Detailed information for compound 1219429

Basic information

Technical information
  • TDR Targets ID: 1219429
  • Name: T5277114
  • MW: 417.485 | Formula: C18H23N7O3S
  • H donors: 1 H acceptors: 6 LogP: 2.24 Rotable bonds: 6
    Rule of 5 violations (Lipinski): 1
  • SMILES: CC(Cn1c(N)c(C(=O)CSc2nn3c(n2)nc(cc3C)C)c(=O)n(c1=O)C)C
  • InChi: 1S/C18H23N7O3S/c1-9(2)7-24-14(19)13(15(27)23(5)18(24)28)12(26)8-29-17-21-16-20-10(3)6-11(4)25(16)22-17/h6,9H,7-8,19H2,1-5H3
  • InChiKey: BIZKBCXZQKTQLG-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • MLS000772568
  • SMR000377275

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens survival of motor neuron 2, centromeric Starlite/ChEMBL No references
Homo sapiens ATPase family, AAA domain containing 5 Starlite/ChEMBL No references

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_132873 All targets in OG5_132873
Brugia malayi hypothetical protein Get druggable targets OG5_132873 All targets in OG5_132873
Echinococcus granulosus survival motor neuron protein 1 Get druggable targets OG5_132873 All targets in OG5_132873
Echinococcus multilocularis survival motor neuron protein 1 Get druggable targets OG5_132873 All targets in OG5_132873
Echinococcus multilocularis atpase aaa+ type core atpase aaa type core Get druggable targets OG5_139225 All targets in OG5_139225
By sequence similarity to non orthologous known druggable targets
No druggable targets predicted by sequence similarity
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Loa Loa (eye worm) hypothetical protein 0.0023 0.0103 0.0102
Echinococcus multilocularis nuclear receptor nhr 48 0.0036 0.0206 0.0205
Brugia malayi Doublecortin family protein 0.0023 0.0103 0.0103
Mycobacterium tuberculosis Probable aldehyde dehydrogenase 0.0071 0.049 0.2514
Brugia malayi Steroid receptor seven-up type 2 0.0076 0.053 0.053
Schistosoma mansoni hypothetical protein 0.0042 0.026 0.0299
Schistosoma mansoni hypothetical protein 0.0535 0.4242 0.6567
Echinococcus granulosus COUP TF:Svp nuclear hormone receptor 0.0076 0.053 0.0528
Entamoeba histolytica Activator 1 140 kDa subunit, putative 0.002 0.0078 0.0119
Echinococcus multilocularis sodium:myo inositol cotransporter 0.0038 0.0221 0.022
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0051 0.0333 0.0414
Schistosoma mansoni photoreceptor-specific nuclear receptor related 0.0076 0.053 0.0723
Echinococcus granulosus replication factor c subunit 1 0.002 0.0078 0.0077
Echinococcus granulosus dna polymerase kappa 0.0019 0.007 0.0069
Schistosoma mansoni zinc finger protein 0.0036 0.0206 0.0214
Brugia malayi MH2 domain containing protein 0.0139 0.1043 0.1043
Schistosoma mansoni hepatocyte nuclear factor 4-alpha (hnf-4-alpha) 0.0036 0.0206 0.0214
Trichomonas vaginalis RNA polymerase II ctd phosphatase, putative 0.002 0.0078 0.0037
Loa Loa (eye worm) hypothetical protein 0.0341 0.2671 0.267
Echinococcus granulosus neuropeptide s receptor 0.1012 0.8091 0.8091
Trypanosoma brucei DNA polymerase kappa, putative 0.0019 0.007 0.2639
Echinococcus granulosus sodium:glucose cotransporter 0.0038 0.0221 0.022
Loa Loa (eye worm) CXXC zinc finger family protein 0.0034 0.0188 0.0187
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0051 0.0333 0.0332
Echinococcus granulosus cpg binding protein 0.0035 0.0204 0.0202
Loa Loa (eye worm) hypothetical protein 0.0148 0.1114 0.1113
Mycobacterium ulcerans aldehyde dehydrogenase 0.0071 0.049 0.1955
Schistosoma mansoni cpg binding protein 0.0034 0.0188 0.0186
Echinococcus multilocularis Nuclear hormone receptor HR96 0.0036 0.0206 0.0205
Onchocerca volvulus Steroid hormone receptor family member cnr14 homolog 0.0076 0.053 0.2381
Echinococcus granulosus aldehyde dehydrogenase mitochondrial 0.0071 0.049 0.0489
Toxoplasma gondii ATPase, AAA family protein 0.002 0.0078 0.0000065904
Schistosoma mansoni hypothetical protein 0.0038 0.022 0.0236
Trypanosoma cruzi hypothetical protein, conserved 0.002 0.0078 0.0607
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0105 0.0767 0.0766
Schistosoma mansoni topbp1 0.002 0.0078 0.0013
Schistosoma mansoni steroid hormone receptor ad4bp 0.0076 0.053 0.0723
Echinococcus multilocularis microtubule associated protein 2 0.0805 0.6423 0.6423
Brugia malayi hypothetical protein 0.004 0.0241 0.0241
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0051 0.0333 0.0333
Echinococcus multilocularis cadherin EGF LAG seven pass G type receptor 0.0033 0.0186 0.0185
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0036 0.0206 0.0205
Schistosoma mansoni tar DNA-binding protein 0.0338 0.2648 0.4058
Schistosoma mansoni loxhd1 0.0023 0.0103 0.0052
Onchocerca volvulus 0.0023 0.0103 0.0132
Echinococcus multilocularis sodium coupled monocarboxylate transporter 1 0.0038 0.0221 0.022
Echinococcus multilocularis Niemann Pick C1 protein 0.0147 0.1102 0.1101
Echinococcus multilocularis solute carrier family 5 0.0038 0.0221 0.022
Echinococcus granulosus GPCR family 2 0.0033 0.0186 0.0185
Brugia malayi nuclear receptor NHR-67 0.0036 0.0206 0.0206
Brugia malayi Iron-sulfur cluster assembly accessory protein 0.0255 0.1974 0.1974
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0076 0.053 0.053
Trichomonas vaginalis RNA polymerase II ctd phosphatase, putative 0.002 0.0078 0.0037
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0076 0.053 0.053
Schistosoma mansoni tar DNA-binding protein 0.0338 0.2648 0.4058
Echinococcus multilocularis RUN 0.0023 0.0103 0.0102
Trichomonas vaginalis D-aminoacylase, putative 0.0035 0.0203 0.0617
Toxoplasma gondii ABC1 family protein 0.0035 0.0203 0.302
Brugia malayi hypothetical protein 0.0148 0.1114 0.1114
Mycobacterium ulcerans esterase/lipase LipP 0.0035 0.0203 0.0617
Loa Loa (eye worm) hypothetical protein 0.002 0.0078 0.0077
Loa Loa (eye worm) ImpB/MucB/SamB family protein 0.0019 0.007 0.0069
Brugia malayi ecdysone receptor 0.0036 0.0206 0.0206
Loa Loa (eye worm) hypothetical protein 0.0036 0.0206 0.0205
Brugia malayi Nuclear hormone receptor family member nhr-41 0.0076 0.053 0.053
Chlamydia trachomatis DNA ligase 0.002 0.0078 0.5
Onchocerca volvulus 0.0255 0.1974 1
Entamoeba histolytica Niemann-Pick C1 protein, putative 0.0103 0.0746 1
Schistosoma mansoni Tr4/Tr2 (homologue) 0.0076 0.053 0.0723
Brugia malayi nuclear receptor NHR-88 0.0036 0.0206 0.0206
Echinococcus multilocularis nibrin 0.002 0.0078 0.0077
Trypanosoma brucei DNA polymerase kappa, putative 0.0019 0.007 0.2639
Brugia malayi tailless protein 0.0036 0.0206 0.0206
Echinococcus multilocularis COUP TF:Svp nuclear hormone receptor 0.0076 0.053 0.0528
Trypanosoma cruzi hypothetical protein, conserved 0.0035 0.0203 1
Schistosoma mansoni chromosome transmission fidelity factor 0.002 0.0078 0.0013
Onchocerca volvulus 0.0038 0.0221 0.0753
Echinococcus granulosus neuropeptide receptor A26 0.1012 0.8091 0.8091
Echinococcus granulosus lipoxygenase domain containing protein 0.0023 0.0103 0.0102
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0076 0.053 0.053
Loa Loa (eye worm) glutaminase 2 0.0285 0.2217 0.2216
Echinococcus multilocularis retinoic acid receptor rxr beta a retinoic acid receptor rxr alpha a retinoic acid receptor rxr alpha 0.0036 0.0206 0.0205
Brugia malayi RNA binding protein 0.0338 0.2648 0.2648
Trichomonas vaginalis chromosome transmission fidelity factor, putative 0.002 0.0078 0.0037
Brugia malayi hypothetical protein 0.0038 0.022 0.022
Onchocerca volvulus 0.0035 0.0203 0.0656
Schistosoma mansoni nuclear receptor 2DBD-gamma 0.0076 0.053 0.0723
Loa Loa (eye worm) hypothetical protein 0.0035 0.0203 0.0201
Echinococcus granulosus retinoic acid receptor rxr beta a 0.0076 0.053 0.0528
Echinococcus granulosus ecdysone induced protein 78C 0.0076 0.053 0.0528
Loa Loa (eye worm) hypothetical protein 0.002 0.0078 0.0077
Leishmania major aldehyde dehydrogenase, mitochondrial precursor 0.0071 0.049 1
Entamoeba histolytica hypothetical protein 0.0038 0.022 0.222
Trypanosoma brucei DNA polymerase kappa, putative 0.0019 0.007 0.2639
Loa Loa (eye worm) DR-78 0.0036 0.0206 0.0205
Echinococcus granulosus sterol regulatory element binding protein 0.0044 0.0273 0.0272
Schistosoma mansoni retinoid-x-receptor (RXR) 0.0076 0.053 0.0723
Brugia malayi latrophilin 2 splice variant baaae 0.0072 0.0498 0.0498
Trichomonas vaginalis conserved hypothetical protein 0.002 0.0078 0.0037
Loa Loa (eye worm) hypothetical protein 0.0036 0.0206 0.0205
Giardia lamblia Replication factor C, subunit 1 0.002 0.0078 1
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0051 0.0333 0.0332
Mycobacterium ulcerans beta-lactamase 0.0035 0.0203 0.0617
Echinococcus multilocularis sterol regulatory element binding protein 0.0044 0.0273 0.0272
Brugia malayi Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative 0.0035 0.0203 0.0203
Schistosoma mansoni niemann-pick C1 (NPC1) 0.0104 0.0759 0.1085
Brugia malayi beta-lactamase family protein 0.0035 0.0203 0.0203
Schistosoma mansoni retinoic acid receptor RXR 0.0076 0.053 0.0723
Brugia malayi photoreceptor-specific nuclear receptor 0.0076 0.053 0.053
Loa Loa (eye worm) nuclear Hormone Receptor family member 0.0076 0.053 0.0528
Trypanosoma brucei DNA polymerase kappa, putative 0.0019 0.007 0.2639
Mycobacterium ulcerans fusion of enoyl-CoA hydratase, EchA21 and lipase, LipE 0.0035 0.0203 0.0617
Trypanosoma brucei DNA polymerase kappa, putative 0.0019 0.007 0.2639
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0051 0.0333 0.0414
Schistosoma mansoni aldehyde dehydrogenase 0.0071 0.049 0.066
Loa Loa (eye worm) nuclear receptor nhr-7B 0.0036 0.0206 0.0205
Entamoeba histolytica hypothetical protein 0.002 0.0078 0.0119
Schistosoma mansoni high-affinity choline transporter 0.0341 0.2671 0.4093
Loa Loa (eye worm) hypothetical protein 0.0036 0.0206 0.0205
Loa Loa (eye worm) hypothetical protein 0.0054 0.0353 0.0352
Brugia malayi ImpB/MucB/SamB family protein 0.0019 0.007 0.007
Loa Loa (eye worm) TAR-binding protein 0.0338 0.2648 0.2647
Schistosoma mansoni microtubule-associated protein tau 0.0805 0.6423 1
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0051 0.0333 0.0332
Schistosoma mansoni thyroid hormone receptor 0.0076 0.053 0.0723
Echinococcus multilocularis nuclear receptor subfamily 1 group D 0.004 0.0241 0.024
Loa Loa (eye worm) hypothetical protein 0.004 0.0241 0.024
Loa Loa (eye worm) hypothetical protein 0.002 0.0078 0.0077
Trypanosoma brucei hypothetical protein, conserved 0.0035 0.0203 1
Trichomonas vaginalis penicillin-binding protein, putative 0.0035 0.0203 0.0617
Echinococcus multilocularis geminin 0.0535 0.4242 0.4241
Echinococcus granulosus Niemann Pick C1 protein 0.0147 0.1102 0.1101
Echinococcus granulosus sodium:myo inositol cotransporter 0.0038 0.0221 0.022
Echinococcus multilocularis neuropeptide s receptor 0.1012 0.8091 0.8091
Loa Loa (eye worm) hypothetical protein 0.0036 0.0206 0.0205
Echinococcus granulosus Nuclear hormone receptor family member nhr 41 0.0076 0.053 0.0528
Loa Loa (eye worm) hypothetical protein 0.0076 0.053 0.0528
Schistosoma mansoni ecdysone-induced protein 78c (dr-78) 0.004 0.0241 0.0268
Loa Loa (eye worm) nuclear hormone receptor-like 1 0.004 0.0241 0.024
Brugia malayi CHE-14 protein 0.0044 0.0273 0.0273
Brugia malayi DKFZp564C0469 protein 0.002 0.0078 0.0078
Schistosoma mansoni hypothetical protein 0.0042 0.026 0.0299
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0051 0.0333 0.0332
Echinococcus granulosus beta LACTamase domain containing family member 0.0035 0.0203 0.0201
Onchocerca volvulus Bile acid receptor homolog 0.0076 0.053 0.2381
Echinococcus granulosus terminal deoxycytidyl transferase rev1 0.0019 0.007 0.0069
Schistosoma mansoni topbp1 0.002 0.0078 0.0013
Trichomonas vaginalis D-aminoacylase, putative 0.0035 0.0203 0.0617
Brugia malayi nuclear receptor NHR-88 0.0076 0.053 0.053
Loa Loa (eye worm) abnormal chemotaxis protein 14 0.0044 0.0273 0.0272
Echinococcus multilocularis survival motor neuron protein 1 0.1248 1 1
Brugia malayi Niemann-Pick C1 protein precursor 0.0103 0.0746 0.0746
Schistosoma mansoni patched 1 0.0044 0.0273 0.0319
Brugia malayi hypothetical protein 0.0023 0.0103 0.0103
Echinococcus multilocularis protein patched 0.0044 0.0273 0.0272
Schistosoma mansoni transcription factor LCR-F1 0.0038 0.022 0.0236
Echinococcus granulosus FTZ F1 alpha 0.0076 0.053 0.0528
Loa Loa (eye worm) hypothetical protein 0.0036 0.0206 0.0205
Trypanosoma cruzi hypothetical protein, conserved 0.002 0.0078 0.0607
Schistosoma mansoni tar DNA-binding protein 0.0338 0.2648 0.4058
Brugia malayi TAR-binding protein 0.0338 0.2648 0.2648
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0076 0.053 0.0528
Echinococcus granulosus nuclear receptor subfamily 4 group A 0.0036 0.0206 0.0205
Loa Loa (eye worm) latrophilin receptor protein 2 0.0033 0.0186 0.0185
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0076 0.053 0.0528
Onchocerca volvulus 0.0034 0.0188 0.058
Schistosoma mansoni nuclear hormone receptor 0.0036 0.0206 0.0214
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0105 0.0767 0.0767
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0076 0.053 0.053
Echinococcus multilocularis ecdysone induced protein 78C 0.0076 0.053 0.0528
Schistosoma mansoni nuclear hormone receptor 0.0036 0.0206 0.0214
Brugia malayi Nuclear hormone receptor family member nhr-31 0.0076 0.053 0.053
Loa Loa (eye worm) hypothetical protein 0.0076 0.053 0.0528
Brugia malayi Nuclear hormone receptor family member nhr-1 0.0076 0.053 0.053
Echinococcus multilocularis GPCR, family 2 0.0033 0.0186 0.0185
Onchocerca volvulus 0.0035 0.0203 0.0656
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.0338 0.2648 0.2647
Brugia malayi nuclear hormone receptor 0.0036 0.0206 0.0206
Loa Loa (eye worm) nuclear hormone receptor family member nhr-40 0.0076 0.053 0.0528
Echinococcus granulosus Protein patched homolog 1 0.0044 0.0273 0.0272
Mycobacterium tuberculosis Probable lipase LipE 0.0035 0.0203 0.0793
Loa Loa (eye worm) hypothetical protein 0.0019 0.007 0.0069
Loa Loa (eye worm) hypothetical protein 0.0076 0.053 0.0528
Trichomonas vaginalis conserved hypothetical protein 0.002 0.0078 0.0037
Schistosoma mansoni FTZ-F1 nuclear receptor-like protein 0.0076 0.053 0.0723
Brugia malayi beta-lactamase 0.0035 0.0203 0.0203
Loa Loa (eye worm) hypothetical protein 0.0103 0.0746 0.0745
Schistosoma mansoni rab6-interacting 0.0023 0.0103 0.0052
Loa Loa (eye worm) hypothetical protein 0.0036 0.0206 0.0205
Echinococcus granulosus Nuclear hormone receptor HR96 0.0036 0.0206 0.0205
Leishmania major hypothetical protein, conserved 0.0035 0.0203 0.3154
Brugia malayi Pax transcription activation domain interacting protein 0.002 0.0078 0.0078
Echinococcus granulosus nuclear receptor subfamily 1 group D 0.004 0.0241 0.024
Brugia malayi conserved hypotetical protein 0.0036 0.0206 0.0206
Loa Loa (eye worm) RNA binding protein 0.0338 0.2648 0.2647
Schistosoma mansoni hypothetical protein 0.0042 0.026 0.0299
Loa Loa (eye worm) nuclear hormone receptor family member nhr-14 0.0076 0.053 0.0528
Schistosoma mansoni tar DNA-binding protein 0.0338 0.2648 0.4058
Loa Loa (eye worm) hypothetical protein 0.0044 0.0273 0.0272
Schistosoma mansoni cpg binding protein 0.0035 0.0204 0.021
Loa Loa (eye worm) nuclear hormone receptor family member nhr-1 0.0076 0.053 0.0528
Onchocerca volvulus 0.0076 0.053 0.2381
Echinococcus multilocularis beta LACTamase domain containing family member 0.0035 0.0203 0.0201
Brugia malayi Nuclear hormone receptor-like 1 0.004 0.0241 0.0241
Mycobacterium ulcerans hypothetical protein 0.0035 0.0203 0.0617
Echinococcus multilocularis Nuclear hormone receptor HR96 0.0036 0.0206 0.0205
Loa Loa (eye worm) hypothetical protein 0.0076 0.053 0.0528
Plasmodium vivax multidomain scavenger receptor, putative 0.0023 0.0103 0.201
Brugia malayi topoisomerase 0.002 0.0078 0.0078
Loa Loa (eye worm) hypothetical protein 0.0035 0.0203 0.0201
Onchocerca volvulus 0.0036 0.0206 0.0675
Entamoeba histolytica hypothetical protein 0.0038 0.022 0.222
Brugia malayi Nuclear hormone receptor-like 1 0.0076 0.053 0.053
Echinococcus multilocularis nuclear receptor subfamily 4 group A 0.0036 0.0206 0.0205
Loa Loa (eye worm) hypothetical protein 0.1248 1 1
Mycobacterium leprae conserved hypothetical protein 0.0035 0.0203 1
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0036 0.0206 0.0205
Echinococcus granulosus high affinity choline transporter 1 0.0341 0.2671 0.267
Echinococcus multilocularis tar DNA binding protein 0.0338 0.2648 0.2647
Brugia malayi nuclear hormone receptor 0.0076 0.053 0.053
Echinococcus multilocularis dna polymerase eta 0.0019 0.007 0.0069
Brugia malayi Nuclear hormone receptor family member nhr-49 0.0076 0.053 0.053
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0076 0.053 0.0528
Brugia malayi GH02984p 0.0341 0.2671 0.2671
Brugia malayi nuclear receptor RXR 0.004 0.0241 0.0241
Trichomonas vaginalis chromosome transmission fidelity factor, putative 0.002 0.0078 0.0037
Loa Loa (eye worm) hypothetical protein 0.002 0.0078 0.0077
Mycobacterium tuberculosis Conserved protein 0.0035 0.0203 0.0793
Loa Loa (eye worm) hypothetical protein 0.0036 0.0206 0.0205
Schistosoma mansoni inositol transporter 0.0038 0.0221 0.0237
Mycobacterium ulcerans lipase LipD 0.0035 0.0203 0.0617
Loa Loa (eye worm) hypothetical protein 0.0033 0.0186 0.0185
Loa Loa (eye worm) hypothetical protein 0.004 0.0241 0.024
Echinococcus granulosus sodium:glucose cotransporter 2 0.0038 0.0221 0.022
Loa Loa (eye worm) hypothetical protein 0.0076 0.053 0.0528
Mycobacterium tuberculosis Possible penicillin-binding protein 0.0226 0.1739 1
Mycobacterium ulcerans NAD-dependent DNA ligase LigA 0.002 0.0078 0.0037
Trypanosoma brucei BRCA1 C Terminus (BRCT) domain containing protein, putative 0.002 0.0078 0.3086
Echinococcus multilocularis Niemann Pick C1 protein 0.0103 0.0746 0.0745
Echinococcus granulosus dnaJ subfamily B 0.0477 0.3774 0.3773
Loa Loa (eye worm) doublecortin family protein 0.0023 0.0103 0.0102
Brugia malayi Nuclear hormone receptor E75 0.0036 0.0206 0.0206
Echinococcus granulosus cadherin EGF LAG seven pass G type receptor 0.0033 0.0186 0.0185
Brugia malayi ecdysteroid receptor 0.0076 0.053 0.053
Mycobacterium tuberculosis Conserved protein 0.0035 0.0203 0.0793
Wolbachia endosymbiont of Brugia malayi NAD-dependent DNA ligase, Lig 0.002 0.0078 0.5
Brugia malayi hypothetical protein 0.0023 0.0103 0.0103
Loa Loa (eye worm) hypothetical protein 0.0023 0.0103 0.0102
Trypanosoma brucei DNA polymerase eta, putative 0.0019 0.007 0.2639
Trypanosoma brucei DNA polymerase kappa, putative 0.0019 0.007 0.2639
Echinococcus granulosus survival motor neuron protein 1 0.1248 1 1
Schistosoma mansoni lipoxygenase 0.0138 0.1029 0.151
Toxoplasma gondii transporter, solute:sodium symporter (SSS) family protein 0.0038 0.0221 0.3469
Entamoeba histolytica hypothetical protein 0.0038 0.022 0.222
Schistosoma mansoni coup transcription factor 0.0076 0.053 0.0723
Schistosoma mansoni nuclear hormone receptor nor-1/nor-2 0.0076 0.053 0.0723
Echinococcus multilocularis high affinity choline transporter 1 0.0341 0.2671 0.267
Brugia malayi steroid hormone receptor 0.0076 0.053 0.053
Plasmodium vivax hypothetical protein, conserved 0.0035 0.0203 1
Echinococcus granulosus geminin 0.0535 0.4242 0.4241
Loa Loa (eye worm) hypothetical protein 0.0038 0.0221 0.022
Trypanosoma brucei unspecified product 0.0019 0.007 0.2639
Loa Loa (eye worm) hypothetical protein 0.0076 0.053 0.0528
Echinococcus multilocularis expressed conserved protein 0.0096 0.0696 0.0695
Mycobacterium tuberculosis Probable lipase LipD 0.0035 0.0203 0.0793
Brugia malayi glutaminase DH11.1 0.0285 0.2217 0.2217
Mycobacterium tuberculosis Probable esterase/lipase LipP 0.0035 0.0203 0.0793
Mycobacterium tuberculosis Conserved protein 0.0035 0.0203 0.0793
Trypanosoma cruzi BRCA1 C Terminus (BRCT) domain containing protein, putative 0.002 0.0078 0.0607
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.0033 0.0186 0.0185
Brugia malayi ATP dependent DNA ligase C terminal region family protein 0.002 0.0078 0.0078
Trypanosoma cruzi FHA domain containing protein, putative 0.002 0.0078 0.0607
Brugia malayi RNA recognition motif domain containing protein 0.0338 0.2648 0.2648
Onchocerca volvulus 0.0023 0.0103 0.0132
Brugia malayi hypothetical protein 0.0036 0.0206 0.0206
Trichomonas vaginalis conserved hypothetical protein 0.002 0.0078 0.0037
Brugia malayi nuclear receptor RXR 0.0036 0.0206 0.0206
Trichomonas vaginalis conserved hypothetical protein 0.002 0.0078 0.0037
Echinococcus granulosus Nuclear hormone receptor HR96 0.0036 0.0206 0.0205
Schistosoma mansoni aldehyde dehydrogenase 0.0071 0.049 0.066
Loa Loa (eye worm) hypothetical protein 0.0036 0.0206 0.0205
Trichomonas vaginalis esterase, putative 0.0035 0.0203 0.0617
Schistosoma mansoni cpg binding protein 0.0035 0.0204 0.021
Schistosoma mansoni sodium/solute symporter 0.0038 0.0221 0.0237
Echinococcus multilocularis aldehyde dehydrogenase, mitochondrial 0.0071 0.049 0.0489
Mycobacterium ulcerans aldehyde dehydrogenase 0.0071 0.049 0.1955
Trichomonas vaginalis penicillin-binding protein, putative 0.0035 0.0203 0.0617
Schistosoma mansoni thyroid hormone receptor 0.0076 0.053 0.0723
Echinococcus multilocularis atpase aaa+ type core atpase aaa type core 0.0979 0.7829 0.7829
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.0033 0.0186 0.0186
Onchocerca volvulus 0.0035 0.0203 0.0656
Echinococcus granulosus solute carrier family 5 0.0038 0.0221 0.022
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0035 0.0203 0.0208
Brugia malayi Nuclear hormone receptor-like 1 0.004 0.0241 0.0241
Trypanosoma cruzi hypothetical protein, conserved 0.0035 0.0203 1
Trypanosoma brucei DNA polymerase IV, putative 0.0019 0.007 0.2639
Trypanosoma brucei DNA polymerase kappa, putative 0.0019 0.007 0.2639
Loa Loa (eye worm) hypothetical protein 0.0072 0.0498 0.0497
Brugia malayi beta-lactamase family protein 0.0035 0.0203 0.0203
Loa Loa (eye worm) hypothetical protein 0.004 0.0241 0.024
Echinococcus granulosus Niemann Pick C1 protein 0.0103 0.0746 0.0745
Loa Loa (eye worm) hypothetical protein 0.0036 0.0206 0.0205
Schistosoma mansoni hypothetical protein 0.0255 0.1974 0.2996
Schistosoma mansoni hypothetical protein 0.0023 0.0103 0.0052
Echinococcus granulosus lipoxygenase domain containing protein 0.0023 0.0103 0.0102
Onchocerca volvulus Protein ultraspiracle homolog 0.0076 0.053 0.2381
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0076 0.053 0.0528
Loa Loa (eye worm) nuclear hormone receptor 0.0036 0.0206 0.0205
Echinococcus granulosus nibrin 0.002 0.0078 0.0077
Loa Loa (eye worm) hypothetical protein 0.0036 0.0206 0.0205
Schistosoma mansoni nuclear receptor nhr-48 0.0036 0.0206 0.0214
Loa Loa (eye worm) hypothetical protein 0.002 0.0078 0.0077
Schistosoma mansoni nuclear hormone receptor superfamily protein-related 0.0036 0.0206 0.0214
Echinococcus granulosus microtubule associated protein 2 0.0805 0.6423 0.6423
Schistosoma mansoni survival motor neuron protein 0.0255 0.1974 0.2996
Loa Loa (eye worm) hypothetical protein 0.0035 0.0203 0.0201
Echinococcus multilocularis FTZ F1 nuclear receptor protein 0.0076 0.053 0.0528
Echinococcus multilocularis dna polymerase kappa 0.0019 0.007 0.0069
Echinococcus granulosus dna polymerase eta 0.0019 0.007 0.0069
Loa Loa (eye worm) hypothetical protein 0.0076 0.053 0.0528
Echinococcus multilocularis arachidonate 5 lipoxygenase 0.0138 0.1029 0.1028
Trichomonas vaginalis conserved hypothetical protein 0.0044 0.0273 0.0946
Echinococcus multilocularis terminal deoxycytidyl transferase rev1 0.0019 0.007 0.0069
Loa Loa (eye worm) MH2 domain-containing protein 0.0139 0.1043 0.1042
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0038 0.022 0.0219
Trichomonas vaginalis replication factor C large subunit, putative 0.002 0.0078 0.0037
Echinococcus multilocularis Nuclear hormone receptor family member nhr 41 0.0076 0.053 0.0528
Loa Loa (eye worm) hypothetical protein 0.0076 0.053 0.0528
Trichomonas vaginalis D-aminoacylase, putative 0.0035 0.0203 0.0617
Schistosoma mansoni inositol transporter 0.0038 0.0221 0.0237
Echinococcus multilocularis FTZ F1 alpha 0.0076 0.053 0.0528
Loa Loa (eye worm) steroid hormone receptor 0.0076 0.053 0.0528
Onchocerca volvulus Nuclear receptor subfamily 6 group A member 1 homolog 0.0036 0.0206 0.0675
Trypanosoma brucei DNA polymerase kappa, putative 0.0019 0.007 0.2639
Loa Loa (eye worm) nuclear hormone receptor family member nhr-49 0.0076 0.053 0.0528
Echinococcus multilocularis hepatocyte nuclear factor 4 alpha 0.0076 0.053 0.0528
Echinococcus multilocularis Polycystic kidney disease protein 0.0023 0.0103 0.0102
Brugia malayi ImpB/MucB/SamB family protein 0.0019 0.007 0.007
Echinococcus granulosus nuclear receptor nhr 48 0.0036 0.0206 0.0205
Schistosoma mansoni hypothetical protein 0.0033 0.0186 0.0182
Brugia malayi nuclear hormone receptor family member nhr-6 0.0036 0.0206 0.0206
Schistosoma mansoni nuclear receptor 0.0036 0.0206 0.0214
Loa Loa (eye worm) hypothetical protein 0.0036 0.0206 0.0205
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0051 0.0333 0.0414
Loa Loa (eye worm) hypothetical protein 0.004 0.0241 0.024
Echinococcus granulosus RUN 0.0023 0.0103 0.0102
Brugia malayi hypothetical protein 0.004 0.0241 0.0241
Echinococcus granulosus tar DNA binding protein 0.0338 0.2648 0.2647
Schistosoma mansoni retinoid-x-receptor (RXR) 0.004 0.0241 0.0268
Schistosoma mansoni tar DNA-binding protein 0.0338 0.2648 0.4058
Trypanosoma brucei DNA polymerase kappa, putative 0.0019 0.007 0.2639
Echinococcus granulosus Polycystic kidney disease protein 0.0023 0.0103 0.0102
Echinococcus granulosus FTZ F1 nuclear receptor protein 0.0076 0.053 0.0528
Loa Loa (eye worm) hypothetical protein 0.0036 0.0206 0.0205
Loa Loa (eye worm) hypothetical protein 0.0035 0.0203 0.0201
Mycobacterium tuberculosis Probable hydrolase 0.0035 0.0203 0.0793
Schistosoma mansoni hypothetical protein 0.0033 0.0186 0.0182
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0071 0.0492 0.0663
Echinococcus multilocularis sodium:glucose cotransporter 2 0.0038 0.0221 0.022
Loa Loa (eye worm) transcription factor SMAD2 0.0139 0.1043 0.1042
Onchocerca volvulus Nuclear receptor subfamily 6 group A member 1 homolog 0.0036 0.0206 0.0675
Schistosoma mansoni nuclear hormone receptor 0.0076 0.053 0.0723
Brugia malayi hypothetical protein 0.002 0.0078 0.0078
Echinococcus multilocularis lipoxygenase domain containing protein 0.0023 0.0103 0.0102
Mycobacterium ulcerans glutaminase 0.0285 0.2217 1
Echinococcus multilocularis replication factor c subunit 1 0.002 0.0078 0.0077
Schistosoma mansoni hypothetical protein 0.0477 0.3774 0.5829
Echinococcus multilocularis protein dispatched 1 0.005 0.0323 0.0322
Echinococcus granulosus thyroid hormone receptor alpha 0.0036 0.0206 0.0205
Loa Loa (eye worm) hypothetical protein 0.0035 0.0203 0.0201
Schistosoma mansoni RAR-like nuclear receptor 0.0076 0.053 0.0723
Trypanosoma brucei DNA polymerase kappa, putative 0.0019 0.007 0.2639
Echinococcus granulosus arachidonate 5 lipoxygenase 0.0138 0.1029 0.1028
Plasmodium falciparum LCCL domain-containing protein 0.0023 0.0103 1
Echinococcus granulosus expressed conserved protein 0.0096 0.0696 0.0695
Toxoplasma gondii aldehyde dehydrogenase 0.0071 0.049 1
Brugia malayi Nuclear hormone receptor E75 0.0036 0.0206 0.0206
Mycobacterium tuberculosis Probable conserved lipoprotein 0.0035 0.0203 0.0793
Entamoeba histolytica hypothetical protein 0.0038 0.022 0.222
Echinococcus multilocularis dnaJ subfamily B 0.0477 0.3774 0.3773
Echinococcus multilocularis neuropeptide receptor A26 0.1012 0.8091 0.8091
Schistosoma mansoni hypothetical protein 0.0535 0.4242 0.6567
Brugia malayi Sodium:solute symporter family protein 0.0038 0.0221 0.0221
Schistosoma mansoni glutaminase 0.0285 0.2217 0.3378
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0051 0.0333 0.0332
Schistosoma mansoni DNA ligase IV 0.002 0.0078 0.0013
Trypanosoma brucei DNA polymerase IV, putative 0.0019 0.007 0.2639
Echinococcus granulosus sodium coupled monocarboxylate transporter 1 0.0038 0.0221 0.022
Mycobacterium tuberculosis Probable esterase LipL 0.0035 0.0203 0.0793
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.0033 0.0186 0.0185
Brugia malayi Calcitonin receptor-like protein seb-1 0.0105 0.0767 0.0767
Onchocerca volvulus 0.0036 0.0206 0.0675
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0076 0.053 0.053
Schistosoma mansoni hypothetical protein 0.0072 0.0498 0.0673
Echinococcus multilocularis lipoxygenase domain containing protein 0.0023 0.0103 0.0102
Treponema pallidum DNA ligase (lig) 0.002 0.0078 0.5
Loa Loa (eye worm) nuclear receptor NHR-67 0.0036 0.0206 0.0205
Loa Loa (eye worm) beta-lactamase 0.0035 0.0203 0.0201
Brugia malayi Nuclear hormone receptor family member nhr-3 0.0076 0.053 0.053
Mycobacterium ulcerans aldehyde dehydrogenase 0.0071 0.049 0.1955
Loa Loa (eye worm) hypothetical protein 0.004 0.0241 0.024
Loa Loa (eye worm) nuclear hormone receptor family member nhr-41 0.0076 0.053 0.0528
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0076 0.053 0.053
Trypanosoma brucei DNA polymerase IV, putative 0.0019 0.007 0.2639
Trichomonas vaginalis conserved hypothetical protein 0.002 0.0078 0.0037
Brugia malayi nuclear hormone receptor family member odr-7 0.0036 0.0206 0.0206
Loa Loa (eye worm) hypothetical protein 0.0105 0.0767 0.0766
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0038 0.022 0.0219
Schistosoma mansoni lipoxygenase 0.0096 0.0695 0.0983
Echinococcus multilocularis cpg binding protein 0.0035 0.0204 0.0202
Echinococcus multilocularis thyroid hormone receptor alpha 0.0076 0.053 0.0528
Schistosoma mansoni hypothetical protein 0.0033 0.0186 0.0182
Loa Loa (eye worm) beta-LACTamase domain containing family member 0.0035 0.0203 0.0201
Echinococcus granulosus hepatocyte nuclear factor 4 alpha 0.0076 0.053 0.0528
Brugia malayi hypothetical protein 0.0036 0.0206 0.0206
Brugia malayi Latrophilin receptor protein 2 0.0033 0.0186 0.0186
Schistosoma mansoni rab6-interacting 0.0023 0.0103 0.0052
Mycobacterium tuberculosis Possible conserved lipoprotein LpqK 0.0035 0.0203 0.0793
Brugia malayi Nuclear hormone receptor family member nhr-40 0.0076 0.053 0.053
Onchocerca volvulus 0.0148 0.1114 0.5466
Loa Loa (eye worm) hypothetical protein 0.0036 0.0206 0.0205
Loa Loa (eye worm) hypothetical protein 0.002 0.0078 0.0077
Loa Loa (eye worm) nuclear hormone receptor family member nhr-31 0.0076 0.053 0.0528
Brugia malayi hypothetical protein 0.002 0.0078 0.0078
Brugia malayi CXXC zinc finger family protein 0.0034 0.0188 0.0188
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0035 0.0203 0.0208
Brugia malayi Nuclear hormone receptor family member nhr-14 0.0076 0.053 0.053
Loa Loa (eye worm) glutaminase 0.0285 0.2217 0.2216
Brugia malayi orphan nuclear receptor NR2E1 0.0036 0.0206 0.0206
Schistosoma mansoni hypothetical protein 0.0033 0.0186 0.0182
Schistosoma mansoni polycystin 1-related 0.0023 0.0103 0.0052
Toxoplasma gondii histone lysine methyltransferase SET1 0.0063 0.043 0.8554
Schistosoma mansoni hypothetical protein 0.0042 0.026 0.0299
Trichomonas vaginalis glutaminase, putative 0.0285 0.2217 1
Brugia malayi nuclear receptor subfamily 1, group D, member 1, putative 0.0036 0.0206 0.0206
Mycobacterium leprae Probable lipase LipE 0.0035 0.0203 1
Schistosoma mansoni nuclear receptor 0.0036 0.0206 0.0214
Loa Loa (eye worm) hypothetical protein 0.0035 0.0203 0.0201

Activities

Activity type Activity value Assay description Source Reference
Potency (functional) 0.3696 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) 4.6535 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) = 11.2202 um PUBCHEM_BIOASSAY: qHTS Assay for Enhancers of SMN2 Splice Variant Expression. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 12.99 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) 20.5962 uM PUBCHEM_BIOASSAY: Nrf2 qHTS screen for inhibitors. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID493153, AID493163, AID504648] ChEMBL. No reference
Potency (functional) 89.1251 uM PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Mammalian Selenoprotein Thioredoxin Reductase 1 (TrxR1): qHTS. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488771] 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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