Detailed information for compound 78348

Basic information

Technical information
  • TDR Targets ID: 78348
  • Name: (3R,4R,5S)-5-amino-4-(methanesulfonamido)-3-p ropoxycyclohexene-1-carboxylic acid
  • MW: 292.352 | Formula: C11H20N2O5S
  • H donors: 3 H acceptors: 4 LogP: -3.04 Rotable bonds: 6
    Rule of 5 violations (Lipinski): 1
  • SMILES: CCCO[C@@H]1C=C(C[C@@H]([C@H]1NS(=O)(=O)C)N)C(=O)O
  • InChi: 1S/C11H20N2O5S/c1-3-4-18-9-6-7(11(14)15)5-8(12)10(9)13-19(2,16)17/h6,8-10,13H,3-5,12H2,1-2H3,(H,14,15)/t8-,9+,10+/m0/s1
  • InChiKey: OEZYEYXMBIPGKG-IVZWLZJFSA-N  


Substructure search Similarity search

Network

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Synonyms

  • (3R,4R,5S)-5-amino-4-(methanesulfonamido)-3-propoxy-cyclohexene-1-carboxylic acid
  • (3R,4R,5S)-5-amino-4-(methanesulfonamido)-3-propoxy-1-cyclohexenecarboxylic acid
  • (3R,4R,5S)-5-azanyl-4-(methylsulfonylamino)-3-propoxy-cyclohexene-1-carboxylic acid
  • (3R,4R,5S)-5-amino-4-methanesulfonamido-3-propoxycyclohexene-1-carboxylic acid
  • (3R,4R,5S)-5-amino-4-methanesulfonamido-3-propoxy-cyclohexene-1-carboxylic acid
  • (3R,4R,5S)-5-amino-4-methanesulfonamido-3-propoxy-1-cyclohexenecarboxylic acid
  • (3R,4R,5S)-5-amino-4-(methylsulfonylamino)-3-propoxy-cyclohexene-1-carboxylic acid
  • carbocyclic analogue 14
  • 1-Cyclohexene-1-carboxylic acid, 5-amino-4-[(methylsulfonyl)amino]-3-propoxy-, (3R,4R,5S)-
  • AIDS-169148
  • AIDS169148

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
Brugia malayi Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative 0.0036 0.006 0.0137
Echinococcus multilocularis voltage dependent calcium channel subunit 0.0161 0.1205 0.1976
Echinococcus multilocularis aldehyde dehydrogenase, mitochondrial 0.006 0.0283 0.0451
Leishmania major 3-oxoacyl-(acyl-carrier protein) reductase, putative 0.0133 0.0943 0.2443
Echinococcus granulosus subfamily M14A unassigned peptidase 0.0343 0.2855 0.4713
Trypanosoma cruzi metallo-peptidase, Clan MC, Family M14 0.0059 0.0272 0.0585
Trichomonas vaginalis histone deacetylase 1, 2 ,3, putative 0.0281 0.2297 0.9504
Brugia malayi TAR-binding protein 0.0064 0.032 0.0845
Loa Loa (eye worm) hypothetical protein 0.0059 0.0272 0.0715
Loa Loa (eye worm) hypothetical protein 0.0146 0.1065 0.288
Schistosoma mansoni hypothetical protein 0.0083 0.0495 0.0802
Loa Loa (eye worm) hypothetical protein 0.0059 0.0272 0.0715
Echinococcus multilocularis beta LACTamase domain containing family member 0.0036 0.006 0.0083
Echinococcus granulosus voltage dependent calcium channel subunit 0.0355 0.2966 0.4896
Schistosoma mansoni histone deacetylase hda2 0.0121 0.0837 0.1368
Toxoplasma gondii histone deacetylase HDAC3 0.0281 0.2297 1
Schistosoma mansoni hypothetical protein 0.0194 0.1501 0.2466
Mycobacterium ulcerans short-chain type dehydrogenase/reductase 0.0133 0.0943 0.0888
Schistosoma mansoni tar DNA-binding protein 0.0064 0.032 0.0512
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.009 0.0559 0.1499
Echinococcus multilocularis 0.0059 0.0272 0.0433
Echinococcus granulosus geminin 0.0194 0.1501 0.2478
Trichomonas vaginalis Clan MC, family M14, Zinc carboxypeptidase-like metallopeptidase 0.0059 0.0272 0.0899
Echinococcus granulosus histone deacetylase 3 0.0281 0.2297 0.3792
Schistosoma mansoni hypothetical protein 0.0034 0.0043 0.0055
Schistosoma mansoni aldehyde dehydrogenase 0.006 0.0283 0.0451
Brugia malayi Zinc carboxypeptidase family protein 0.0059 0.0272 0.0715
Mycobacterium ulcerans aldehyde dehydrogenase 0.006 0.0283 0.0224
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0294 0.2414 1
Echinococcus granulosus voltage dependent calcium channel subunit 0.0161 0.1205 0.199
Leishmania major histone deacetylase, putative 0.0253 0.2042 0.5483
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0294 0.2414 1
Onchocerca volvulus 0.0343 0.2855 1
Echinococcus granulosus histone deacetylase 0.0253 0.2042 0.3371
Onchocerca volvulus 0.0343 0.2855 1
Loa Loa (eye worm) hypothetical protein 0.0059 0.0272 0.0715
Leishmania major aldehyde dehydrogenase, mitochondrial precursor 0.006 0.0283 0.0615
Loa Loa (eye worm) hypothetical protein 0.0049 0.0185 0.0477
Leishmania major histone deacetylase, putative 0.0281 0.2297 0.6188
Schistosoma mansoni histone deacetylase 0.0281 0.2297 0.3782
Brugia malayi hypothetical protein 0.0278 0.2265 0.6155
Schistosoma mansoni hypothetical protein 0.0057 0.0252 0.0401
Mycobacterium ulcerans aldehyde dehydrogenase 0.006 0.0283 0.0224
Toxoplasma gondii histone deacetylase HDAC2 0.0281 0.2297 1
Schistosoma mansoni dihydropyridine-sensitive l-type calcium channel 0.0155 0.1145 0.1877
Trypanosoma cruzi metallo-peptidase, Clan MC, Family M14, putative 0.0059 0.0272 0.0585
Loa Loa (eye worm) TAR-binding protein 0.0064 0.032 0.0845
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0294 0.2414 1
Schistosoma mansoni hypothetical protein 0.0194 0.1501 0.2466
Schistosoma mansoni tar DNA-binding protein 0.0064 0.032 0.0512
Onchocerca volvulus 0.0036 0.006 0.0177
Schistosoma mansoni aldehyde dehydrogenase 0.006 0.0283 0.0451
Trypanosoma cruzi histone deacetylase, putative 0.0121 0.0837 0.2149
Loa Loa (eye worm) pre-SET domain-containing protein family protein 0.0209 0.1643 0.4456
Schistosoma mansoni histone deacetylase 4 5 0.0253 0.2042 0.336
Loa Loa (eye worm) hypothetical protein 0.0059 0.0272 0.0715
Schistosoma mansoni carboxypeptidase N (M14 family) 0.0059 0.0272 0.0433
Brugia malayi Zinc carboxypeptidase family protein 0.0059 0.0272 0.0715
Schistosoma mansoni histone deacetylase hda2 0.0261 0.2108 0.3469
Toxoplasma gondii histone deacetylase HDAC4 0.0121 0.0837 0.3617
Schistosoma mansoni tar DNA-binding protein 0.0064 0.032 0.0512
Loa Loa (eye worm) hypothetical protein 0.0036 0.006 0.0137
Toxoplasma gondii histone deacetylase HDAC1 0.0253 0.2042 0.8885
Echinococcus granulosus cytosolic carboxypeptidase 1 0.0059 0.0272 0.0449
Leishmania major histone deacetylase, putative 0.0253 0.2042 0.5483
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.009 0.0559 0.1499
Trypanosoma brucei histone deacetylase, putative 0.0253 0.2042 0.5483
Trypanosoma brucei Carboxypeptidase-like protein 0.0059 0.0272 0.0585
Trichomonas vaginalis Clan MC, family M14, Zinc carboxypeptidase-like metallopeptidase 0.0059 0.0272 0.0899
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.009 0.0559 0.0923
Onchocerca volvulus 0.0059 0.0272 0.0921
Brugia malayi Zinc carboxypeptidase family protein 0.0059 0.0272 0.0715
Brugia malayi histone deacetylase 1 (HD1) 0.0281 0.2297 0.6241
Schistosoma mansoni 3-hydroxyacyl-CoA dehydrogenase 0.0133 0.0943 0.1543
Loa Loa (eye worm) hypothetical protein 0.0121 0.0837 0.2257
Mycobacterium tuberculosis Probable aldehyde dehydrogenase 0.006 0.0283 0.0224
Loa Loa (eye worm) hypothetical protein 0.0036 0.006 0.0137
Loa Loa (eye worm) hypothetical protein 0.0036 0.006 0.0137
Schistosoma mansoni serine-rich repeat protein 0.0083 0.0495 0.0802
Plasmodium falciparum histone deacetylase 1 0.0281 0.2297 1
Echinococcus granulosus cytosolic carboxypeptidase protein 5 0.0059 0.0272 0.0449
Brugia malayi beta-lactamase 0.0036 0.006 0.0137
Echinococcus granulosus Zinc carboxypeptidase family protein 0.0059 0.0272 0.0449
Loa Loa (eye worm) histone deacetylase 1 0.0281 0.2297 0.6241
Trypanosoma cruzi histone deacetylase 1, putative 0.0281 0.2297 0.6188
Echinococcus granulosus snurportin 1 0.0297 0.2443 0.4034
Mycobacterium ulcerans short chain dehydrogenase 0.1128 1 1
Brugia malayi RNA, U transporter 1 0.0079 0.0458 0.1221
Brugia malayi Calcitonin receptor-like protein seb-1 0.0049 0.0185 0.0477
Loa Loa (eye worm) nucleolar RNA-associated protein alpha 0.0297 0.2443 0.664
Loa Loa (eye worm) hypothetical protein 0.0036 0.006 0.0137
Schistosoma mansoni metallocarboxypeptidase D peptidase unit 2 (M14 family) 0.0059 0.0272 0.0433
Onchocerca volvulus Carboxypeptidase D homolog 0.0059 0.0272 0.0921
Brugia malayi hypothetical protein 0.0146 0.1065 0.288
Loa Loa (eye worm) histone deacetylase 7A 0.0253 0.2042 0.5545
Onchocerca volvulus 0.0146 0.1065 0.3709
Plasmodium vivax histone deacetylase 1, putative 0.0281 0.2297 1
Brugia malayi Zinc carboxypeptidase family protein 0.0059 0.0272 0.0715
Echinococcus granulosus histone deacetylase 6 0.0261 0.2108 0.348
Loa Loa (eye worm) hypothetical protein 0.0071 0.0387 0.1028
Brugia malayi 3-hydroxyacyl-CoA dehydrogenase type II 0.0133 0.0943 0.2547
Trypanosoma brucei metallo-peptidase, Clan MC, Family M14, putative 0.0059 0.0272 0.0585
Trichomonas vaginalis Clan MC, family M14, Zinc carboxypeptidase-like metallopeptidase 0.0059 0.0272 0.0899
Echinococcus granulosus histone deacetylase 6 0.0253 0.2042 0.3371
Echinococcus granulosus survival motor neuron protein 1 0.0278 0.2265 0.374
Echinococcus multilocularis histone deacetylase 8 0.0121 0.0837 0.1368
Loa Loa (eye worm) hypothetical protein 0.0059 0.0272 0.0715
Schistosoma mansoni peptidase 0.0059 0.0272 0.0433
Echinococcus multilocularis 3 hydroxyacyl coenzyme A dehydrogenase type 2 0.0133 0.0943 0.1543
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0036 0.006 0.0099
Onchocerca volvulus Cytosolic carboxypeptidase 1 homolog 0.0059 0.0272 0.0921
Echinococcus granulosus tar DNA binding protein 0.0064 0.032 0.0528
Echinococcus granulosus histone lysine methyltransferase setb 0.003 0.001 0.0017
Mycobacterium leprae Probable fructose bisphosphate aldolase Fba 0.0144 0.1044 1
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.009 0.0559 0.0908
Mycobacterium ulcerans fructose-bisphosphate aldolase 0.0144 0.1044 0.099
Loa Loa (eye worm) hypothetical protein 0.0034 0.0043 0.009
Brugia malayi beta-lactamase family protein 0.0036 0.006 0.0137
Schistosoma mansoni transcription factor LCR-F1 0.0036 0.006 0.0083
Trichomonas vaginalis Clan MC, family M14, Zinc carboxypeptidase-like metallopeptidase 0.0059 0.0272 0.0899
Trypanosoma brucei histone deacetylase 1 0.0281 0.2297 0.6188
Trichomonas vaginalis set domain proteins, putative 0.0238 0.1906 0.7844
Leishmania major zinc carboxypeptidase, putative,metallo-peptidase, Clan MC, Family M14 0.0059 0.0272 0.0585
Brugia malayi Histone deacetylase family protein 0.0253 0.2042 0.5545
Loa Loa (eye worm) RNA binding protein 0.0064 0.032 0.0845
Trichomonas vaginalis histone deacetylase, putative 0.0281 0.2297 0.9504
Schistosoma mansoni survival motor neuron protein 0.0057 0.0252 0.0401
Echinococcus multilocularis histone deacetylase 7 0.0253 0.2042 0.336
Echinococcus multilocularis snurportin 1 0.0297 0.2443 0.4024
Toxoplasma gondii ABC1 family protein 0.0036 0.006 0.022
Loa Loa (eye worm) histone deacetylase 11 0.0121 0.0837 0.2257
Loa Loa (eye worm) hypothetical protein 0.0281 0.2297 0.6241
Echinococcus multilocularis voltage dependent calcium channel subunit 0.0355 0.2966 0.4887
Plasmodium vivax hypothetical protein, conserved 0.0059 0.0272 0.1145
Loa Loa (eye worm) hypothetical protein 0.0059 0.0272 0.0715
Trypanosoma brucei histone deacetylase 2 0.0121 0.0837 0.2149
Schistosoma mansoni subfamily M14A unassigned peptidase (M14 family) 0.0343 0.2855 0.4705
Loa Loa (eye worm) hypothetical protein 0.0059 0.0272 0.0715
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0294 0.2414 1
Brugia malayi RNA recognition motif domain containing protein 0.0064 0.032 0.0845
Schistosoma mansoni tar DNA-binding protein 0.0064 0.032 0.0512
Trichomonas vaginalis histone deacetylase, putative 0.0281 0.2297 0.9504
Trichomonas vaginalis Clan MC, family M14, Zinc carboxypeptidase-like metallopeptidase 0.0059 0.0272 0.0899
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0036 0.006 0.0083
Trypanosoma cruzi histone deacetylase, putative 0.0253 0.2042 0.5483
Brugia malayi Zinc carboxypeptidase family protein 0.0059 0.0272 0.0715
Trichomonas vaginalis Clan MC, family M14, Zinc carboxypeptidase-like metallopeptidase 0.0059 0.0272 0.0899
Loa Loa (eye worm) zinc carboxypeptidase 0.0059 0.0272 0.0715
Trypanosoma cruzi histone deacetylase, putative 0.0253 0.2042 0.5483
Schistosoma mansoni peptidase 0.0059 0.0272 0.0433
Loa Loa (eye worm) histone deacetylase 0.0253 0.2042 0.5545
Trypanosoma cruzi Carboxypeptidase-like protein 0.0059 0.0272 0.0585
Loa Loa (eye worm) hypothetical protein 0.014 0.1007 0.2722
Brugia malayi Pre-SET motif family protein 0.0209 0.1643 0.4456
Brugia malayi histone deacetylase 11 0.0121 0.0837 0.2257
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.009 0.0559 0.0923
Echinococcus granulosus histone deacetylase 7 0.0253 0.2042 0.3371
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0294 0.2414 1
Echinococcus multilocularis histone deacetylase 0.0253 0.2042 0.336
Echinococcus multilocularis histone deacetylase 3 0.0281 0.2297 0.3782
Trichomonas vaginalis Clan MC, family M14, Zinc carboxypeptidase-like metallopeptidase 0.0059 0.0272 0.0899
Brugia malayi Carboxypeptidase A2 precursor 0.0059 0.0272 0.0715
Loa Loa (eye worm) 3-hydroxyacyl-CoA dehydrogenase type II 0.0106 0.0699 0.188
Mycobacterium ulcerans aldehyde dehydrogenase 0.006 0.0283 0.0224
Loa Loa (eye worm) cytochrome P450 family protein 0.0044 0.0141 0.0357
Leishmania major zinc carboxypeptidase, putative,metallo-peptidase, Clan MC, Family M14 0.0059 0.0272 0.0585
Echinococcus multilocularis histone deacetylase 6 0.0261 0.2108 0.3469
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.009 0.0559 0.0908
Echinococcus multilocularis Zinc carboxypeptidase family protein 0.0059 0.0272 0.0433
Mycobacterium ulcerans short-chain type dehydrogenase/reductase 0.0133 0.0943 0.0888
Brugia malayi Histone deacetylase family protein 0.0253 0.2042 0.5545
Onchocerca volvulus 0.0059 0.0272 0.0921
Plasmodium vivax histone deacetylase 2, putative 0.0253 0.2042 0.8885
Plasmodium vivax histone deacetylase, putative 0.0253 0.2042 0.8885
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.009 0.0559 0.0908
Onchocerca volvulus 0.0343 0.2855 1
Echinococcus granulosus histone deacetylase 8 0.0121 0.0837 0.1382
Loa Loa (eye worm) beta-LACTamase domain containing family member 0.0036 0.006 0.0137
Trypanosoma cruzi metallo-peptidase, Clan MC, Family M14, putative 0.0059 0.0272 0.0585
Echinococcus multilocularis histone deacetylase 6 0.0253 0.2042 0.336
Trichomonas vaginalis histone deacetylase, putative 0.0281 0.2297 0.9504
Loa Loa (eye worm) hypothetical protein 0.0132 0.0942 0.2542
Echinococcus multilocularis survival motor neuron protein 1 0.0278 0.2265 0.373
Schistosoma mansoni histone deacetylase 1 2 3 0.0121 0.0837 0.1368
Loa Loa (eye worm) zinc carboxypeptidase 0.0059 0.0272 0.0715
Onchocerca volvulus 0.0057 0.0252 0.0852
Trichomonas vaginalis histone deacetylase 1, 2 ,3, putative 0.0281 0.2297 0.9504
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0036 0.006 0.0083
Brugia malayi latrophilin 2 splice variant baaae 0.0034 0.0043 0.009
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.009 0.0559 0.0908
Trypanosoma brucei histone deacetylase 3 0.0253 0.2042 0.5483
Loa Loa (eye worm) hypothetical protein 0.0221 0.1749 0.4746
Echinococcus granulosus histone deacetylase 6 0.0253 0.2042 0.3371
Brugia malayi ERG2 and Sigma1 receptor like protein 0.0433 0.3674 1
Brugia malayi Zinc carboxypeptidase family protein 0.0059 0.0272 0.0715
Brugia malayi Zinc carboxypeptidase family protein 0.0059 0.0272 0.0715
Onchocerca volvulus 0.0343 0.2855 1
Trypanosoma brucei metallo-peptidase, Clan MC, Family M14, putative 0.0059 0.0272 0.0585
Echinococcus granulosus aldehyde dehydrogenase mitochondrial 0.006 0.0283 0.0467
Trichomonas vaginalis histone deacetylase 1, 2 ,3, putative 0.0281 0.2297 0.9504
Schistosoma mansoni hypothetical protein 0.0059 0.0272 0.0433
Echinococcus multilocularis geminin 0.0194 0.1501 0.2466
Onchocerca volvulus 0.0036 0.006 0.0177
Trypanosoma cruzi histone deacetylase, putative 0.0121 0.0837 0.2149
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0294 0.2414 1
Leishmania major zinc carboxypeptidase, putative,metallo-peptidase, Clan MC, Family M14 0.0059 0.0272 0.0585
Toxoplasma gondii flagellar/basal body protein 0.0059 0.0272 0.1145
Loa Loa (eye worm) hypothetical protein 0.0278 0.2265 0.6155
Schistosoma mansoni histone deacetylase 0.0281 0.2297 0.3782
Trypanosoma cruzi C-8 sterol isomerase, putative 0.0433 0.3674 1
Toxoplasma gondii zinc carboxypeptidase superfamily protein 0.0059 0.0272 0.1145
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0036 0.006 0.0083
Plasmodium vivax histone deacetylase, putative 0.0121 0.0837 0.3617
Loa Loa (eye worm) hypothetical protein 0.0059 0.0272 0.0715
Echinococcus granulosus 3 hydroxyacyl coenzyme A dehydrogenase type 2 0.0133 0.0943 0.1557
Entamoeba histolytica histone deacetylase, putative 0.0281 0.2297 0.9504
Echinococcus granulosus histone deacetylase 1 0.0281 0.2297 0.3792
Echinococcus multilocularis histone deacetylase 1 0.0281 0.2297 0.3782
Giardia lamblia Histone deacetylase 0.0281 0.2297 0.9455
Echinococcus multilocularis subfamily M14A unassigned peptidase 0.0343 0.2855 0.4705
Trichomonas vaginalis Clan MC, family M14, Zinc carboxypeptidase-like metallopeptidase 0.0059 0.0272 0.0899
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.009 0.0559 0.0908
Trichomonas vaginalis histone deacetylase, putative 0.0281 0.2297 0.9504
Brugia malayi RNA binding protein 0.0064 0.032 0.0845
Loa Loa (eye worm) beta-lactamase 0.0036 0.006 0.0137
Trypanosoma cruzi histone deacetylase 1, putative 0.0281 0.2297 0.6188
Brugia malayi hypothetical protein 0.0036 0.006 0.0137
Schistosoma mansoni hypothetical protein 0.0297 0.2443 0.4024
Trichomonas vaginalis Clan MC, family M14, Zinc carboxypeptidase-like metallopeptidase 0.0059 0.0272 0.0899
Brugia malayi Histone deacetylase 1 0.0281 0.2297 0.6241
Toxoplasma gondii histone deacetylase HDAC5 0.0121 0.0837 0.3617
Brugia malayi histone deacetylase 3 (HD3) 0.0281 0.2297 0.6241
Trichomonas vaginalis histone deacetylase, putative 0.0281 0.2297 0.9504
Schistosoma mansoni family M14 non-peptidase homologue (M14 family) 0.0059 0.0272 0.0433
Toxoplasma gondii aldehyde dehydrogenase 0.006 0.0283 0.1192
Entamoeba histolytica fructose-1,6-bisphosphate aldolase, putative 0.0294 0.2414 1
Echinococcus multilocularis cytosolic carboxypeptidase protein 5 0.0059 0.0272 0.0433
Trypanosoma brucei histone deacetylase 4 0.0253 0.2042 0.5483
Schistosoma mansoni protease m14 carboxypeptidase 0.0059 0.0272 0.0433
Toxoplasma gondii zinc carboxypeptidase superfamily protein 0.0059 0.0272 0.1145
Loa Loa (eye worm) hypothetical protein 0.0036 0.006 0.0137
Mycobacterium tuberculosis Possible penicillin-binding protein 0.0227 0.1805 0.1755
Brugia malayi Cytochrome P450 family protein 0.0044 0.0141 0.0357
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0294 0.2414 1
Echinococcus granulosus microtubule associated protein 2 0.0694 0.6057 1
Loa Loa (eye worm) hypothetical protein 0.0036 0.006 0.0137
Leishmania major histone deacetylase, putative 0.0281 0.2297 0.6188
Echinococcus multilocularis microtubule associated protein 2 0.0694 0.6057 1
Trypanosoma brucei C-8 sterol isomerase, putative 0.0433 0.3674 1
Brugia malayi Iron-sulfur cluster assembly accessory protein 0.0057 0.0252 0.0661
Echinococcus granulosus beta LACTamase domain containing family member 0.0036 0.006 0.01
Loa Loa (eye worm) zinc carboxypeptidase 0.0059 0.0272 0.0715
Leishmania major C-8 sterol isomerase-like protein 0.0433 0.3674 1
Onchocerca volvulus 0.0238 0.1906 0.6665
Trichomonas vaginalis Clan MC, family M14, Zinc carboxypeptidase-like metallopeptidase 0.0059 0.0272 0.0899
Loa Loa (eye worm) hypothetical protein 0.0059 0.0272 0.0715
Onchocerca volvulus Histone deacetylase 10 homolog 0.0121 0.0837 0.2907
Onchocerca volvulus Subfamily M14A unassigned peptidase homolog 0.0343 0.2855 1
Schistosoma mansoni tar DNA-binding protein 0.0064 0.032 0.0512
Trypanosoma cruzi histone deacetylase, putative 0.0253 0.2042 0.5483
Loa Loa (eye worm) hypothetical protein 0.0433 0.3674 1
Loa Loa (eye worm) hypothetical protein 0.0284 0.232 0.6303
Loa Loa (eye worm) histone deacetylase 3 0.0281 0.2297 0.6241
Loa Loa (eye worm) zinc carboxypeptidase 0.0059 0.0272 0.0715
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0294 0.2414 1
Brugia malayi Cache domain containing protein 0.0071 0.0387 0.1028
Trichomonas vaginalis histone deacetylase, putative 0.0281 0.2297 0.9504
Treponema pallidum fructose-bisphosphate aldolase 0.0294 0.2414 0.5
Entamoeba histolytica fructose-1,6-bisphosphate aldolase, putative 0.0294 0.2414 1
Schistosoma mansoni microtubule-associated protein tau 0.0694 0.6057 1
Schistosoma mansoni dihydropyridine-sensitive l-type calcium channel 0.0078 0.0447 0.0722
Echinococcus multilocularis histone deacetylase 6 0.0253 0.2042 0.336
Schistosoma mansoni histone deacetylase 4 5 0.0253 0.2042 0.336
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0049 0.0185 0.0477
Giardia lamblia Fructose-bisphosphate aldolase 0.0294 0.2414 1
Onchocerca volvulus 0.0036 0.006 0.0177
Loa Loa (eye worm) hypothetical protein 0.0059 0.0272 0.0715
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.0064 0.032 0.0845
Schistosoma mansoni peptidase 0.0059 0.0272 0.0433
Trypanosoma cruzi zinc carboxypeptidase, putative 0.0059 0.0272 0.0585
Brugia malayi Zinc carboxypeptidase family protein 0.0059 0.0272 0.0715
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0049 0.0185 0.0477
Toxoplasma gondii zinc carboxypeptidase, putative 0.0059 0.0272 0.1145
Plasmodium vivax hypothetical protein, conserved 0.0036 0.006 0.022
Schistosoma mansoni hypothetical protein 0.0036 0.006 0.0083
Brugia malayi beta-lactamase family protein 0.0036 0.006 0.0137
Trichomonas vaginalis Clan MC, family M14, Zinc carboxypeptidase-like metallopeptidase 0.0059 0.0272 0.0899
Mycobacterium tuberculosis Probable short-chain type dehydrogenase/reductase 0.0133 0.0943 0.0888
Echinococcus multilocularis tar DNA binding protein 0.0064 0.032 0.0512
Mycobacterium tuberculosis Probable fructose-bisphosphate aldolase Fba 0.0144 0.1044 0.099

Activities

Activity type Activity value Assay description Source Reference
IC50 (functional) 0 nM Concentration required for 50% inhibition of influenza A/WS/33 by plaque reduction assay; not determined ChEMBL. No reference
IC50 (binding) = 25000 nM Inhibition of neuraminidase of influenza A/PR/8/34(H1N1) ChEMBL. No reference
IC50 (binding) = 25000 nM Inhibition of neuraminidase of influenza A/PR/8/34(H1N1) 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.

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