Detailed information for compound 1708484

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 394.49 | Formula: C21H22N4O2S
  • H donors: 1 H acceptors: 4 LogP: 2.45 Rotable bonds: 5
    Rule of 5 violations (Lipinski): 1
  • SMILES: O=C(N1C[C@H](n2nnc(c2)C2CC2)[C@H](C[C@@H]1c1ccccc1)O)c1cccs1
  • InChi: 1S/C21H22N4O2S/c26-19-11-17(15-5-2-1-3-6-15)24(21(27)20-7-4-10-28-20)13-18(19)25-12-16(22-23-25)14-8-9-14/h1-7,10,12,14,17-19,26H,8-9,11,13H2/t17-,18+,19+/m1/s1
  • InChiKey: YRXBMYFKYAGSLI-QYZOEREBSA-N  


Substructure search Similarity search

Network

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Synonyms

No synonyms found for this compound

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
Trypanosoma cruzi DNA polymerase kappa, putative 0.0017 0.0075 0.0005
Echinococcus multilocularis hepatocyte nuclear factor 4 alpha 0.0093 0.0873 0.1039
Echinococcus granulosus geminin 0.0189 0.1871 0.7966
Plasmodium falciparum ataxin-2 like protein, putative 0.0028 0.0191 0.0896
Loa Loa (eye worm) hypothetical protein 0.0044 0.0358 0.0376
Echinococcus multilocularis nuclear receptor subfamily 4 group A 0.0044 0.0358 0.0425
Mycobacterium ulcerans acetyl-coenzyme a carboxylase carboxyl transferase (subunit beta) AccD3 0.0027 0.0176 0.1676
Schistosoma mansoni coup transcription factor 0.0093 0.0873 0.4396
Schistosoma mansoni nuclear hormone receptor superfamily protein-related 0.0044 0.0358 0.1711
Schistosoma mansoni survival motor neuron protein 0.0048 0.0398 0.192
Loa Loa (eye worm) hypothetical protein 0.0093 0.0873 0.0919
Plasmodium falciparum AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.0019 0.0095 0.0156
Brugia malayi nuclear receptor NHR-67 0.0044 0.0358 0.0377
Echinococcus granulosus propionyl coenzyme A carboxylase alpha chain 0.0075 0.0679 0.2886
Trypanosoma brucei DNA polymerase IV, putative 0.0017 0.0075 0.0285
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0046 0.0377 0.1599
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0093 0.0873 0.092
Brugia malayi hypothetical protein 0.0044 0.0358 0.0377
Trypanosoma brucei DNA polymerase kappa, putative 0.0017 0.0075 0.0285
Plasmodium falciparum biotin carboxylase subunit of acetyl CoA carboxylase, putative 0.0142 0.1381 1
Schistosoma mansoni RAR-like nuclear receptor 0.0093 0.0873 0.4396
Echinococcus multilocularis Nuclear hormone receptor HR96 0.0044 0.0358 0.0425
Schistosoma mansoni transcription factor LCR-F1 0.0036 0.0274 0.1277
Loa Loa (eye worm) hypothetical protein 0.0028 0.0191 0.02
Echinococcus multilocularis dna polymerase kappa 0.0017 0.0075 0.0088
Trypanosoma brucei DNA polymerase IV, putative 0.0017 0.0075 0.0285
Wolbachia endosymbiont of Brugia malayi Acetyl-CoA carboxylase, carboxyltransferase component 0.0027 0.0176 0.1676
Onchocerca volvulus 0.0048 0.0398 0.0169
Schistosoma mansoni nuclear receptor nhr-48 0.0044 0.0358 0.1711
Trypanosoma cruzi DNA polymerase eta, putative 0.0017 0.0075 0.0005
Echinococcus granulosus nuclear receptor subfamily 1 group D 0.0049 0.0413 0.1753
Brugia malayi ecdysone receptor 0.0044 0.0358 0.0377
Loa Loa (eye worm) carboxyl transferase domain-containing protein 0.0189 0.1876 0.1976
Brugia malayi hypothetical protein 0.0018 0.0087 0.0092
Trypanosoma brucei DNA polymerase kappa, putative 0.0017 0.0075 0.0285
Brugia malayi Nuclear hormone receptor family member nhr-14 0.0093 0.0873 0.092
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0044 0.0358 0.1518
Onchocerca volvulus 0.0093 0.0873 0.0655
Loa Loa (eye worm) CXXC zinc finger family protein 0.0032 0.0232 0.0244
Loa Loa (eye worm) hypothetical protein 0.0044 0.0358 0.0376
Loa Loa (eye worm) hypothetical protein 0.0049 0.0413 0.0434
Trypanosoma brucei DNA polymerase kappa, putative 0.0017 0.0075 0.0285
Brugia malayi CXXC zinc finger family protein 0.0032 0.0232 0.0245
Echinococcus granulosus terminal deoxycytidyl transferase rev1 0.0017 0.0075 0.0313
Schistosoma mansoni nuclear hormone receptor nor-1/nor-2 0.0093 0.0873 0.4396
Mycobacterium ulcerans pyruvate carboxylase 0.0075 0.0679 1
Toxoplasma gondii LsmAD domain-containing protein 0.0028 0.0191 0.0625
Echinococcus granulosus dna polymerase kappa 0.0017 0.0075 0.0313
Echinococcus granulosus propionyl coenzyme A carboxylase beta chain 0.0027 0.0176 0.0743
Mycobacterium tuberculosis Probable exodeoxyribonuclease III protein XthA (exonuclease III) (EXO III) (AP endonuclease VI) 0.0019 0.0095 0.0328
Loa Loa (eye worm) nuclear receptor nhr-7B 0.0918 0.9485 1
Brugia malayi nuclear receptor RXR 0.0044 0.0358 0.0377
Trypanosoma brucei DNA polymerase kappa, putative 0.0017 0.0075 0.0285
Echinococcus multilocularis dna polymerase eta 0.0017 0.0075 0.0088
Plasmodium falciparum ataxin-2 like protein, putative 0.0028 0.0191 0.0896
Leishmania major DNA polymerase kappa, putative 0.0017 0.0075 0.0003
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0093 0.0873 0.092
Trypanosoma brucei DNA polymerase IV, putative 0.0017 0.0075 0.0285
Echinococcus granulosus COUP TF:Svp nuclear hormone receptor 0.0093 0.0873 0.3712
Schistosoma mansoni retinoid-x-receptor (RXR) 0.0049 0.0413 0.1998
Onchocerca volvulus Nuclear receptor subfamily 6 group A member 1 homolog 0.0044 0.0358 0.0128
Echinococcus multilocularis ecdysone induced protein 78C 0.0093 0.0873 0.1039
Toxoplasma gondii acetyl-coA carboxylase ACC2 0.0196 0.1947 1
Schistosoma mansoni nuclear hormone receptor 0.0093 0.0873 0.4396
Entamoeba histolytica acetyl-coA carboxylase, putative 0.0033 0.0247 0.8649
Trypanosoma cruzi 3-methylcrotonyl-CoA carboxylase, putative 0.0075 0.0679 0.5531
Mycobacterium ulcerans bifunctional protein acetyl-/propionyl-coenzyme a carboxylase (alpha chain) AccA3 0.0075 0.0679 1
Schistosoma mansoni propionyl-CoA carboxylase beta chain mitochondrial precursor 0.0027 0.0176 0.0762
Schistosoma mansoni carbamoyl-phosphate synthetase 0.0017 0.0074 0.0234
Trypanosoma brucei PAB1-binding protein , putative 0.0028 0.0191 0.0889
Trypanosoma cruzi acetyl-CoA carboxylase, putative 0.0027 0.0176 0.0927
Loa Loa (eye worm) hypothetical protein 0.0017 0.0075 0.0078
Mycobacterium tuberculosis Acetyl/propionyl-CoA carboxylase (beta subunit) AccD6 0.0027 0.0176 0.1669
Loa Loa (eye worm) exodeoxyribonuclease III family protein 0.0019 0.0095 0.0098
Echinococcus multilocularis terminal deoxycytidyl transferase rev1 0.0017 0.0075 0.0088
Trypanosoma cruzi acetyl-CoA carboxylase 0.0121 0.1167 1
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0093 0.0873 0.3712
Schistosoma mansoni FTZ-F1 nuclear receptor-like protein 0.0093 0.0873 0.4396
Brugia malayi Nuclear hormone receptor family member nhr-40 0.0093 0.0873 0.092
Loa Loa (eye worm) nuclear hormone receptor family member nhr-40 0.0093 0.0873 0.0919
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0093 0.0873 0.1039
Entamoeba histolytica exodeoxyribonuclease III, putative 0.0019 0.0095 0.0994
Echinococcus multilocularis FTZ F1 alpha 0.0093 0.0873 0.1039
Loa Loa (eye worm) steroid hormone receptor 0.0093 0.0873 0.0919
Schistosoma mansoni hypothetical protein 0.0189 0.1871 0.9601
Loa Loa (eye worm) hypothetical protein 0.0044 0.0358 0.0376
Brugia malayi hypothetical protein 0.0049 0.0413 0.0435
Trypanosoma brucei DNA polymerase kappa, putative 0.0017 0.0075 0.0285
Schistosoma mansoni nuclear receptor 0.0044 0.0358 0.1711
Schistosoma mansoni photoreceptor-specific nuclear receptor related 0.0093 0.0873 0.4396
Mycobacterium tuberculosis Probable acetyl-/propionyl-coenzyme A carboxylase alpha chain (alpha subunit) AccA2: biotin carboxylase + biotin carboxyl carrie 0.0075 0.0679 1
Brugia malayi MH2 domain containing protein 0.0133 0.1288 0.1358
Mycobacterium ulcerans DNA polymerase IV 0.0017 0.0075 0.0009
Entamoeba histolytica hypothetical protein 0.0036 0.0274 1
Loa Loa (eye worm) nuclear Hormone Receptor family member 0.0093 0.0873 0.0919
Echinococcus granulosus survival motor neuron protein 1 0.0235 0.2348 1
Mycobacterium ulcerans acetyl-/propionyl-CoA carboxylase subunit beta 0.0027 0.0176 0.1676
Brugia malayi Carboxyl transferase domain containing protein 0.0189 0.1876 0.1977
Loa Loa (eye worm) hypothetical protein 0.0093 0.0873 0.0919
Brugia malayi hypothetical protein 0.0028 0.0191 0.0202
Schistosoma mansoni ap endonuclease 0.0019 0.0095 0.034
Echinococcus multilocularis Nuclear hormone receptor family member nhr 41 0.0093 0.0873 0.1039
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0044 0.0358 0.0425
Echinococcus granulosus Ataxin 2 N terminaldomain containing protein 0.0013 0.003 0.012
Schistosoma mansoni ap endonuclease 0.0019 0.0095 0.034
Loa Loa (eye worm) hypothetical protein 0.0044 0.0358 0.0376
Loa Loa (eye worm) hypothetical protein 0.0093 0.0873 0.0919
Leishmania major propionyl-coa carboxylase beta chain, putative 0.0027 0.0176 0.0541
Schistosoma mansoni rab geranylgeranyl transferase alpha subunit 0.0017 0.0075 0.0236
Trypanosoma brucei DNA polymerase kappa, putative 0.0017 0.0075 0.0285
Brugia malayi photoreceptor-specific nuclear receptor 0.0093 0.0873 0.092
Leishmania major carboxylase, putative 0.0075 0.0679 0.3226
Brugia malayi conserved hypotetical protein 0.0044 0.0358 0.0377
Loa Loa (eye worm) nuclear hormone receptor family member nhr-31 0.0093 0.0873 0.0919
Brugia malayi Nuclear hormone receptor-like 1 0.0049 0.0413 0.0435
Echinococcus granulosus FTZ F1 nuclear receptor protein 0.0093 0.0873 0.3712
Trypanosoma brucei DNA polymerase kappa, putative 0.0017 0.0075 0.0285
Echinococcus multilocularis propionyl coenzyme A carboxylase beta chain 0.0027 0.0176 0.0208
Trypanosoma brucei DNA polymerase eta, putative 0.0017 0.0075 0.0285
Mycobacterium ulcerans exodeoxyribonuclease III protein XthA 0.0019 0.0095 0.0337
Trypanosoma cruzi 3-methylcrotonoyl-CoA carboxylase beta subunit, putative 0.0027 0.0176 0.0927
Loa Loa (eye worm) hypothetical protein 0.0044 0.0358 0.0376
Loa Loa (eye worm) hypothetical protein 0.0235 0.2348 0.2474
Schistosoma mansoni hypothetical protein 0.0036 0.0274 0.1277
Mycobacterium ulcerans propionyl-CoA carboxylase beta chain 4 AccD4 0.0027 0.0176 0.1676
Brugia malayi nuclear receptor RXR 0.0049 0.0413 0.0435
Brugia malayi Cytochrome P450 family protein 0.0022 0.0132 0.0139
Trypanosoma brucei acetyl-CoA carboxylase 0.0196 0.1947 1
Wolbachia endosymbiont of Brugia malayi exonuclease III 0.0019 0.0095 0.0337
Trypanosoma brucei 3-methylcrotonyl-CoA carboxylase alpha subunit, putative 0.0075 0.0679 0.3417
Schistosoma mansoni Tr4/Tr2 (homologue) 0.0093 0.0873 0.4396
Schistosoma mansoni hypothetical protein 0.0048 0.0398 0.192
Loa Loa (eye worm) ImpB/MucB/SamB family protein 0.0017 0.0075 0.0078
Treponema pallidum exodeoxyribonuclease (exoA) 0.0019 0.0095 0.5
Brugia malayi hypothetical protein 0.0036 0.0274 0.0289
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0093 0.0873 0.092
Trypanosoma cruzi apurinic/apyrimidinic endonuclease 0.0019 0.0095 0.0186
Brugia malayi orphan nuclear receptor NR2E1 0.0044 0.0358 0.0377
Toxoplasma gondii exonuclease III APE 0.0019 0.0095 0.0109
Loa Loa (eye worm) hypothetical protein 0.0044 0.0358 0.0376
Echinococcus granulosus retinoic acid receptor rxr beta a 0.0093 0.0873 0.3712
Brugia malayi steroid hormone receptor 0.0093 0.0873 0.092
Schistosoma mansoni cpg binding protein 0.0034 0.0251 0.1157
Schistosoma mansoni ecdysone-induced protein 78c (dr-78) 0.0049 0.0413 0.1998
Trypanosoma brucei DNA polymerase kappa, putative 0.0017 0.0075 0.0285
Loa Loa (eye worm) hypothetical protein 0.0093 0.0873 0.0919
Plasmodium vivax biotin carboxylase subunit of acetyl CoA carboxylase, putative 0.0142 0.1381 1
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0046 0.0377 0.1809
Leishmania major apurinic/apyrimidinic endonuclease-redox protein 0.0019 0.0095 0.0109
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0093 0.0873 0.092
Brugia malayi Nuclear hormone receptor family member nhr-41 0.0093 0.0873 0.092
Schistosoma mansoni aspartate carbamoyltransferase 0.0017 0.0074 0.0234
Echinococcus granulosus DNA apurinic or apyrimidinic site lyase 0.0019 0.0095 0.0398
Brugia malayi nuclear receptor NHR-88 0.0093 0.0873 0.092
Mycobacterium ulcerans acetyl/propionyl CoA carboxylase subunit beta 0.0027 0.0176 0.1676
Echinococcus granulosus ecdysone induced protein 78C 0.0093 0.0873 0.3712
Onchocerca volvulus 0.0044 0.0358 0.0128
Leishmania major DNA polymerase eta, putative 0.0017 0.0075 0.0003
Schistosoma mansoni retinoid-x-receptor (RXR) 0.0093 0.0873 0.4396
Schistosoma mansoni cpg binding protein 0.0032 0.0232 0.1057
Trypanosoma cruzi DNA polymerase kappa, putative 0.0017 0.0075 0.0005
Echinococcus multilocularis COUP TF:Svp nuclear hormone receptor 0.0093 0.0873 0.1039
Schistosoma mansoni hepatocyte nuclear factor 4-alpha (hnf-4-alpha) 0.0044 0.0358 0.1711
Echinococcus multilocularis thyroid hormone receptor alpha 0.0093 0.0873 0.1039
Loa Loa (eye worm) transcription factor SMAD2 0.0133 0.1288 0.1357
Loa Loa (eye worm) hypothetical protein 0.0044 0.0358 0.0376
Echinococcus multilocularis muscleblind protein 1 0.0167 0.1637 0.1952
Echinococcus multilocularis FTZ F1 nuclear receptor protein 0.0093 0.0873 0.1039
Brugia malayi tailless protein 0.0044 0.0358 0.0377
Echinococcus multilocularis survival motor neuron protein 1 0.0235 0.2348 0.28
Echinococcus multilocularis Ataxin 2, N terminal,domain containing protein 0.0013 0.003 0.0034
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0046 0.0377 0.0448
Entamoeba histolytica hypothetical protein 0.0036 0.0274 1
Brugia malayi hypothetical protein 0.0049 0.0413 0.0435
Giardia lamblia Acetyl-CoA carboxylase/pyruvate carboxylase fusion protein, putative 0.0033 0.0247 1
Loa Loa (eye worm) hypothetical protein 0.0044 0.0358 0.0376
Echinococcus multilocularis nuclear receptor subfamily 1 group D 0.0049 0.0413 0.0491
Loa Loa (eye worm) hypothetical protein 0.0093 0.0873 0.0919
Brugia malayi nuclear hormone receptor 0.0918 0.9485 1
Wolbachia endosymbiont of Brugia malayi Acetyl/propionyl-CoA carboxylase, alpha subunit 0.0075 0.0679 1
Loa Loa (eye worm) nuclear hormone receptor family member nhr-49 0.0093 0.0873 0.0919
Echinococcus granulosus muscleblind protein 0.0167 0.1637 0.6971
Trichomonas vaginalis ap endonuclease, putative 0.0019 0.0095 1
Schistosoma mansoni nuclear hormone receptor 0.0044 0.0358 0.1711
Toxoplasma gondii acetyl-CoA carboxylase ACC1 0.0196 0.1947 1
Brugia malayi nuclear receptor NHR-88 0.0044 0.0358 0.0377
Loa Loa (eye worm) hypothetical protein 0.0167 0.1637 0.1725
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0046 0.0377 0.0448
Onchocerca volvulus 0.0044 0.0358 0.0128
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0036 0.0274 0.0326
Brugia malayi nuclear hormone receptor family member nhr-6 0.0044 0.0358 0.0377
Schistosoma mansoni carbamoyl-phosphate synthetase 0.0017 0.0074 0.0234
Schistosoma mansoni retinoic acid receptor RXR 0.0093 0.0873 0.4396
Schistosoma mansoni methylcrotonyl-CoA carboxylase 0.0075 0.068 0.339
Leishmania major acetyl-CoA carboxylase, putative 0.0196 0.1947 1
Echinococcus granulosus acetyl coenzyme A carboxylase 1 0.0196 0.1947 0.8292
Giardia lamblia Endonuclease/Exonuclease/phosphatase 0.0019 0.0095 0.1149
Loa Loa (eye worm) hypothetical protein 0.0093 0.0873 0.0919
Brugia malayi Nuclear hormone receptor family member nhr-1 0.0093 0.0873 0.092
Loa Loa (eye worm) hypothetical protein 0.0049 0.0413 0.0434
Loa Loa (eye worm) nuclear hormone receptor-like 1 0.0049 0.0413 0.0434
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0093 0.0873 0.3712
Brugia malayi Nuclear hormone receptor E75 0.0044 0.0358 0.0377
Loa Loa (eye worm) hypothetical protein 0.0874 0.9025 0.9515
Trypanosoma cruzi 3-methylcrotonyl-CoA carboxylase, putative 0.0075 0.0679 0.5531
Loa Loa (eye worm) nuclear hormone receptor family member nhr-1 0.0093 0.0873 0.0919
Echinococcus multilocularis retinoic acid receptor rxr beta a retinoic acid receptor rxr alpha a retinoic acid receptor rxr alpha 0.0044 0.0358 0.0425
Loa Loa (eye worm) MH2 domain-containing protein 0.0133 0.1288 0.1357
Brugia malayi ecdysteroid receptor 0.0093 0.0873 0.092
Echinococcus granulosus thyroid hormone receptor alpha 0.0044 0.0358 0.1518
Loa Loa (eye worm) nuclear hormone receptor 0.0044 0.0358 0.0376
Trypanosoma brucei glutamine hydrolysing (not ammonia-dependent) carbomoyl phosphate synthase, putative 0.0017 0.0074 0.0282
Mycobacterium tuberculosis Probable propionyl-CoA carboxylase beta chain 5 AccD5 (pccase) (propanoyl-CoA:carbon dioxide ligase) 0.0027 0.0176 0.1669
Brugia malayi ImpB/MucB/SamB family protein 0.0017 0.0075 0.0079
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0046 0.0377 0.1809
Loa Loa (eye worm) DR-78 0.0044 0.0358 0.0376
Trypanosoma cruzi apurinic/apyrimidinic endonuclease, putative 0.0019 0.0095 0.0186
Mycobacterium ulcerans propionyl-CoA carboxylase beta chain 5 AccD5 0.0027 0.0176 0.1676
Trypanosoma cruzi PAB1-binding protein , putative 0.0028 0.0191 0.1071
Trypanosoma brucei unspecified product 0.0017 0.0075 0.0285
Plasmodium vivax ataxin-2 like protein, putative 0.0028 0.0191 0.0896
Echinococcus granulosus dna polymerase eta 0.0017 0.0075 0.0313
Onchocerca volvulus Protein ultraspiracle homolog 0.0093 0.0873 0.0655
Brugia malayi Nuclear hormone receptor family member nhr-31 0.0093 0.0873 0.092
Trypanosoma brucei apurinic/apyrimidinic endonuclease, putative 0.0019 0.0095 0.0388
Brugia malayi hypothetical protein 0.0235 0.2348 0.2476
Echinococcus multilocularis nuclear receptor nhr 48 0.0044 0.0358 0.0425
Toxoplasma gondii pyruvate carboxylase 0.0075 0.0679 0.3226
Echinococcus multilocularis Nuclear hormone receptor HR96 0.0044 0.0358 0.0425
Loa Loa (eye worm) hypothetical protein 0.0044 0.0358 0.0376
Trypanosoma cruzi DNA polymerase kappa, putative 0.0017 0.0075 0.0005
Echinococcus multilocularis acetyl coenzyme A carboxylase 1 0.0196 0.1947 0.2322
Trypanosoma brucei 3-methylcrotonoyl-CoA carboxylase beta subunit, putative 0.0027 0.0176 0.0808
Entamoeba histolytica hypothetical protein 0.0036 0.0274 1
Echinococcus multilocularis cpg binding protein 0.0034 0.0251 0.0298
Brugia malayi Nuclear hormone receptor family member nhr-3 0.0093 0.0873 0.092
Schistosoma mansoni zinc finger protein 0.0044 0.0358 0.1711
Loa Loa (eye worm) hypothetical protein 0.0044 0.0358 0.0376
Echinococcus multilocularis geminin 0.0189 0.1871 0.223
Mycobacterium tuberculosis Probable pyruvate carboxylase Pca (pyruvic carboxylase) 0.0075 0.0679 1
Loa Loa (eye worm) hypothetical protein 0.0044 0.0358 0.0376
Toxoplasma gondii histone lysine methyltransferase SET1 0.0061 0.0531 0.244
Loa Loa (eye worm) nuclear receptor NHR-67 0.0044 0.0358 0.0376
Trypanosoma brucei 3-methylcrotonyl-CoA carboxylase alpha subunit, putative 0.0075 0.0679 0.3417
Leishmania major methylcrotonoyl-coa carboxylase biotinylated subunitprotein-like protein 0.0075 0.0679 0.3226
Schistosoma mansoni nuclear receptor 2DBD-gamma 0.0093 0.0873 0.4396
Brugia malayi Nuclear hormone receptor E75 0.0044 0.0358 0.0377
Leishmania major DNA polymerase kappa, putative,DNA polymerase IV, putative 0.0017 0.0075 0.0003
Schistosoma mansoni terminal deoxycytidyl transferase 0.0017 0.0075 0.0236
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0046 0.0377 0.0397
Trypanosoma cruzi PAB1-binding protein , putative 0.0028 0.0191 0.1071
Trypanosoma cruzi 3-methylcrotonoyl-CoA carboxylase beta subunit, putative 0.0027 0.0176 0.0927
Leishmania major 3-methylcrotonoyl-CoA carboxylase beta subunit, putative 0.0027 0.0176 0.0541
Brugia malayi Muscleblind-like protein 0.0167 0.1637 0.1726
Onchocerca volvulus Bile acid receptor homolog 0.0093 0.0873 0.0655
Mycobacterium ulcerans acetyl-/propionyl-coenzyme a carboxylase alpha chain, AccA2 0.0075 0.0679 1
Echinococcus granulosus Nuclear hormone receptor HR96 0.0044 0.0358 0.1518
Loa Loa (eye worm) hypothetical protein 0.0167 0.1637 0.1725
Brugia malayi Nuclear hormone receptor family member nhr-49 0.0093 0.0873 0.092
Brugia malayi nuclear hormone receptor 0.0093 0.0873 0.092
Loa Loa (eye worm) hypothetical protein 0.0049 0.0413 0.0434
Loa Loa (eye worm) hypothetical protein 0.0044 0.0358 0.0376
Echinococcus multilocularis propionyl coenzyme A carboxylase alpha chain 0.0075 0.0679 0.0808
Brugia malayi nuclear hormone receptor family member odr-7 0.0044 0.0358 0.0377
Brugia malayi Iron-sulfur cluster assembly accessory protein 0.0048 0.0398 0.0419
Loa Loa (eye worm) cytochrome P450 family protein 0.0022 0.0132 0.0138
Echinococcus granulosus Nuclear hormone receptor family member nhr 41 0.0093 0.0873 0.3712
Schistosoma mansoni hypothetical protein 0.0189 0.1871 0.9601
Brugia malayi Nuclear hormone receptor-like 1 0.0049 0.0413 0.0435
Loa Loa (eye worm) nuclear hormone receptor family member nhr-14 0.0093 0.0873 0.0919
Brugia malayi hypothetical protein 0.0044 0.0358 0.0377
Toxoplasma gondii acyl-CoA carboxyltransferase beta chain, putative 0.0027 0.0176 0.0541
Echinococcus granulosus Nuclear hormone receptor HR96 0.0044 0.0358 0.1518
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0093 0.0873 0.092
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0093 0.0873 0.092
Entamoeba histolytica hypothetical protein 0.0036 0.0274 1
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0036 0.0274 0.1163
Schistosoma mansoni methylcrotonyl-CoA carboxylase 0.0075 0.068 0.339
Trypanosoma brucei unspecified product 0.0049 0.0411 0.203
Schistosoma mansoni pyruvate carboxylase 0.0075 0.0679 0.3384
Loa Loa (eye worm) nuclear hormone receptor family member nhr-41 0.0093 0.0873 0.0919
Echinococcus granulosus cpg binding protein 0.0034 0.0251 0.1065
Schistosoma mansoni cpg binding protein 0.0034 0.0251 0.1157
Echinococcus multilocularis DNA (apurinic or apyrimidinic site) lyase 0.0019 0.0095 0.0111
Trichomonas vaginalis ap endonuclease, putative 0.0019 0.0095 1
Mycobacterium ulcerans propionyl-CoA carboxylase beta chain 4 AccD4_2 0.0027 0.0176 0.1676
Trypanosoma brucei DNA polymerase kappa, putative 0.0017 0.0075 0.0285
Brugia malayi exodeoxyribonuclease III family protein 0.0019 0.0095 0.01
Schistosoma mansoni nuclear receptor 0.0044 0.0358 0.1711
Loa Loa (eye worm) hypothetical protein 0.0049 0.0413 0.0434
Echinococcus multilocularis muscleblind protein 0.0167 0.1637 0.1952
Mycobacterium ulcerans DNA polymerase IV 0.0017 0.0075 0.0009
Schistosoma mansoni steroid hormone receptor ad4bp 0.0093 0.0873 0.4396
Echinococcus granulosus hepatocyte nuclear factor 4 alpha 0.0093 0.0873 0.3712
Schistosoma mansoni thyroid hormone receptor 0.0093 0.0873 0.4396
Loa Loa (eye worm) hypothetical protein 0.0093 0.0873 0.0919
Mycobacterium leprae Probable bifunctional protein acetyl-/propionyl-coenzyme A carboxylase, alpha chain AccA3 (BccP) 0.0075 0.0679 1
Trypanosoma cruzi DNA polymerase kappa, putative 0.0017 0.0075 0.0005
Mycobacterium ulcerans acetyl-/propionyl-coenzyme a carboxylase alpha chain AccA1 0.0075 0.0679 1
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0068 0.0607 0.3012
Brugia malayi Steroid receptor seven-up type 2 0.0093 0.0873 0.092
Brugia malayi nuclear receptor subfamily 1, group D, member 1, putative 0.0044 0.0358 0.0377
Plasmodium vivax AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.0019 0.0095 0.0156
Schistosoma mansoni thyroid hormone receptor 0.0093 0.0873 0.4396
Echinococcus granulosus nuclear receptor nhr 48 0.0044 0.0358 0.1518
Loa Loa (eye worm) hypothetical protein 0.0049 0.0413 0.0434
Echinococcus granulosus FTZ F1 alpha 0.0093 0.0873 0.3712
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0046 0.0377 0.1599
Schistosoma mansoni nuclear hormone receptor 0.0044 0.0358 0.1711
Schistosoma mansoni acetyl-CoA carboxylase 0.0196 0.1947 1
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0046 0.0377 0.0396
Brugia malayi ImpB/MucB/SamB family protein 0.0017 0.0075 0.0079
Brugia malayi Nuclear hormone receptor-like 1 0.0093 0.0873 0.092
Schistosoma mansoni DNA polymerase eta 0.0017 0.0075 0.0236
Loa Loa (eye worm) hypothetical protein 0.0093 0.0873 0.0919
Trypanosoma brucei DNA polymerase kappa, putative 0.0017 0.0075 0.0285
Chlamydia trachomatis biotin carboxylase 0.0068 0.0607 1
Echinococcus multilocularis atpase aaa+ type core atpase aaa type core 0.0812 0.8383 1
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0093 0.0873 0.1039
Onchocerca volvulus Nuclear receptor subfamily 6 group A member 1 homolog 0.0044 0.0358 0.0128
Echinococcus granulosus nuclear receptor subfamily 4 group A 0.0044 0.0358 0.1518
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0046 0.0377 0.1809
Loa Loa (eye worm) hypothetical protein 0.0044 0.0358 0.0376
Leishmania major hypothetical protein, conserved 0.0028 0.0191 0.0625

Activities

Activity type Activity value Assay description Source Reference
Potency (functional) 50.1187 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

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.
 
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External resources for this compound

Bibliographic References

No literature references available for this target.

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