Detailed information for compound 1291523

Basic information

Technical information
  • TDR Targets ID: 1291523
  • Name: 3-acetyl-1,3-thiazolidine-4-carboxylic acid
  • MW: 175.206 | Formula: C6H9NO3S
  • H donors: 1 H acceptors: 3 LogP: -0.13 Rotable bonds: 2
    Rule of 5 violations (Lipinski): 1
  • SMILES: CC(=O)N1CSCC1C(=O)O
  • InChi: 1S/C6H9NO3S/c1-4(8)7-3-11-2-5(7)6(9)10/h5H,2-3H2,1H3,(H,9,10)
  • InChiKey: WXTBYSIPOKXCPM-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • 3-Acetylthiazolidine-4-carboxylic acid
  • 3-acetyl-4-thiazolidinecarboxylic acid
  • 3-ethanoyl-1,3-thiazolidine-4-carboxylic acid
  • 118014-14-5
  • 5025-82-1
  • 24877-72-3
  • 54323-50-1
  • MLS000035739
  • 3-Acetyl-thiazolidine-4-carboxylic acid
  • EU-0079037
  • 4-Thiazolidinecarboxylic acid, 3-acetyl-
  • (R)-3-Acetylthiazolidine-4-carboxylic acid
  • EINECS 259-102-0
  • N-Acetyl-4-thiazolidinecarboxylic acid
  • N-Acetylthiazolidine-4-carboxylic acid
  • NSC146111
  • SMR000012081
  • ARK084
  • Acetylthiazolidinecarboxylic acid
  • STOCK1N-30681
  • N-ATC
  • NSC 146111
  • EINECS 225-713-6
  • ChemDiv2_000828

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens GNAS complex locus Starlite/ChEMBL No references
Bacillus subtilis 4'-phosphopantetheinyl transferase ffp Starlite/ChEMBL No references
Homo sapiens hydroxysteroid (17-beta) dehydrogenase 10 Starlite/ChEMBL No references

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Brugia malayi aminoadipate-semialdehyde dehydrogenase-phosphopantetheinyl transferase Get druggable targets OG5_129301 All targets in OG5_129301
Loa Loa (eye worm) 3-hydroxyacyl-CoA dehydrogenase type II Get druggable targets OG5_129031 All targets in OG5_129031
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) Get druggable targets OG5_131088 All targets in OG5_131088
Cryptosporidium parvum phosphopantetheinyl transferase Get druggable targets OG5_129301 All targets in OG5_129301
Leishmania infantum 3-oxoacyl-(acyl-carrier protein) reductase, putative Get druggable targets OG5_129031 All targets in OG5_129031
Cryptosporidium hominis proteinx0005 Get druggable targets OG5_129301 All targets in OG5_129301
Brugia malayi 3-hydroxyacyl-CoA dehydrogenase type II Get druggable targets OG5_129031 All targets in OG5_129031
Echinococcus granulosus L aminoadipate semialdehyde Get druggable targets OG5_129301 All targets in OG5_129301
Echinococcus granulosus guanine nucleotide binding protein Gs subunit Get druggable targets OG5_131088 All targets in OG5_131088
Leishmania donovani 3-oxoacyl-(acyl-carrier protein) reductase, putative Get druggable targets OG5_129031 All targets in OG5_129031
Leishmania mexicana 3-oxoacyl-(acyl-carrier protein) reductase, putative Get druggable targets OG5_129031 All targets in OG5_129031
Echinococcus granulosus 3 hydroxyacyl coenzyme A dehydrogenase type 2 Get druggable targets OG5_129031 All targets in OG5_129031
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) Get druggable targets OG5_131088 All targets in OG5_131088
Schistosoma mansoni aminoadipate-semialdehyde dehydrogenase Get druggable targets OG5_129301 All targets in OG5_129301
Echinococcus granulosus guanine nucleotide binding protein Gs subunit Get druggable targets OG5_131088 All targets in OG5_131088
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit Get druggable targets OG5_131088 All targets in OG5_131088
Echinococcus multilocularis 3 hydroxyacyl coenzyme A dehydrogenase type 2 Get druggable targets OG5_129031 All targets in OG5_129031
Mycobacterium tuberculosis Probable short-chain type dehydrogenase/reductase Get druggable targets OG5_129031 All targets in OG5_129031
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit Get druggable targets OG5_131088 All targets in OG5_131088
Mycobacterium ulcerans short-chain type dehydrogenase/reductase Get druggable targets OG5_129031 All targets in OG5_129031
Schistosoma japonicum ko:K04632 guanine nucleotide binding protein (G protein), alpha stimulating, putative Get druggable targets OG5_131088 All targets in OG5_131088
Schistosoma mansoni 3-hydroxyacyl-CoA dehydrogenase Get druggable targets OG5_129031 All targets in OG5_129031
Leishmania braziliensis 3-oxoacyl-(acyl-carrier protein) reductase, putative Get druggable targets OG5_129031 All targets in OG5_129031
Cryptosporidium hominis scully CG7113-PA Get druggable targets OG5_129031 All targets in OG5_129031
Leishmania major 3-oxoacyl-(acyl-carrier protein) reductase, putative Get druggable targets OG5_129031 All targets in OG5_129031
Schistosoma japonicum ko:K00142 aminoadipate-semialdehyde dehydrogenase [EC1.2.1.31], putative Get druggable targets OG5_129301 All targets in OG5_129301
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_129301 All targets in OG5_129301
Mycobacterium ulcerans short-chain type dehydrogenase/reductase Get druggable targets OG5_129031 All targets in OG5_129031
Echinococcus multilocularis L aminoadipate semialdehyde Get druggable targets OG5_129301 All targets in OG5_129301
Schistosoma japonicum expressed protein Get druggable targets OG5_129301 All targets in OG5_129301
Onchocerca volvulus Get druggable targets OG5_129301 All targets in OG5_129301
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative Get druggable targets OG5_131088 All targets in OG5_131088
Schistosoma japonicum ko:K00022 3-hydroxyacyl-CoA dehydrogenase [EC1.1.1.35], putative Get druggable targets OG5_129031 All targets in OG5_129031
Cryptosporidium parvum scully CG7113-PA, putative Get druggable targets OG5_129031 All targets in OG5_129031
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain Get druggable targets OG5_131088 All targets in OG5_131088
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) Get druggable targets OG5_131088 All targets in OG5_131088
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 %
Plasmodium falciparum 3-oxoacyl-[acyl-carrier-protein] reductase hydroxysteroid (17-beta) dehydrogenase 10 252 aa 251 aa 24.7 %
Candida albicans aminoadipate-semialdehyde dehydrogenase small subunit 4'-phosphopantetheinyl transferase ffp   224 aa 183 aa 27.3 %
Candida albicans aminoadipate-semialdehyde dehydrogenase small subunit 4'-phosphopantetheinyl transferase ffp   224 aa 183 aa 27.3 %
Schistosoma mansoni GTP-binding protein alpha subunit gna GNAS complex locus 394 aa 450 aa 28.7 %
Onchocerca volvulus 4'-phosphopantetheinyl transferase ffp   224 aa 186 aa 26.3 %
Trichomonas vaginalis conserved hypothetical protein 4'-phosphopantetheinyl transferase ffp   224 aa 197 aa 22.3 %
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0179 0.0957 0.0947
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.011 0.0539 0.0528
Mycobacterium tuberculosis Probable esterase LipL 0.0107 0.0523 0.1202
Schistosoma mansoni hypothetical protein 0.011 0.0539 0.411
Plasmodium vivax hypothetical protein, conserved 0.0107 0.0523 1
Toxoplasma gondii histone lysine acetyltransferase GCN5-B 0.0044 0.0139 0.1977
Mycobacterium tuberculosis Inositol-1-monophosphatase SuhB 0.0032 0.0068 0.006
Entamoeba histolytica hypothetical protein 0.0179 0.0957 1
Schistosoma mansoni hypothetical protein 0.0179 0.0957 0.7297
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.0124 0.0625 0.1786
Trichomonas vaginalis D-aminoacylase, putative 0.0107 0.0523 0.3549
Loa Loa (eye worm) acetyltransferase 0.0143 0.0742 0.212
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0094 0.0445 0.0434
Brugia malayi Calcitonin receptor-like protein seb-1 0.0347 0.1978 0.5637
Brugia malayi Smad1 0.0041 0.012 0.0316
Loa Loa (eye worm) hypothetical protein 0.0045 0.0144 0.0413
Schistosoma mansoni hypothetical protein 0.0164 0.0869 0.6624
Mycobacterium ulcerans short-chain type dehydrogenase/reductase 0.0069 0.0293 0.5197
Mycobacterium ulcerans fusion of enoyl-CoA hydratase, EchA21 and lipase, LipE 0.0107 0.0523 1
Loa Loa (eye worm) hypothetical protein 0.0232 0.1277 0.3647
Mycobacterium tuberculosis Probable hydrolase 0.0107 0.0523 0.1202
Echinococcus multilocularis survival motor neuron protein 1 0.0232 0.1277 0.1266
Brugia malayi RNA recognition motif domain containing protein 0.0124 0.0625 0.1762
Schistosoma mansoni smad 0.0041 0.012 0.0918
Loa Loa (eye worm) beta-LACTamase domain containing family member 0.0107 0.0523 0.1494
Mycobacterium ulcerans esterase/lipase LipP 0.0107 0.0523 1
Brugia malayi Bromodomain containing protein 0.0042 0.0129 0.0342
Brugia malayi Bromodomain containing protein 0.0079 0.0355 0.0988
Echinococcus multilocularis gcn5proteinral control of amino acid synthesis 0.0143 0.0742 0.0731
Loa Loa (eye worm) hypothetical protein 0.0107 0.0523 0.1494
Echinococcus granulosus histone acetyltransferase KAT2B 0.0044 0.0139 0.0216
Schistosoma mansoni tar DNA-binding protein 0.0124 0.0625 0.4765
Brugia malayi MH1 domain containing protein 0.0041 0.012 0.0316
Brugia malayi Pre-SET motif family protein 0.003 0.0054 0.0126
Plasmodium vivax SET domain protein, putative 0.003 0.0054 0.0202
Brugia malayi Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative 0.0107 0.0523 0.147
Echinococcus multilocularis inositol monophosphatase 1 0.0036 0.0091 0.0079
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0107 0.0523 0.3987
Schistosoma mansoni tar DNA-binding protein 0.0124 0.0625 0.4765
Trichomonas vaginalis D-aminoacylase, putative 0.0107 0.0523 0.3549
Loa Loa (eye worm) hypothetical protein 0.0072 0.0308 0.0879
Onchocerca volvulus 0.0107 0.0523 0.3739
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0094 0.0445 0.1246
Loa Loa (eye worm) hypothetical protein 0.0107 0.0523 0.1494
Brugia malayi Cytochrome P450 family protein 0.0047 0.0161 0.0432
Loa Loa (eye worm) MH2 domain-containing protein 0.0598 0.3501 1
Echinococcus multilocularis histone lysine N methyltransferase SETMAR 0.003 0.0054 0.0042
Brugia malayi PHD-finger family protein 0.0029 0.0047 0.0107
Echinococcus granulosus bromodomain adjacent to zinc finger domain 0.0036 0.0094 0.0139
Echinococcus multilocularis 3 hydroxyacyl coenzyme A dehydrogenase type 2 0.0069 0.0293 0.0282
Trichomonas vaginalis set domain proteins, putative 0.0237 0.1308 1
Mycobacterium ulcerans short-chain type dehydrogenase/reductase 0.0069 0.0293 0.5197
Echinococcus multilocularis beta LACTamase domain containing family member 0.0107 0.0523 0.0512
Echinococcus multilocularis tar DNA binding protein 0.0124 0.0625 0.0614
Plasmodium falciparum histone acetyltransferase GCN5 0.0038 0.0104 1
Leishmania major 3-oxoacyl-(acyl-carrier protein) reductase, putative 0.0069 0.0293 0.5197
Toxoplasma gondii histone lysine methyltransferase SET/SUV39 0.003 0.0054 0.0202
Entamoeba histolytica hypothetical protein 0.0179 0.0957 1
Echinococcus granulosus smad 0.0041 0.012 0.0184
Mycobacterium tuberculosis Possible conserved lipoprotein LpqK 0.0107 0.0523 0.1202
Schistosoma mansoni hypothetical protein 0.011 0.0539 0.411
Loa Loa (eye worm) RNA binding protein 0.0124 0.0625 0.1786
Schistosoma mansoni TGF-beta signal transducer Smad2 0.0041 0.012 0.0918
Toxoplasma gondii ABC1 family protein 0.0107 0.0523 1
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0094 0.0445 0.339
Mycobacterium ulcerans lipase LipD 0.0107 0.0523 1
Echinococcus multilocularis L aminoadipate semialdehyde 0.01 0.0482 0.0471
Echinococcus granulosus tar DNA binding protein 0.0124 0.0625 0.1039
Brugia malayi acetyltransferase, GNAT family protein 0.0143 0.0742 0.2098
Chlamydia trachomatis holo [acyl-carrier protein] synthase 0.0028 0.0044 0.5
Schistosoma mansoni transcription factor LCR-F1 0.0179 0.0957 0.7297
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0107 0.0523 0.3987
Onchocerca volvulus 0.01 0.0482 0.3411
Echinococcus multilocularis histone lysine methyltransferase setb histone lysine methyltransferase eggless 0.0047 0.0159 0.0147
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.011 0.0539 0.0893
Trypanosoma cruzi hypothetical protein, conserved 0.0107 0.0523 1
Trichomonas vaginalis D-aminoacylase, putative 0.0107 0.0523 0.3549
Brugia malayi RNA binding protein 0.0124 0.0625 0.1762
Schistosoma mansoni tar DNA-binding protein 0.0124 0.0625 0.4765
Brugia malayi Inositol-1 0.0036 0.0091 0.0232
Schistosoma mansoni hypothetical protein 0.011 0.0539 0.411
Schistosoma mansoni hypothetical protein 0.0047 0.016 0.1216
Onchocerca volvulus 0.0146 0.0758 0.5612
Loa Loa (eye worm) 3-hydroxyacyl-CoA dehydrogenase type II 0.0065 0.0265 0.0757
Loa Loa (eye worm) hypothetical protein 0.0237 0.1312 0.3748
Brugia malayi MH2 domain containing protein 0.0041 0.012 0.0316
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0094 0.0445 0.0434
Mycobacterium ulcerans beta-lactamase 0.0107 0.0523 1
Trichomonas vaginalis cat eye syndrome critical region protein 2, cscr2, putative 0.0044 0.0139 0.0395
Onchocerca volvulus Huntingtin homolog 0.0121 0.0605 0.439
Loa Loa (eye worm) hypothetical protein 0.011 0.0539 0.154
Schistosoma mansoni zinc finger protein 0.0023 0.0014 0.011
Echinococcus granulosus 3 hydroxyacyl coenzyme A dehydrogenase type 2 0.0069 0.0293 0.0477
Brugia malayi Latrophilin receptor protein 2 0.011 0.0539 0.1516
Loa Loa (eye worm) MH1 domain-containing protein 0.0041 0.012 0.0344
Schistosoma mansoni cellular tumor antigen P53 0.0146 0.0758 0.5777
Entamoeba histolytica hypothetical protein 0.0179 0.0957 1
Schistosoma mansoni aminoadipate-semialdehyde dehydrogenase 0.01 0.0482 0.3673
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.011 0.0539 0.1516
Schistosoma mansoni smad1 5 8 and 0.0041 0.012 0.0918
Echinococcus multilocularis geminin 0.0164 0.0869 0.0858
Loa Loa (eye worm) hypothetical protein 0.0107 0.0523 0.1494
Schistosoma mansoni hypothetical protein 0.011 0.0539 0.411
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0047 0.0159 0.1211
Loa Loa (eye worm) transcription factor SMAD2 0.0598 0.3501 1
Onchocerca volvulus 0.0047 0.016 0.0841
Loa Loa (eye worm) cytochrome P450 family protein 0.0047 0.0161 0.0459
Loa Loa (eye worm) nuclear factor I 0.0023 0.001 0.0028
Brugia malayi MH1 domain containing protein 0.0041 0.012 0.0316
Loa Loa (eye worm) Smad1 0.0041 0.012 0.0344
Loa Loa (eye worm) hypothetical protein 0.0347 0.1978 0.565
Brugia malayi MH2 domain containing protein 0.0041 0.012 0.0316
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0094 0.0445 0.339
Schistosoma mansoni inositol monophosphatase 0.0036 0.0091 0.0694
Brugia malayi Pre-SET motif family protein 0.0208 0.1134 0.322
Mycobacterium ulcerans extragenic suppressor protein SuhB 0.0036 0.0091 0.0973
Schistosoma mansoni 3-hydroxyacyl-CoA dehydrogenase 0.0069 0.0293 0.2235
Mycobacterium tuberculosis Conserved protein 0.0107 0.0523 0.1202
Echinococcus multilocularis zinc finger protein 0.0023 0.0014 0.0003
Mycobacterium leprae Probable lipase LipE 0.0107 0.0523 1
Echinococcus multilocularis mothers against decapentaplegic 5 0.0041 0.012 0.0109
Brugia malayi Iron-sulfur cluster assembly accessory protein 0.0047 0.016 0.0428
Echinococcus multilocularis tumor protein p63 0.0997 0.5917 0.5912
Echinococcus multilocularis cadherin EGF LAG seven pass G type receptor 0.011 0.0539 0.0528
Loa Loa (eye worm) hypothetical protein 0.0039 0.0109 0.0311
Onchocerca volvulus 0.0107 0.0523 0.3739
Trichomonas vaginalis penicillin-binding protein, putative 0.0107 0.0523 0.3549
Brugia malayi 3-hydroxyacyl-CoA dehydrogenase type II 0.0069 0.0293 0.0811
Echinococcus granulosus beta LACTamase domain containing family member 0.0107 0.0523 0.0866
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0179 0.0957 0.1601
Echinococcus multilocularis TGF beta signal transducer SmadC 0.0041 0.012 0.0109
Echinococcus multilocularis bromodomain adjacent to zinc finger domain 0.0064 0.0261 0.0249
Echinococcus granulosus histone acetyltransferase KAT2B 0.0137 0.0704 0.1172
Echinococcus granulosus Smad4 0.0041 0.012 0.0184
Schistosoma mansoni inositol monophosphatase 0.0036 0.0091 0.0694
Mycobacterium tuberculosis Probable esterase/lipase LipP 0.0107 0.0523 0.1202
Brugia malayi latrophilin 2 splice variant baaae 0.0237 0.1312 0.373
Wolbachia endosymbiont of Brugia malayi fructose-1,6-bisphosphatase 0.0036 0.0091 1
Brugia malayi hypothetical protein 0.0179 0.0957 0.2714
Entamoeba histolytica hypothetical protein 0.0179 0.0957 1
Loa Loa (eye worm) hypothetical protein 0.0023 0.001 0.0028
Schistosoma mansoni bromodomain containing protein 0.0068 0.0283 0.2156
Toxoplasma gondii histone lysine acetyltransferase GCN5-A 0.0044 0.0139 0.1977
Schistosoma mansoni histone-lysine n-methyltransferase suv9 0.003 0.0054 0.0412
Brugia malayi hypothetical protein 0.0121 0.0605 0.1704
Mycobacterium leprae possible inositol monophosphatase SubH (IMPase) (inositol-1-phosphatase) (I-1-Pase ). 0.0032 0.0068 0.0496
Trypanosoma brucei inositol-1(or 4)-monophosphatase 1, putative 0.0036 0.0091 0.0973
Echinococcus multilocularis bromodomain adjacent to zinc finger domain 0.0036 0.0094 0.0082
Giardia lamblia Histone acetyltransferase GCN5 0.0038 0.0104 0.5
Brugia malayi aminoadipate-semialdehyde dehydrogenase-phosphopantetheinyl transferase 0.01 0.0482 0.1352
Leishmania major myo-inositol-1(or 4)-monophosphatase 1, putative 0.0036 0.0091 0.0973
Loa Loa (eye worm) hypothetical protein 0.0121 0.0605 0.1727
Mycobacterium tuberculosis Probable short-chain type dehydrogenase/reductase 0.0069 0.0293 0.0625
Mycobacterium tuberculosis Probable lipase LipE 0.0107 0.0523 0.1202
Loa Loa (eye worm) pre-SET domain-containing protein family protein 0.0208 0.1134 0.3239
Trichomonas vaginalis penicillin-binding protein, putative 0.0107 0.0523 0.3549
Schistosoma mansoni gcn5proteinral control of amino-acid synthesis 5-like 2 gcnl2 0.0143 0.0742 0.5657
Onchocerca volvulus 0.0237 0.1308 1
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0347 0.1978 0.565
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0094 0.0445 0.127
Echinococcus granulosus zinc finger protein 0.0023 0.0014 0.0005
Echinococcus granulosus mothers against decapentaplegic 5 0.0041 0.012 0.0184
Echinococcus granulosus histone lysine methyltransferase setb 0.0047 0.0159 0.0249
Echinococcus multilocularis GPCR, family 2 0.011 0.0539 0.0528
Brugia malayi beta-lactamase 0.0107 0.0523 0.147
Echinococcus granulosus L aminoadipate semialdehyde 0.01 0.0482 0.0796
Schistosoma mansoni acetyl-CoA C-acetyltransferase 0.0023 0.0012 0.0089
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0094 0.0445 0.339
Trypanosoma brucei hypothetical protein, conserved 0.0107 0.0523 1
Mycobacterium tuberculosis Possible penicillin-binding protein 0.0685 0.4024 1
Brugia malayi TAR-binding protein 0.0124 0.0625 0.1762
Toxoplasma gondii inositol(myo)-1(or 4)-monophosphatase 2, putative 0.0036 0.0091 0.0973
Brugia malayi beta-lactamase family protein 0.0107 0.0523 0.147
Loa Loa (eye worm) hypothetical protein 0.0107 0.0523 0.1494
Leishmania major hypothetical protein, conserved 0.0107 0.0523 1
Echinococcus granulosus tumor protein p63 0.0997 0.5917 1
Schistosoma mansoni smad1 5 8 and 0.0041 0.012 0.0918
Echinococcus multilocularis smad 0.0041 0.012 0.0109
Mycobacterium leprae conserved hypothetical protein 0.0107 0.0523 1
Echinococcus granulosus geminin 0.0164 0.0869 0.1452
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0047 0.0159 0.1211
Loa Loa (eye worm) inositol-1 0.0036 0.0091 0.026
Echinococcus multilocularis Smad4 0.0041 0.012 0.0109
Loa Loa (eye worm) hypothetical protein 0.0047 0.0159 0.0454
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0094 0.0445 0.0733
Loa Loa (eye worm) hypothetical protein 0.0107 0.0523 0.1494
Trichomonas vaginalis bromodomain-containing protein, putative 0.0044 0.0139 0.0395
Loa Loa (eye worm) hypothetical protein 0.0146 0.0758 0.2165
Onchocerca volvulus Huntingtin homolog 0.0121 0.0605 0.439
Schistosoma mansoni hypothetical protein 0.0237 0.1312 1
Trichomonas vaginalis esterase, putative 0.0107 0.0523 0.3549
Loa Loa (eye worm) TAR-binding protein 0.0124 0.0625 0.1786
Loa Loa (eye worm) bromodomain containing protein 0.0021 0.0003 0.0008
Schistosoma mansoni tar DNA-binding protein 0.0124 0.0625 0.4765
Treponema pallidum 4'-phosphopantetheinyl transferase 0.0028 0.0044 0.5
Mycobacterium tuberculosis Conserved protein 0.0107 0.0523 0.1202
Mycobacterium tuberculosis Conserved protein 0.0107 0.0523 0.1202
Brugia malayi MH2 domain containing protein 0.0598 0.3501 1
Schistosoma mansoni smad1 5 8 and 0.0041 0.012 0.0918
Echinococcus granulosus inositol monophosphatase 1 0.0036 0.0091 0.0134
Mycobacterium tuberculosis Probable conserved lipoprotein 0.0107 0.0523 0.1202
Plasmodium vivax histone acetyltransferase GCN5, putative 0.0044 0.0139 0.1977
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.003 0.0054 0.0412
Echinococcus granulosus 5'partial|histone lysine N methyltransferase SETDB2 0.0029 0.0047 0.006
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0347 0.1978 0.5637
Echinococcus granulosus survival motor neuron protein 1 0.0232 0.1277 0.2142
Echinococcus granulosus cadherin EGF LAG seven pass G type receptor 0.011 0.0539 0.0893
Echinococcus granulosus TGF beta signal transducer SmadC 0.0041 0.012 0.0184
Entamoeba histolytica myo-inositol monophosphatase, putative 0.0036 0.0091 0.051
Loa Loa (eye worm) beta-lactamase 0.0107 0.0523 0.1494
Mycobacterium tuberculosis Probable lipase LipD 0.0107 0.0523 0.1202
Echinococcus granulosus GPCR family 2 0.011 0.0539 0.0893
Schistosoma mansoni hypothetical protein 0.0164 0.0869 0.6624
Loa Loa (eye worm) MH2 domain-containing protein 0.0041 0.012 0.0344
Loa Loa (eye worm) hypothetical protein 0.01 0.0482 0.1376
Schistosoma mansoni survival motor neuron protein 0.0047 0.016 0.1216
Loa Loa (eye worm) latrophilin receptor protein 2 0.011 0.0539 0.154
Schistosoma mansoni tar DNA-binding protein 0.0124 0.0625 0.4765
Onchocerca volvulus 0.0107 0.0523 0.3739
Brugia malayi beta-lactamase family protein 0.0107 0.0523 0.147
Trypanosoma cruzi hypothetical protein, conserved 0.0107 0.0523 1
Mycobacterium ulcerans hypothetical protein 0.0107 0.0523 1
Echinococcus granulosus bromodomain adjacent to zinc finger domain 0.0064 0.0261 0.0422
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0094 0.0445 0.0733
Loa Loa (eye worm) hypothetical protein 0.0107 0.0523 0.1494
Loa Loa (eye worm) hypothetical protein 0.0121 0.0605 0.1727
Brugia malayi hypothetical protein 0.0232 0.1277 0.3629
Loa Loa (eye worm) hypothetical protein 0.0047 0.0156 0.0446
Schistosoma mansoni Smad4 0.0041 0.012 0.0918
Entamoeba histolytica acetyltransferase, GNAT family 0.0038 0.0104 0.0648

Activities

Activity type Activity value Assay description Source Reference
Potency (functional) 11.6891 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) = 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 HADH2 (Hydroxyacyl-Coenzyme A Dehydrogenase, Type II). (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 19.9526 uM PubChem BioAssay. qHTS for Agonist of gsp, the Etiologic Mutation Responsible for Fibrous Dysplasia/McCune-Albright Syndrome: qHTS. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 25.1189 uM PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of 15-hLO-2 (15-human lipoxygenase 2). (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID2312, AID2537, AID2702] ChEMBL. No reference
Potency (functional) 39.8107 uM PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Histone Lysine Methyltransferase G9a. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID504404] ChEMBL. No reference
Potency (functional) 89.1251 uM PUBCHEM_BIOASSAY: HTS for Inhibitors of HP1-beta Chromodomain Interactions with Methylated Histone Tails. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488962] 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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