Detailed information for compound 1238782

Basic information

Technical information
  • TDR Targets ID: 1238782
  • Name: 1-[(5,7-dimethyl-2-oxo-1H-quinolin-3-yl)methy l]-1-(furan-2-ylmethyl)-3-(oxolan-2-ylmethyl) thiourea
  • MW: 425.544 | Formula: C23H27N3O3S
  • H donors: 1 H acceptors: 2 LogP: 3.89 Rotable bonds: 7
    Rule of 5 violations (Lipinski): 1
  • SMILES: Cc1cc(C)c2c(c1)nc(c(c2)CN(C(=NCC1CCCO1)S)Cc1ccco1)O
  • InChi: 1S/C23H27N3O3S/c1-15-9-16(2)20-11-17(22(27)25-21(20)10-15)13-26(14-19-6-4-8-29-19)23(30)24-12-18-5-3-7-28-18/h4,6,8-11,18H,3,5,7,12-14H2,1-2H3,(H,24,30)(H,25,27)
  • InChiKey: JUWVFMBLRZYEBS-UHFFFAOYSA-N  


Substructure search Similarity search

Network

Hover on a compound node to display the structore

Synonyms

  • 1-[(5,7-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-1-(2-furylmethyl)-3-(tetrahydrofuran-2-ylmethyl)thiourea
  • 1-[(5,7-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-1-(2-furylmethyl)-3-(2-tetrahydrofuranylmethyl)thiourea
  • 1-(2-furylmethyl)-1-[(2-keto-5,7-dimethyl-1H-quinolin-3-yl)methyl]-3-(tetrahydrofurfuryl)thiourea
  • SMR000274880
  • ASN 03156927
  • MLS000856523

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens glucagon-like peptide 1 receptor Starlite/ChEMBL No references
Homo sapiens bromodomain adjacent to zinc finger domain, 2B Starlite/ChEMBL No references
Bacillus subtilis 4'-phosphopantetheinyl transferase ffp Starlite/ChEMBL No references
Homo sapiens glucosidase, beta, acid Starlite/ChEMBL No references

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Trichomonas vaginalis glucosylceramidase, putative Get druggable targets OG5_129423 All targets in OG5_129423
Onchocerca volvulus Glucosylceramidase homolog Get druggable targets OG5_129423 All targets in OG5_129423
Cryptosporidium parvum phosphopantetheinyl transferase Get druggable targets OG5_129301 All targets in OG5_129301
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_131570 All targets in OG5_131570
Echinococcus granulosus L aminoadipate semialdehyde Get druggable targets OG5_129301 All targets in OG5_129301
Trichomonas vaginalis glucosylceramidase, putative Get druggable targets OG5_129423 All targets in OG5_129423
Schistosoma japonicum Conserved hypothetical protein Get druggable targets OG5_131570 All targets in OG5_131570
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_129301 All targets in OG5_129301
Trichomonas vaginalis glucosylceramidase, putative Get druggable targets OG5_129423 All targets in OG5_129423
Schistosoma japonicum Cleft lip and palate transmembrane protein 1-like protein, putative Get druggable targets OG5_131570 All targets in OG5_131570
Trichomonas vaginalis glucosylceramidase, putative Get druggable targets OG5_129423 All targets in OG5_129423
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_131570 All targets in OG5_131570
Trichomonas vaginalis glucosylceramidase, putative Get druggable targets OG5_129423 All targets in OG5_129423
Schistosoma japonicum ko:K01549 ATP synthase [EC3.6.3.14], putative Get druggable targets OG5_131570 All targets in OG5_131570
Trichomonas vaginalis glucosylceramidase, putative Get druggable targets OG5_129423 All targets in OG5_129423
Trichomonas vaginalis glucosylceramidase, putative Get druggable targets OG5_129423 All targets in OG5_129423
Brugia malayi aminoadipate-semialdehyde dehydrogenase-phosphopantetheinyl transferase Get druggable targets OG5_129301 All targets in OG5_129301
Schistosoma japonicum hypothetical protein Get druggable targets OG5_131570 All targets in OG5_131570
Trichomonas vaginalis glucosylceramidase, putative Get druggable targets OG5_129423 All targets in OG5_129423
Trichomonas vaginalis glucosylceramidase, putative Get druggable targets OG5_129423 All targets in OG5_129423
Trichomonas vaginalis glucosylceramidase, putative Get druggable targets OG5_129423 All targets in OG5_129423
Onchocerca volvulus Get druggable targets OG5_129301 All targets in OG5_129301
Trichomonas vaginalis glucosylceramidase, putative Get druggable targets OG5_129423 All targets in OG5_129423
Echinococcus granulosus bromodomain adjacent to zinc finger domain Get druggable targets OG5_131570 All targets in OG5_131570
Trichomonas vaginalis glucosylceramidase, putative Get druggable targets OG5_129423 All targets in OG5_129423
Echinococcus multilocularis bromodomain adjacent to zinc finger domain Get druggable targets OG5_131570 All targets in OG5_131570
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_131570 All targets in OG5_131570
Brugia malayi Bromodomain containing protein Get druggable targets OG5_131570 All targets in OG5_131570
Schistosoma japonicum expressed protein Get druggable targets OG5_129301 All targets in OG5_129301
Cryptosporidium hominis proteinx0005 Get druggable targets OG5_129301 All targets in OG5_129301
Echinococcus multilocularis L aminoadipate semialdehyde Get druggable targets OG5_129301 All targets in OG5_129301
Trichomonas vaginalis glucosylceramidase, putative Get druggable targets OG5_129423 All targets in OG5_129423
Schistosoma japonicum ko:K00142 aminoadipate-semialdehyde dehydrogenase [EC1.2.1.31], putative Get druggable targets OG5_129301 All targets in OG5_129301
Trichomonas vaginalis glucosylceramidase, putative Get druggable targets OG5_129423 All targets in OG5_129423
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_131570 All targets in OG5_131570
Loa Loa (eye worm) O-glycosyl hydrolase family 30 protein Get druggable targets OG5_129423 All targets in OG5_129423
Brugia malayi O-Glycosyl hydrolase family 30 protein Get druggable targets OG5_129423 All targets in OG5_129423
Schistosoma japonicum expressed protein Get druggable targets OG5_131570 All targets in OG5_131570
Schistosoma mansoni bromodomain containing protein Get druggable targets OG5_131570 All targets in OG5_131570
Trichomonas vaginalis glucosylceramidase, putative Get druggable targets OG5_129423 All targets in OG5_129423
Schistosoma mansoni aminoadipate-semialdehyde dehydrogenase Get druggable targets OG5_129301 All targets in OG5_129301
By sequence similarity to non orthologous known druggable targets
Species Potential target Known druggable target Length Alignment span Identity
Entamoeba histolytica hypothetical protein 4'-phosphopantetheinyl transferase ffp   224 aa 198 aa 28.3 %
Candida albicans aminoadipate-semialdehyde dehydrogenase small subunit 4'-phosphopantetheinyl transferase ffp   224 aa 183 aa 27.3 %
Trichomonas vaginalis conserved hypothetical protein 4'-phosphopantetheinyl transferase ffp   224 aa 197 aa 22.3 %
Onchocerca volvulus 4'-phosphopantetheinyl transferase ffp   224 aa 186 aa 26.3 %
Candida albicans aminoadipate-semialdehyde dehydrogenase small subunit 4'-phosphopantetheinyl transferase ffp   224 aa 183 aa 27.3 %
Loa Loa (eye worm) pigment dispersing factor receptor c glucagon-like peptide 1 receptor 463 aa 388 aa 25.8 %
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Loa Loa (eye worm) eukaryotic-type carbonic anhydrase 0.148 0.9903 1
Schistosoma mansoni carbonic anhydrase II (carbonate dehydratase II) 0.148 0.9903 1
Trichomonas vaginalis glucosylceramidase, putative 0.0312 0.1894 0.1894
Loa Loa (eye worm) PHD-finger family protein 0.0044 0.0056 0.0056
Brugia malayi Eukaryotic-type carbonic anhydrase family protein 0.148 0.9903 1
Loa Loa (eye worm) hypothetical protein 0.0081 0.0313 0.0316
Echinococcus multilocularis intestinal type alkaline phosphatase 1 0.0362 0.2235 0.2257
Loa Loa (eye worm) hypothetical protein 0.0061 0.0177 0.0179
Echinococcus granulosus bromodomain adjacent to zinc finger domain 0.0126 0.0623 0.0629
Onchocerca volvulus 0.0054 0.0126 0.1086
Mycobacterium tuberculosis Probable conserved transmembrane protein 0.0233 0.1352 0.2134
Echinococcus granulosus carbonic anhydrase II 0.148 0.9903 1
Brugia malayi RNA binding protein 0.0064 0.0192 0.0194
Brugia malayi latrophilin 2 splice variant baaae 0.0071 0.0247 0.0249
Echinococcus multilocularis zinc finger protein 0.0041 0.0041 0.0041
Loa Loa (eye worm) hypothetical protein 0.0086 0.0348 0.0351
Mycobacterium ulcerans hypothetical protein 0.004 0.0029 0.0029
Echinococcus granulosus polycomb protein SCMH1 0.0054 0.0126 0.0127
Echinococcus granulosus bromodomain adjacent to zinc finger domain 0.0076 0.0278 0.0281
Echinococcus multilocularis methyl CpG binding domain protein 2 0.0036 0.0004 0.0004
Loa Loa (eye worm) mbt repeat family protein 0.0054 0.0126 0.0127
Leishmania major hypothetical protein, conserved 0.004 0.0029 0.003
Echinococcus granulosus L aminoadipate semialdehyde 0.01 0.0445 0.0449
Mycobacterium leprae Probable transmembrane transport protein 0.0233 0.1352 0.1416
Trichomonas vaginalis conserved hypothetical protein 0.1495 1 1
Loa Loa (eye worm) transcription factor SMAD2 0.0118 0.0564 0.0569
Loa Loa (eye worm) hypothetical protein 0.015 0.0782 0.079
Echinococcus granulosus endonuclease exonuclease phosphatase 0.0212 0.1212 0.1224
Echinococcus multilocularis carbonic anhydrase 0.0714 0.4651 0.4697
Plasmodium falciparum carbonic anhydrase 0.0714 0.4651 0.5
Plasmodium vivax hypothetical protein, conserved 0.0036 0 0.5
Trichomonas vaginalis glucosylceramidase, putative 0.0205 0.1159 0.1159
Schistosoma mansoni tar DNA-binding protein 0.0064 0.0192 0.0194
Schistosoma mansoni hypothetical protein 0.0044 0.0056 0.0057
Schistosoma mansoni hypothetical protein 0.0188 0.1044 0.1055
Loa Loa (eye worm) bromodomain containing protein 0.0037 0.0013 0.0013
Mycobacterium tuberculosis Beta-carbonic anhydrase CanB 0.0893 0.588 0.9284
Trypanosoma brucei carbonic anhydrase-like protein 0.148 0.9903 1
Loa Loa (eye worm) hypothetical protein 0.0714 0.4651 0.4697
Schistosoma mansoni alkaline phosphatase 0.0362 0.2235 0.2257
Trichomonas vaginalis glucosylceramidase, putative 0.0205 0.1159 0.1159
Trypanosoma cruzi hypothetical protein, conserved 0.004 0.0029 0.003
Schistosoma mansoni carbonic anhydrase II (carbonate dehydratase II) 0.148 0.9903 1
Schistosoma mansoni myelin transcription factor 1 myt1 0.0061 0.0177 0.0179
Echinococcus multilocularis SAM and MBT domain containing protein 0.0054 0.0126 0.0127
Brugia malayi Eukaryotic-type carbonic anhydrase family protein 0.0714 0.4651 0.4697
Brugia malayi Carbonic anhydrase like protein 2 precursor 0.0714 0.4651 0.4697
Schistosoma mansoni aminoadipate-semialdehyde dehydrogenase 0.01 0.0445 0.0449
Echinococcus granulosus carbonic anhydrase 0.0714 0.4651 0.4697
Schistosoma mansoni carbonic anhydrase-related 0.0714 0.4651 0.4697
Schistosoma mansoni zinc finger protein 0.0041 0.0041 0.0041
Loa Loa (eye worm) hypothetical protein 0.1298 0.8651 0.8735
Loa Loa (eye worm) hypothetical protein 0.009 0.0375 0.0379
Entamoeba histolytica bacterial transferase hexapeptide family protein 0.004 0.0029 0.0031
Echinococcus multilocularis fetal alzheimer antigen, falz 0.0048 0.0084 0.0085
Loa Loa (eye worm) hypothetical protein 0.0714 0.4651 0.4697
Echinococcus multilocularis carbonic anhydrase II 0.148 0.9903 1
Schistosoma mansoni sex comb on midleg homolog 0.0054 0.0126 0.0127
Trichomonas vaginalis conserved hypothetical protein 0.0067 0.0214 0.0214
Trichomonas vaginalis glucosylceramidase, putative 0.0205 0.1159 0.1159
Echinococcus multilocularis histone lysine methyltransferase setb histone lysine methyltransferase eggless 0.0036 0.0004 0.0004
Brugia malayi PHD-finger family protein 0.0053 0.0118 0.0119
Schistosoma mansoni hypothetical protein 0.0714 0.4651 0.4697
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0105 0.0474 0.0478
Schistosoma mansoni tar DNA-binding protein 0.0064 0.0192 0.0194
Brugia malayi mbt repeat family protein 0.0054 0.0126 0.0127
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.0064 0.0192 0.0194
Trichomonas vaginalis glucosylceramidase, putative 0.0312 0.1894 0.1894
Echinococcus granulosus alkaline phosphatase 0.0362 0.2235 0.2257
Loa Loa (eye worm) carbonic anhydrase 3 0.148 0.9903 1
Entamoeba histolytica acetyltransferase, putative 0.0069 0.0232 0.0243
Schistosoma mansoni carbonic anhydrase-related 0.0714 0.4651 0.4697
Echinococcus granulosus dynactin 5 p25 0.0069 0.0232 0.0234
Schistosoma mansoni hypothetical protein 0.0365 0.226 0.2282
Toxoplasma gondii hypothetical protein 0.0714 0.4651 1
Trichomonas vaginalis glucosylceramidase, putative 0.0205 0.1159 0.1159
Brugia malayi Bromodomain containing protein 0.0159 0.0845 0.0853
Echinococcus multilocularis geminin 0.0365 0.226 0.2282
Trypanosoma cruzi carbonic anhydrase-like protein, putative 0.148 0.9903 1
Schistosoma mansoni tar DNA-binding protein 0.0064 0.0192 0.0194
Onchocerca volvulus 0.01 0.0445 0.3837
Loa Loa (eye worm) hypothetical protein 0.0054 0.0126 0.0127
Onchocerca volvulus Glucosylceramidase homolog 0.0205 0.1159 1
Wolbachia endosymbiont of Brugia malayi 2,3,4,5-tetrahydropyridine-2,6-carboxylate N-succinyltransferase 0.0069 0.0232 1
Echinococcus granulosus intestinal type alkaline phosphatase 1 0.0362 0.2235 0.2257
Trichomonas vaginalis glucosylceramidase, putative 0.0216 0.1235 0.1235
Mycobacterium tuberculosis Possible penicillin-binding protein 0.0227 0.1312 0.2071
Trichomonas vaginalis conserved hypothetical protein 0.1495 1 1
Brugia malayi Eukaryotic-type carbonic anhydrase family protein 0.0714 0.4651 0.4697
Schistosoma mansoni sex comb on midleg homolog 0.0054 0.0126 0.0127
Schistosoma mansoni hypothetical protein 0.0365 0.226 0.2282
Echinococcus granulosus histone lysine methyltransferase setb 0.0036 0.0004 0.0004
Trichomonas vaginalis glucosylceramidase, putative 0.0312 0.1894 0.1894
Trichomonas vaginalis glucosylceramidase, putative 0.0205 0.1159 0.1159
Loa Loa (eye worm) eukaryotic-type carbonic anhydrase 0.0714 0.4651 0.4697
Echinococcus granulosus geminin 0.0365 0.226 0.2282
Echinococcus granulosus fetal alzheimer antigen falz 0.0048 0.0084 0.0085
Echinococcus multilocularis tar DNA binding protein 0.0064 0.0192 0.0194
Mycobacterium tuberculosis Possible siderophore-binding protein 0.004 0.0029 0.0046
Schistosoma mansoni tar DNA-binding protein 0.0064 0.0192 0.0194
Schistosoma mansoni carbonic anhydrase-related 0.0714 0.4651 0.4697
Schistosoma mansoni acetyl-CoA C-acetyltransferase 0.0048 0.0084 0.0085
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0036 0.0004 0.0004
Schistosoma mansoni hypothetical protein 0.0328 0.2002 0.2021
Echinococcus granulosus carbonic anhydrase 0.0714 0.4651 0.4697
Entamoeba histolytica carbonic anhydrase, putative 0.1428 0.9546 1
Loa Loa (eye worm) O-glycosyl hydrolase family 30 protein 0.0312 0.1894 0.1913
Schistosoma mansoni tar DNA-binding protein 0.0064 0.0192 0.0194
Mycobacterium ulcerans transferase 0.0067 0.0214 0.0214
Trichomonas vaginalis glucosylceramidase, putative 0.0312 0.1894 0.1894
Schistosoma mansoni alkaline phosphatase 0.0362 0.2235 0.2257
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0036 0.0004 0.0004
Mycobacterium tuberculosis Probable serine acetyltransferase CysE (sat) 0.0069 0.0232 0.0366
Echinococcus granulosus SAM and MBT domain containing protein 0.0054 0.0126 0.0127
Brugia malayi O-Glycosyl hydrolase family 30 protein 0.0312 0.1894 0.1913
Echinococcus granulosus zinc finger protein 0.0041 0.0041 0.0041
Leishmania major carbonic anhydrase-like protein 0.148 0.9903 1
Schistosoma mansoni methyl-cpg binding protein mbd 0.0036 0.0004 0.0004
Echinococcus multilocularis histone acetyltransferase MYST2 0.0061 0.0177 0.0179
Schistosoma mansoni bromodomain containing protein 0.0134 0.0675 0.0681
Echinococcus multilocularis endonuclease exonuclease phosphatase 0.0212 0.1212 0.1224
Brugia malayi aminoadipate-semialdehyde dehydrogenase-phosphopantetheinyl transferase 0.01 0.0445 0.0449
Trypanosoma cruzi carbonic anhydrase-like protein, putative 0.148 0.9903 1
Loa Loa (eye worm) TAR-binding protein 0.0064 0.0192 0.0194
Echinococcus multilocularis intestinal type alkaline phosphatase 0.0362 0.2235 0.2257
Mycobacterium leprae CARBONIC ANHYDRASE (CARBONATE DEHYDRATASE) (CARBONIC DEHYDRATASE) 0.1428 0.9546 1
Onchocerca volvulus Polycomb protein Sfmbt homolog 0.0054 0.0126 0.1086
Trichomonas vaginalis maltose O-acetyltransferase, putative 0.0067 0.0214 0.0214
Brugia malayi mbt repeat family protein 0.0054 0.0126 0.0127
Wolbachia endosymbiont of Brugia malayi N-acetylglucosamine-1-phosphate uridyltransferase 0.0069 0.0232 1
Echinococcus granulosus methyl CpG binding domain protein 2 0.0036 0.0004 0.0004
Brugia malayi Eukaryotic-type carbonic anhydrase family protein 0.0714 0.4651 0.4697
Schistosoma mansoni methyl-cpg binding protein mbd 0.0036 0.0004 0.0004
Loa Loa (eye worm) RNA binding protein 0.0064 0.0192 0.0194
Mycobacterium tuberculosis Beta-carbonic anhydrase 0.096 0.6334 1
Schistosoma mansoni carbonic anhydrase 0.0714 0.4651 0.4697
Trichomonas vaginalis glucosylceramidase, putative 0.0312 0.1894 0.1894
Trichomonas vaginalis glucosylceramidase, putative 0.0205 0.1159 0.1159
Echinococcus multilocularis carbonic anhydrase 0.0714 0.4651 0.4697
Schistosoma mansoni scm-relatedprotein containing 4 mbt domains (sfmbt) 0.0054 0.0126 0.0127
Onchocerca volvulus 0.0201 0.1138 0.9814
Echinococcus multilocularis alkaline phosphatase, intestinal, gene 2 0.0362 0.2235 0.2257
Loa Loa (eye worm) hypothetical protein 0.0036 0.0004 0.0004
Loa Loa (eye worm) hypothetical protein 0.0105 0.0474 0.0478
Echinococcus multilocularis L aminoadipate semialdehyde 0.01 0.0445 0.0449
Loa Loa (eye worm) MBCTL1 0.0061 0.0177 0.0179
Echinococcus granulosus alkaline phosphatase intestinal gene 2 0.0362 0.2235 0.2257
Onchocerca volvulus 0.0067 0.0214 0.1846
Loa Loa (eye worm) hypothetical protein 0.0071 0.0247 0.0249
Echinococcus multilocularis polycomb protein SCMH1 0.0054 0.0126 0.0127
Schistosoma mansoni hypothetical protein 0.0071 0.0247 0.0249
Brugia malayi Bromodomain containing protein 0.0081 0.0312 0.0315
Brugia malayi MH2 domain containing protein 0.0118 0.0564 0.0569
Mycobacterium leprae PROBABLE TRANSFERASE 0.0067 0.0214 0.0224
Brugia malayi Putative carbonic anhydrase 5 precursor 0.148 0.9903 1
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0105 0.0474 0.0478
Entamoeba histolytica ankyrin, putative 0.0069 0.0232 0.0243
Echinococcus multilocularis suppression of tumorigenicity 18 protein 0.0061 0.0177 0.0179
Brugia malayi C2-HC type zinc finger protein C.e-MyT1 0.0061 0.0177 0.0179
Trypanosoma cruzi hypothetical protein, conserved 0.004 0.0029 0.003
Loa Loa (eye worm) hypothetical protein 0.01 0.0445 0.0449
Echinococcus multilocularis carbonic anhydrase 0.0714 0.4651 0.4697
Echinococcus granulosus histone acetyltransferase MYST2 0.0061 0.0177 0.0179
Brugia malayi TAR-binding protein 0.0064 0.0192 0.0194
Echinococcus multilocularis bromodomain adjacent to zinc finger domain 0.0126 0.0623 0.0629
Mycobacterium tuberculosis Probable transmembrane carbonic anhydrase (carbonate dehydratase) (carbonic dehydratase) 0.0768 0.5018 0.7922
Trichomonas vaginalis glucosylceramidase, putative 0.0216 0.1235 0.1235
Brugia malayi Calcitonin receptor-like protein seb-1 0.0105 0.0474 0.0478
Loa Loa (eye worm) MH2 domain-containing protein 0.0118 0.0564 0.0569
Echinococcus multilocularis bromodomain adjacent to zinc finger domain 0.0076 0.0278 0.0281
Onchocerca volvulus Putative sulfate transporter 0.0201 0.1138 0.9814
Trypanosoma brucei hypothetical protein, conserved 0.004 0.0029 0.003
Mycobacterium ulcerans carbonic anhydrase 0.1428 0.9546 0.9546
Trichomonas vaginalis glucosylceramidase, putative 0.0205 0.1159 0.1159
Echinococcus granulosus carbonic anhydrase 0.0714 0.4651 0.4697
Brugia malayi Carbonic anhydrase like protein 2 precursor 0.0714 0.4651 0.4697
Schistosoma mansoni carbonic anhydrase 0.1428 0.9546 0.964
Trichomonas vaginalis glucosylceramidase, putative 0.0312 0.1894 0.1894
Echinococcus granulosus suppression of tumorigenicity 18 protein 0.0061 0.0177 0.0179
Brugia malayi RNA recognition motif domain containing protein 0.0064 0.0192 0.0194
Leishmania major carbonic anhydrase family protein, putative 0.1428 0.9546 0.964
Echinococcus granulosus intestinal type alkaline phosphatase 0.0362 0.2235 0.2257
Echinococcus granulosus tar DNA binding protein 0.0064 0.0192 0.0194
Echinococcus multilocularis alkaline phosphatase 0.0362 0.2235 0.2257

Activities

Activity type Activity value Assay description Source Reference
EC50 (functional) > 260 uM PUBCHEM_BIOASSAY: Luminescence Cell-Based Dose Retest to Identify Potentiators of Heat Shock Factor 1 (HSF1). (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID493224] ChEMBL. No reference
Potency (functional) 0.7943 uM PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors and Activators of N370S glucocerebrosidase as a Potential Chaperone Treatment of Gaucher Disease. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID1473, AID2293, AID2577, AID2578, AID2587, AID2588, AID2589, AID2590, AID2592, AID2593, AID2595, AID2596, AID2597, AID2613, AID2671, AID488845] ChEMBL. No reference
Potency (functional) 2.0787 uM PUBCHEM_BIOASSAY: Primary qHTS for delayed death inhibitors of the malarial parasite plastid, 48 hour incubation. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488752, AID488774, AID504848, AID504850] ChEMBL. No reference
Potency (functional) 9.285 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) 12.5893 uM PubChem BioAssay. qHTS of GLP-1 Receptor Inverse Agonists (Inhibition Mode). (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) = 19.9526 um PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Bacillus subtilis Sfp phosphopantetheinyl transferase (PPTase). (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 19.9526 uM PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of BAZ2B. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID504391] ChEMBL. No reference
Potency (functional) 20.5878 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) = 22.3872 um PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Human Jumonji Domain Containing 2E (JMJD2E). (Class of assay: confirmatory) ChEMBL. No reference
Potency (binding) = 22.3872 um PUBCHEM_BIOASSAY: qHTS for Inhibitors of Tau Fibril Formation, Thioflavin T Binding. (Class of assay: confirmatory) [Related pubchem assays: 596 ] ChEMBL. No reference
Potency (functional) = 25.1189 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) = 25.1189 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
Potency (functional) 100 uM PUBCHEM_BIOASSAY: qHTS for Inhibitors of Polymerase Iota. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID588623] ChEMBL. No reference
Potency (functional) 398.1072 uM PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of the Phosphatase Activity of Eya2. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488939] 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.
 
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External resources for this compound

Bibliographic References

No literature references available for this target.

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