0.0306 0.1004
Echinococcus granulosus cyclin dependent kinase 5 activator 1 0.0252 0.1346 0.4286
Echinococcus multilocularis 0.0044 0.0161 0.0495
Loa Loa (eye worm) hypothetical protein 0.0022 0.0035 0.0177
Leishmania major 4-coumarate:coa ligase-like protein 0.0046 0.0171 0.0737
Echinococcus granulosus cyclin dependent kinase 1 0.0042 0.0149 0.0476
Brugia malayi amine oxidase, flavin-containing family protein 0.0044 0.0161 0.0922
Brugia malayi Histone deacetylase 1 0.0265 0.1423 0.844
Echinococcus multilocularis histone deacetylase 8 0.0131 0.0656 0.2233
Wolbachia endosymbiont of Brugia malayi UDP-N-acetylglucosamine 1-carboxyvinyltransferase 0.0179 0.0931 1
Toxoplasma gondii chorismate synthase, putative 0.1764 1 1
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0139 0.07 0.4134
Plasmodium falciparum acyl-CoA synthetase 0.0035 0.0105 0.0054
Schistosoma mansoni hypothetical protein 0.0518 0.2868 1
Trypanosoma cruzi peptidyl-prolyl cis-trans isomerase 0.0032 0.0089 0.0233
Echinococcus granulosus para nitrobenzyl esterase 0.0022 0.0035 0.0113
Echinococcus multilocularis acetylcholinesterase 0.0133 0.0667 0.2275
Trypanosoma cruzi histone deacetylase, putative 0.0311 0.1685 1
Leishmania major histone deacetylase, putative 0.0265 0.1423 0.8397
Schistosoma mansoni Lysine-specific histone demethylase 1 0.0044 0.0161 0.0495
Mycobacterium tuberculosis 3-phosphoshikimate 1-carboxyvinyltransferase AroA (5-enolpyruvylshikimate-3-phosphate synthase) (EPSP synthase) (EPSPS) 0.0114 0.056 0.1081
Plasmodium falciparum lysine-specific histone demethylase 1, putative 0.0044 0.0161 0.011
Plasmodium falciparum histone deacetylase 2 0.0311 0.1685 0.1643
Schistosoma mansoni cellular tumor antigen P53 0.0048 0.0183 0.0575
Echinococcus multilocularis histone deacetylase 3 0.0265 0.1423 0.4929
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0139 0.07 0.2229
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0139 0.07 0.2229
Trypanosoma cruzi UDP-galactopyranose mutase 0.0044 0.0161 0.067
Loa Loa (eye worm) hypothetical protein 0.0039 0.013 0.0743
Trypanosoma cruzi UDP-galactopyranose mutase 0.0044 0.0161 0.067
Brugia malayi Steroid receptor seven-up type 2 0.002 0.002 0.0083
Schistosoma mansoni topbp1 0.003 0.008 0.0211
Echinococcus multilocularis chromobox protein 1 0.007 0.0306 0.1004
Giardia lamblia Kinase, CMGC CDK 0.0042 0.0149 0.0519
Trypanosoma brucei histone deacetylase 4 0.0311 0.1685 1
Echinococcus granulosus hepatocyte nuclear factor 4 alpha 0.002 0.002 0.0063
Schistosoma mansoni chromobox protein 0.007 0.0306 0.1004
Echinococcus granulosus FTZ F1 alpha 0.002 0.002 0.0063
Mycobacterium ulcerans long-chain fatty-acid CoA ligase 0.0046 0.0171 0.0137
Brugia malayi SWIRM domain containing protein 0.0044 0.0161 0.0922
Onchocerca volvulus 0.0022 0.0035 0.0247
Echinococcus multilocularis family S9 non peptidase ue (S09 family) 0.0022 0.0035 0.0055
Plasmodium falciparum replication factor C subunit 1, putative 0.003 0.008 0.0029
Brugia malayi DKFZp564C0469 protein 0.003 0.008 0.0441
Trichomonas vaginalis rotamase, putative 0.0033 0.0094 0.042
Treponema pallidum UDP-N-acetylglucosamine 1-carboxyvinyltransferase 0.0179 0.0931 1
Schistosoma mansoni hypothetical protein 0.0268 0.1439 0.4985
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.002 0.002 0.0083
Trichomonas vaginalis histone deacetylase 1, 2 ,3, putative 0.0265 0.1423 1
Loa Loa (eye worm) hypothetical protein 0.0265 0.1423 0.844
Plasmodium falciparum histone deacetylase 1 0.0265 0.1423 0.1379
Echinococcus granulosus family S9 non peptidase ue S09 family 0.0022 0.0035 0.0113
Trichomonas vaginalis conserved hypothetical protein 0.0033 0.0094 0.042
Trichomonas vaginalis histone deacetylase, putative 0.0265 0.1423 1
Echinococcus multilocularis geminin 0.0518 0.2868 1
Brugia malayi cell division control protein 2 homolog 0.0042 0.0149 0.0856
Brugia malayi Nuclear hormone receptor family member nhr-19 0.002 0.002 0.0083
Echinococcus granulosus cdgsh iron sulfur domain containing protein 0.0253 0.1352 0.4306
Echinococcus granulosus histone deacetylase 6 0.0317 0.172 0.5478
Loa Loa (eye worm) histone deacetylase 0.0311 0.1685 1
Echinococcus granulosus chromobox protein 1 0.007 0.0306 0.0973
Brugia malayi Nuclear hormone receptor family member nhr-19 0.002 0.002 0.0083
Trichomonas vaginalis CMGC family protein kinase 0.0042 0.0149 0.0822
Leishmania major cell division related protein kinase 2,cdc2-related kinase 0.0042 0.0149 0.0602
Plasmodium vivax hypothetical protein, conserved 0.0044 0.0161 0.011
Onchocerca volvulus 0.0044 0.0161 0.2215
Trypanosoma cruzi cdc2-related kinase 1 0.0042 0.0149 0.0602
Entamoeba histolytica histone deacetylase, putative 0.0265 0.1423 1
Onchocerca volvulus 0.0022 0.0035 0.0247
Echinococcus multilocularis cdgsh iron sulfur domain containing protein 0.0253 0.1352 0.4679
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD5 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0033 0.0094 0.0121
Trichomonas vaginalis chromosome transmission fidelity factor, putative 0.003 0.008 0.032
Loa Loa (eye worm) CMGC/CDK/CDC2 protein kinase 0.0042 0.0149 0.0856
Trichomonas vaginalis CMGC family protein kinase 0.0042 0.0149 0.0822
Loa Loa (eye worm) hypothetical protein 0.003 0.008 0.0441
Brugia malayi AMP-binding enzyme family protein 0.0046 0.0171 0.0987
Loa Loa (eye worm) hypothetical protein 0.0031 0.0082 0.0455

Activities

Activity type Activity value Assay description Source Reference
Potency (functional) 28.1838 uM PubChem BioAssay. qHTS for Activators of Integrin-Mediated Alleviation for Muscular Dystrophy. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 56.2341 uM PUBCHEM_BIOASSAY: qHTS for Inhibitors of Polymerase Iota. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID588623] ChEMBL. No reference

Phenotypes

Whole-cell/tissue/organism interactions

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

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

Annotated phenotypes:

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

External resources for this compound

Bibliographic References

No literature references available for this target.

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