Detailed information for compound 561388

Basic information

Technical information
  • TDR Targets ID: 561388
  • Name: 5-aminopentane-1-sulfonic acid
  • MW: 167.227 | Formula: C5H13NO3S
  • H donors: 2 H acceptors: 3 LogP: -3.04 Rotable bonds: 5
    Rule of 5 violations (Lipinski): 1
  • SMILES: NCCCCCS(=O)(=O)O
  • InChi: 1S/C5H13NO3S/c6-4-2-1-3-5-10(7,8)9/h1-6H2,(H,7,8,9)
  • InChiKey: NJVWBSNUDITJDJ-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • 5-amino-1-pentanesulfonic acid
  • 5-azanylpentane-1-sulfonic acid
  • 5-aminopentanesulfonic acid
  • 37043-68-8
  • NCI60_012592
  • 1-Pentanesulfonic acid, 5-amino-
  • AIDS-136418
  • AIDS136418
  • NSC637821

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
Schistosoma mansoni Smad4 0.0024 0.0171 0.016
Loa Loa (eye worm) hypothetical protein 0.0072 0.0709 0.0709
Echinococcus multilocularis lamin 0.0028 0.0208 0.0208
Loa Loa (eye worm) MH2 domain-containing protein 0.0356 0.3903 0.3903
Trichomonas vaginalis conserved hypothetical protein 0.001 0.0011 0.0111
Brugia malayi Patched family protein 0.0012 0.0032 0.0022
Schistosoma mansoni niemann-pick C1 (NPC1) 0.0201 0.2154 0.2145
Trichomonas vaginalis PIKK family atypical protein kinase 0.0024 0.0164 0.1907
Trichomonas vaginalis PIKK family atypical protein kinase 0.0035 0.0289 0.3387
Trichomonas vaginalis PIKK family atypical protein kinase 0.0044 0.039 0.4573
Echinococcus multilocularis Smad4 0.0024 0.0171 0.0171
Plasmodium falciparum isocitrate dehydrogenase [NADP], mitochondrial 0.0016 0.0078 0.0912
Treponema pallidum DNA ligase (lig) 0.001 0.0011 0.5
Schistosoma mansoni hypothetical protein 0.0706 0.7829 0.7827
Loa Loa (eye worm) hypothetical protein 0.0017 0.0094 0.0094
Loa Loa (eye worm) hypothetical protein 0.0012 0.0032 0.0032
Trichomonas vaginalis replication factor C large subunit, putative 0.001 0.0011 0.0111
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.0062 0.0592 0.0592
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0143 0.1511 0.1502
Onchocerca volvulus 0.0023 0.016 0.0174
Loa Loa (eye worm) patched family protein 0.0012 0.0032 0.0032
Echinococcus granulosus replication factor c subunit 1 0.001 0.0011 0.0011
Brugia malayi Patched family protein 0.0012 0.0032 0.0022
Trichomonas vaginalis PIKK family atypical protein kinase 0.0015 0.0063 0.0722
Entamoeba histolytica Activator 1 140 kDa subunit, putative 0.001 0.0011 0.0000015157
Loa Loa (eye worm) hypothetical protein 0.0017 0.0094 0.0094
Trypanosoma cruzi Phosphatidylinositol 3-kinase tor2 0.0044 0.039 0.5119
Trypanosoma cruzi Phosphatidylinositol 3-kinase tor1 0.0044 0.039 0.5119
Trichomonas vaginalis PIKK family atypical protein kinase 0.0035 0.0289 0.3387
Plasmodium vivax patched family protein, putative 0.0012 0.0032 0.0291
Mycobacterium ulcerans hypothetical protein 0.0072 0.0709 1
Trichomonas vaginalis PIKK family atypical protein kinase 0.0024 0.0163 0.1903
Echinococcus multilocularis tar DNA binding protein 0.0062 0.0592 0.0592
Mycobacterium leprae conserved hypothetical protein 0.0072 0.0709 1
Leishmania major isocitrate dehydrogenase [NADP], mitochondrial precursor, putative 0.0016 0.0078 0.0227
Trichomonas vaginalis PIKK family atypical protein kinase 0.0015 0.0063 0.0722
Loa Loa (eye worm) hypothetical protein 0.0012 0.0032 0.0032
Onchocerca volvulus 0.0072 0.0709 0.0816
Loa Loa (eye worm) hypothetical protein 0.001 0.0011 0.0011
Brugia malayi Intermediate filament tail domain containing protein 0.0028 0.0208 0.0197
Brugia malayi MH2 domain containing protein 0.0011 0.002 0.0009
Brugia malayi Patched family protein 0.0012 0.0032 0.0022
Loa Loa (eye worm) hypothetical protein 0.0012 0.0032 0.0032
Toxoplasma gondii isocitrate dehydrogenase 0.0016 0.0078 0.1026
Trichomonas vaginalis PIKK family atypical protein kinase 0.0044 0.039 0.4573
Brugia malayi MH1 domain containing protein 0.0024 0.0171 0.016
Brugia malayi mothers against decapentaplegic homolog 3 0.0011 0.002 0.0009
Schistosoma mansoni smad1 5 8 and 0.0024 0.0171 0.016
Loa Loa (eye worm) hypothetical protein 0.0023 0.016 0.016
Schistosoma mansoni lamin 0.0028 0.0208 0.0197
Trypanosoma brucei phosphatidylinositol 3-kinase, putative 0.0015 0.0063 0.0701
Loa Loa (eye worm) hypothetical protein 0.0012 0.0032 0.0032
Leishmania major aldehyde dehydrogenase, mitochondrial precursor 0.0062 0.0596 0.7739
Onchocerca volvulus 0.0012 0.0032 0.0025
Schistosoma mansoni survival motor neuron protein 0.0047 0.0426 0.0416
Trypanosoma brucei phosphatidylinositol 3-related kinase, putative 0.0015 0.0063 0.0701
Plasmodium falciparum acyl-CoA synthetase 0.0017 0.0094 0.112
Schistosoma mansoni hypothetical protein 0.0419 0.4604 0.4598
Trichomonas vaginalis PIKK family atypical protein kinase 0.0037 0.0318 0.3726
Onchocerca volvulus 0.0028 0.0208 0.023
Schistosoma mansoni hypothetical protein 0.0065 0.0624 0.0613
Schistosoma mansoni smad 0.0024 0.0171 0.016
Loa Loa (eye worm) hypothetical protein 0.0023 0.016 0.016
Loa Loa (eye worm) hypothetical protein 0.0012 0.0032 0.0032
Loa Loa (eye worm) Smad1 0.0024 0.0171 0.0171
Trichomonas vaginalis conserved hypothetical protein 0.0085 0.0851 1
Mycobacterium ulcerans long-chain-fatty-acid--CoA ligase 0.0023 0.016 0.2139
Loa Loa (eye worm) RNA binding protein 0.0062 0.0592 0.0592
Trypanosoma cruzi isocitrate dehydrogenase, putative 0.0016 0.0078 0.0912
Mycobacterium tuberculosis Probable lipase LipD 0.0072 0.0709 0.126
Echinococcus granulosus cpg binding protein 0.0031 0.0247 0.0247
Entamoeba histolytica acyl-CoA synthetase, putative 0.0023 0.016 0.0708
Loa Loa (eye worm) hypothetical protein 0.0012 0.0032 0.0032
Trichomonas vaginalis conserved hypothetical protein 0.001 0.0011 0.0111
Brugia malayi beta-lactamase 0.0072 0.0709 0.0699
Echinococcus multilocularis GPCR, family 2 0.0065 0.0624 0.0624
Brugia malayi Latrophilin receptor protein 2 0.0065 0.0624 0.0613
Echinococcus granulosus aldehyde dehydrogenase mitochondrial 0.0062 0.0596 0.0596
Loa Loa (eye worm) transcription factor SMAD2 0.0356 0.3903 0.3903
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0072 0.0709 0.0699
Brugia malayi RNA recognition motif domain containing protein 0.0062 0.0592 0.0581
Brugia malayi hypothetical protein 0.0012 0.0032 0.0022
Schistosoma mansoni smad 0.0011 0.002 0.0009
Mycobacterium ulcerans long-chain fatty-acid CoA ligase 0.0023 0.016 0.2139
Echinococcus granulosus GPCR family 2 0.0065 0.0624 0.0624
Schistosoma mansoni aminopeptidase P homologue (M24 family) 0.0899 1 1
Onchocerca volvulus 0.0099 0.1011 0.1169
Trichomonas vaginalis PIKK family atypical protein kinase 0.0033 0.0264 0.3088
Echinococcus multilocularis TGF beta signal transducer SmadC 0.0024 0.0171 0.0171
Brugia malayi protein C24B5.3 0.0012 0.0032 0.0022
Loa Loa (eye worm) hyaluronidase 0.0899 1 1
Leishmania major hypothetical protein, conserved 0.0072 0.0709 0.938
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0143 0.1511 0.1511
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0143 0.1511 0.1511
Entamoeba histolytica hypothetical protein 0.0037 0.0309 0.1415
Onchocerca volvulus Mothers against decapentaplegic homolog 0.0011 0.002 0.001
Leishmania major target of rapamycin (TOR) kinase 2, putative 0.0044 0.039 0.4751
Mycobacterium ulcerans hypothetical protein 0.0023 0.016 0.2139
Schistosoma mansoni cellular tumor antigen P53 0.0099 0.1011 0.1002
Schistosoma mansoni hypothetical protein 0.0034 0.0281 0.027
Loa Loa (eye worm) phosphatidylinositol 3 0.0015 0.0063 0.0063
Schistosoma mansoni cpg binding protein 0.0031 0.0247 0.0236
Trypanosoma cruzi target of rapamycin kinase 3 0.0035 0.029 0.3765
Plasmodium vivax isocitrate dehydrogenase [NADP], mitochondrial, putative 0.0016 0.0078 0.0912
Brugia malayi MH1 domain containing protein 0.0013 0.0049 0.0038
Entamoeba histolytica FKBP-rapamycin associated protein (FRAP), putative 0.0044 0.039 0.1798
Loa Loa (eye worm) hypothetical protein 0.0198 0.212 0.212
Echinococcus multilocularis smad 0.0024 0.0171 0.0171
Loa Loa (eye worm) hypothetical protein 0.0012 0.0032 0.0032
Onchocerca volvulus 0.0012 0.0032 0.0025
Loa Loa (eye worm) CXXC zinc finger family protein 0.0029 0.0228 0.0228
Loa Loa (eye worm) hypothetical protein 0.0012 0.0032 0.0032
Plasmodium falciparum ataxin-2 like protein, putative 0.0076 0.0752 1
Trichomonas vaginalis PIKK family atypical protein kinase 0.0024 0.0164 0.1907
Echinococcus multilocularis cytoplasmic intermediate filament protein 0.0013 0.0047 0.0047
Trichomonas vaginalis penicillin-binding protein, putative 0.0072 0.0709 0.8324
Trypanosoma cruzi isocitrate dehydrogenase [NADP], mitochondrial precursor, putative 0.0016 0.0078 0.0912
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0143 0.1511 0.1502
Mycobacterium ulcerans fatty-acid-CoA ligase 0.0017 0.0094 0.1188
Echinococcus multilocularis mothers against decapentaplegic 2 0.0011 0.002 0.002
Echinococcus granulosus TGF beta signal transducer SmadC 0.0024 0.0171 0.0171
Loa Loa (eye worm) hypothetical protein 0.001 0.0011 0.0011
Mycobacterium tuberculosis Conserved protein 0.0072 0.0709 0.126
Trichomonas vaginalis PIKK family atypical protein kinase 0.0026 0.0189 0.2207
Loa Loa (eye worm) hypothetical protein 0.0104 0.1066 0.1066
Schistosoma mansoni hypothetical protein 0.0065 0.0624 0.0613
Echinococcus multilocularis beta LACTamase domain containing family member 0.0072 0.0709 0.0709
Loa Loa (eye worm) hypothetical protein 0.0099 0.1011 0.1011
Loa Loa (eye worm) patched family protein 0.0012 0.0032 0.0032
Schistosoma mansoni cpg binding protein 0.0029 0.0228 0.0218
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0037 0.0309 0.0309
Echinococcus granulosus cytoplasmic intermediate filament protein 0.0013 0.0047 0.0047
Brugia malayi Patched related family protein 4 0.0012 0.0032 0.0022
Brugia malayi MH1 domain containing protein 0.0013 0.0049 0.0038
Loa Loa (eye worm) hypothetical protein 0.0012 0.0032 0.0032
Loa Loa (eye worm) hypothetical protein 0.0009 0.0002 0.0002
Onchocerca volvulus 0.0012 0.0032 0.0025
Trichomonas vaginalis PIKK family atypical protein kinase 0.0033 0.0264 0.3088
Toxoplasma gondii patched family protein 0.0012 0.0032 0.0413
Brugia malayi Niemann-Pick C1 protein precursor 0.0198 0.212 0.2111
Echinococcus granulosus phosphatidylinositol 3 and 4 kinase 0.0015 0.0063 0.0063
Schistosoma mansoni tar DNA-binding protein 0.0062 0.0592 0.0581
Loa Loa (eye worm) MH1 domain-containing protein 0.0011 0.002 0.002
Schistosoma mansoni chromosome transmission fidelity factor 0.001 0.0011 0.00000031998
Entamoeba histolytica Niemann-Pick C1 protein, putative 0.0198 0.212 1
Schistosoma mansoni Hyaluronidase 0.0899 1 1
Giardia lamblia GTOR 0.0044 0.039 1
Mycobacterium ulcerans aldehyde dehydrogenase 0.0062 0.0596 0.8381
Trichomonas vaginalis conserved hypothetical protein 0.001 0.0011 0.0111
Loa Loa (eye worm) hypothetical protein 0.001 0.0011 0.0011
Toxoplasma gondii target of rapamycin (TOR), putative 0.0033 0.0264 0.3499
Brugia malayi MH2 domain containing protein 0.0024 0.0171 0.016
Toxoplasma gondii isocitrate dehydrogenase 0.0016 0.0078 0.1026
Echinococcus granulosus mothers against decapentaplegic 6 0.0011 0.002 0.002
Brugia malayi Patched family protein 0.0012 0.0032 0.0022
Brugia malayi Patched family protein 0.0012 0.0032 0.0022
Loa Loa (eye worm) hypothetical protein 0.0012 0.0032 0.0032
Brugia malayi MH2 domain containing protein 0.0024 0.0171 0.016
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.0065 0.0624 0.0624
Echinococcus multilocularis geminin 0.0706 0.7829 0.7829
Brugia malayi hypothetical protein 0.0049 0.0449 0.0438
Echinococcus multilocularis bifunctional protein NCOAT 0.0899 1 1
Schistosoma mansoni tar DNA-binding protein 0.0062 0.0592 0.0581
Brugia malayi latrophilin 2 splice variant baaae 0.014 0.1466 0.1457
Loa Loa (eye worm) isocitrate dehydrogenase 0.0016 0.0078 0.0078
Echinococcus multilocularis isocitrate dehydrogenase 2 (NADP+) 0.0016 0.0078 0.0078
Mycobacterium tuberculosis Probable lipase LipE 0.0072 0.0709 0.126
Toxoplasma gondii aldehyde dehydrogenase 0.0062 0.0596 0.7924
Trichomonas vaginalis PIKK family atypical protein kinase 0.0028 0.0217 0.254
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0143 0.1511 0.1502
Schistosoma mansoni patched 1 0.0085 0.0851 0.0841
Brugia malayi cytoplasmic intermediate filament protein 0.0015 0.0064 0.0053
Brugia malayi hypothetical protein 0.023 0.2488 0.248
Schistosoma mansoni transcription factor LCR-F1 0.0037 0.0309 0.0299
Echinococcus granulosus dnaJ subfamily B 0.0419 0.4604 0.4604
Loa Loa (eye worm) beta-lactamase 0.0072 0.0709 0.0709
Brugia malayi hypothetical protein 0.0012 0.0032 0.0022
Loa Loa (eye worm) hypothetical protein 0.0085 0.0851 0.0851
Trypanosoma cruzi PAB1-binding protein , putative 0.0076 0.0752 1
Schistosoma mansoni tar DNA-binding protein 0.0062 0.0592 0.0581
Mycobacterium ulcerans lipase LipD 0.0072 0.0709 1
Onchocerca volvulus 0.0072 0.0709 0.0816
Loa Loa (eye worm) hypothetical protein 0.0012 0.0032 0.0032
Brugia malayi Patched family protein 0.0012 0.0032 0.0022
Onchocerca volvulus 0.0012 0.0032 0.0025
Brugia malayi Patched related family protein 12 0.0012 0.0032 0.0022
Echinococcus granulosus Ataxin 2 N terminaldomain containing protein 0.0034 0.0281 0.0281
Brugia malayi Calcitonin receptor-like protein seb-1 0.0204 0.2192 0.2184
Trichomonas vaginalis PIKK family atypical protein kinase 0.0015 0.0063 0.0722
Brugia malayi intermediate filament protein 0.0028 0.0208 0.0197
Trypanosoma brucei phosphatidylinositol 4-kinase, putative 0.0044 0.039 0.5119
Loa Loa (eye worm) TAR-binding protein 0.0062 0.0592 0.0592
Onchocerca volvulus Protein patched homolog 0.0012 0.0032 0.0025
Loa Loa (eye worm) hypothetical protein 0.0027 0.0202 0.0202
Schistosoma mansoni hypothetical protein 0.0082 0.0817 0.0807
Loa Loa (eye worm) intermediate filament tail domain-containing protein 0.0028 0.0208 0.0208
Schistosoma mansoni phosphatidylinositol 3-and 4-kinase 0.0015 0.0063 0.0052
Onchocerca volvulus 0.0029 0.0228 0.0254
Loa Loa (eye worm) hypothetical protein 0.0013 0.0042 0.0042
Echinococcus multilocularis tumor protein p63 0.0677 0.7507 0.7507
Toxoplasma gondii hypothetical protein 0.0012 0.0032 0.0413
Brugia malayi hypothetical protein 0.0037 0.0309 0.0299
Leishmania major 4-coumarate:coa ligase-like protein 0.0023 0.016 0.1414
Echinococcus multilocularis expressed conserved protein 0.0186 0.1985 0.1985
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.0065 0.0624 0.0613
Brugia malayi Patched family protein 0.0012 0.0032 0.0022
Trichomonas vaginalis PIKK family atypical protein kinase 0.0033 0.0264 0.3088
Loa Loa (eye worm) patched family protein 0.0012 0.0032 0.0032
Loa Loa (eye worm) hypothetical protein 0.0012 0.0032 0.0032
Schistosoma mansoni cpg binding protein 0.0031 0.0247 0.0236
Brugia malayi Patched related family protein 10 0.0012 0.0032 0.0022
Echinococcus granulosus FKBP12 rapamycin complex associated protein 0.0044 0.039 0.039
Schistosoma mansoni hypothetical protein 0.014 0.1466 0.1457
Loa Loa (eye worm) hypothetical protein 0.0204 0.2192 0.2192
Brugia malayi TAR-binding protein 0.0062 0.0592 0.0581
Loa Loa (eye worm) latrophilin receptor protein 2 0.0065 0.0624 0.0624
Loa Loa (eye worm) beta-LACTamase domain containing family member 0.0072 0.0709 0.0709
Toxoplasma gondii histone lysine methyltransferase SET1 0.0056 0.0524 0.6964
Echinococcus granulosus NADP dependent isocitrate dehydrogenase 0.0016 0.0078 0.0078
Loa Loa (eye worm) hypothetical protein 0.0072 0.0709 0.0709
Leishmania major hypothetical protein, conserved 0.0076 0.0752 1
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD3 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0016 0.0083 0.0009
Schistosoma mansoni aldehyde dehydrogenase 0.0062 0.0596 0.0586
Echinococcus multilocularis mothers against decapentaplegic 6 0.0011 0.002 0.002
Echinococcus multilocularis mothers against decapentaplegic 5 0.0024 0.0171 0.0171
Mycobacterium ulcerans aldehyde dehydrogenase 0.0062 0.0596 0.8381
Trypanosoma cruzi hypothetical protein, conserved 0.0072 0.0709 0.9423
Trichomonas vaginalis PIKK family atypical protein kinase 0.0026 0.0192 0.2241
Trypanosoma cruzi phosphatidylinositol 3-related kinase, putative 0.0015 0.0063 0.0701
Mycobacterium tuberculosis Probable aldehyde dehydrogenase 0.0062 0.0596 0.1035
Trypanosoma cruzi PAB1-binding protein , putative 0.0076 0.0752 1
Trypanosoma brucei Phosphatidylinositol 3-kinase tor1 0.0044 0.039 0.5119
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0037 0.0309 0.0309
Brugia malayi Patched family protein 0.0012 0.0032 0.0022
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0143 0.1511 0.1511
Toxoplasma gondii poly(ADP-ribose) polymerase catalytic domain-containing protein 0.001 0.0011 0.0126
Schistosoma mansoni aldehyde dehydrogenase 0.0062 0.0596 0.0586
Schistosoma mansoni hypothetical protein 0.0047 0.0426 0.0416
Schistosoma mansoni tar DNA-binding protein 0.0062 0.0592 0.0581
Loa Loa (eye worm) hypothetical protein 0.0012 0.0032 0.0032
Mycobacterium ulcerans acyl-CoA synthetase 0.0023 0.016 0.2139
Loa Loa (eye worm) hypothetical protein 0.0012 0.0032 0.0032
Echinococcus multilocularis aldehyde dehydrogenase, mitochondrial 0.0062 0.0596 0.0596
Echinococcus multilocularis NADP dependent isocitrate dehydrogenase 0.0016 0.0078 0.0078
Echinococcus multilocularis protein patched 0.0085 0.0851 0.0851
Echinococcus granulosus bifunctional protein NCOAT 0.0899 1 1
Leishmania major 4-coumarate:coa ligase-like protein 0.0023 0.016 0.1414
Echinococcus granulosus smad 0.0024 0.0171 0.0171
Brugia malayi Smad1 0.0024 0.0171 0.016
Trichomonas vaginalis PIKK family atypical protein kinase 0.0033 0.0264 0.3088
Toxoplasma gondii ATPase, AAA family protein 0.001 0.0011 0.0126
Toxoplasma gondii patched family protein 0.0012 0.0032 0.0413
Trichomonas vaginalis PIKK family atypical protein kinase 0.0026 0.0192 0.2241
Loa Loa (eye worm) hypothetical protein 0.0012 0.0032 0.0032
Schistosoma mansoni hypothetical protein 0.0082 0.0817 0.0807
Loa Loa (eye worm) hypothetical protein 0.0013 0.0047 0.0047
Trichomonas vaginalis PIKK family atypical protein kinase 0.0033 0.0264 0.3088
Brugia malayi Patched family protein 0.0012 0.0032 0.0022
Loa Loa (eye worm) phosphatidylinositol 3 0.0044 0.039 0.039
Plasmodium vivax ataxin-2 like protein, putative 0.0076 0.0752 1
Onchocerca volvulus 0.0012 0.0032 0.0025
Loa Loa (eye worm) abnormal chemotaxis protein 14 0.0085 0.0851 0.0851
Schistosoma mansoni smad1 5 8 and 0.0024 0.0171 0.016
Loa Loa (eye worm) intermediate filament protein 0.0028 0.0208 0.0208
Trichomonas vaginalis PIKK family atypical protein kinase 0.0033 0.0264 0.3088
Trypanosoma brucei isocitrate dehydrogenase [NADP], mitochondrial precursor, putative 0.0016 0.0078 0.0912
Echinococcus granulosus tumor protein p63 0.0677 0.7507 0.7507
Trichomonas vaginalis chromosome transmission fidelity factor, putative 0.001 0.0011 0.0111
Echinococcus multilocularis phosphatidylinositol 3 and 4 kinase 0.0015 0.0063 0.0063
Trypanosoma brucei PAB1-binding protein , putative 0.0076 0.0752 1
Trichomonas vaginalis D-aminoacylase, putative 0.0072 0.0709 0.8324
Echinococcus granulosus intermediate filament protein 0.0028 0.0208 0.0208
Trichomonas vaginalis PIKK family atypical protein kinase 0.0024 0.0163 0.1903
Plasmodium falciparum ataxin-2 like protein, putative 0.0076 0.0752 1
Loa Loa (eye worm) hypothetical protein 0.023 0.2488 0.2488
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD5 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0016 0.0083 0.0009
Mycobacterium tuberculosis Fatty-acid-AMP ligase FadD30 (fatty-acid-AMP synthetase) (fatty-acid-AMP synthase) 0.0017 0.0094 0.0031
Brugia malayi MH1 domain containing protein 0.0024 0.0171 0.016
Loa Loa (eye worm) patched family protein 0.0012 0.0032 0.0032
Trichomonas vaginalis penicillin-binding protein, putative 0.0072 0.0709 0.8324
Schistosoma mansoni Smad4 0.0011 0.002 0.0009
Loa Loa (eye worm) hypothetical protein 0.001 0.0011 0.0011
Echinococcus multilocularis Niemann Pick C1 protein 0.0198 0.212 0.212
Loa Loa (eye worm) hypothetical protein 0.0012 0.0032 0.0032
Mycobacterium ulcerans esterase/lipase LipP 0.0072 0.0709 1
Mycobacterium ulcerans aldehyde dehydrogenase 0.0062 0.0596 0.8381
Loa Loa (eye worm) cytoplasmic intermediate filament protein 0.0015 0.0064 0.0064
Trichomonas vaginalis conserved hypothetical protein 0.001 0.0011 0.0111
Loa Loa (eye worm) hypothetical protein 0.0771 0.8566 0.8566
Brugia malayi CHE-14 protein 0.0085 0.0851 0.0841
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD35 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0016 0.0083 0.0009
Echinococcus multilocularis lamin dm0 0.0028 0.0208 0.0208
Echinococcus multilocularis FKBP12 rapamycin complex associated protein 0.0044 0.039 0.039
Onchocerca volvulus 0.0012 0.0032 0.0025
Toxoplasma gondii patched family protein 0.0012 0.0032 0.0413
Trichomonas vaginalis RNA polymerase II ctd phosphatase, putative 0.001 0.0011 0.0111
Mycobacterium tuberculosis Probable esterase/lipase LipP 0.0072 0.0709 0.126
Echinococcus granulosus sterol regulatory element binding protein 0.0085 0.0851 0.0851
Echinococcus multilocularis protein dispatched 1 0.0097 0.0986 0.0986
Loa Loa (eye worm) hypothetical protein 0.0012 0.0032 0.0032
Onchocerca volvulus 0.0012 0.0032 0.0025
Trypanosoma brucei hypothetical protein, conserved 0.0072 0.0709 0.9423
Echinococcus granulosus geminin 0.0706 0.7829 0.7829
Plasmodium vivax acyl-CoA synthetase, putative 0.0017 0.0094 0.112
Mycobacterium tuberculosis Probable esterase LipL 0.0072 0.0709 0.126
Onchocerca volvulus 0.0771 0.8566 1
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.0044 0.039 0.038
Brugia malayi RNA binding protein 0.0062 0.0592 0.0581
Loa Loa (eye worm) hypothetical protein 0.0076 0.0752 0.0752
Mycobacterium tuberculosis Conserved protein 0.0072 0.0709 0.126
Brugia malayi Patched family protein 0.0012 0.0032 0.0022
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0072 0.0709 0.0699
Trypanosoma cruzi hypothetical protein, conserved 0.0072 0.0709 0.9423
Brugia malayi protein C24B5.3 0.0012 0.0032 0.0022
Loa Loa (eye worm) hypothetical protein 0.0012 0.0032 0.0032
Schistosoma mansoni Smad4 0.0011 0.002 0.0009
Schistosoma mansoni hypothetical protein 0.0065 0.0624 0.0613
Brugia malayi Patched family protein 0.0012 0.0032 0.0022
Echinococcus granulosus lamin 0.0028 0.0208 0.0208
Mycobacterium ulcerans acyl-CoA synthetase 0.0023 0.016 0.2139
Schistosoma mansoni hypothetical protein 0.0082 0.0817 0.0807
Trichomonas vaginalis D-aminoacylase, putative 0.0072 0.0709 0.8324
Echinococcus granulosus Niemann Pick C1 protein 0.0282 0.3073 0.3073
Trypanosoma brucei FAT domain/Rapamycin binding domain/Phosphatidylinositol 3- and 4-kinase, putative 0.0018 0.0102 0.1233
Echinococcus multilocularis cpg binding protein 0.0031 0.0247 0.0247
Echinococcus granulosus nibrin 0.001 0.0011 0.0011
Echinococcus granulosus Smad4 0.0024 0.0171 0.0171
Mycobacterium ulcerans fatty-acid-CoA ligase 0.0023 0.016 0.2139
Echinococcus multilocularis nibrin 0.001 0.0011 0.0011
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0143 0.1511 0.1511
Trichomonas vaginalis PIKK family atypical protein kinase 0.0029 0.0228 0.2665
Mycobacterium tuberculosis Probable conserved lipoprotein 0.0072 0.0709 0.126
Echinococcus multilocularis cadherin EGF LAG seven pass G type receptor 0.0065 0.0624 0.0624
Echinococcus multilocularis musashi 0.0028 0.0208 0.0208
Loa Loa (eye worm) hypothetical protein 0.0072 0.0709 0.0709
Echinococcus multilocularis sterol regulatory element binding protein 0.0085 0.0851 0.0851
Leishmania major target of rapamycin (TOR) kinase 1, putative 0.0044 0.039 0.4751
Brugia malayi Myosin head containing protein 0.0012 0.0032 0.0022
Trichomonas vaginalis PIKK family atypical protein kinase 0.0026 0.0192 0.2241
Schistosoma mansoni tar DNA-binding protein 0.0062 0.0592 0.0581
Trichomonas vaginalis PIKK family atypical protein kinase 0.0024 0.0164 0.1907
Plasmodium falciparum lipid/sterol:H+ symporter 0.0012 0.0032 0.0291
Loa Loa (eye worm) MH2 domain-containing protein 0.0024 0.0171 0.0171
Loa Loa (eye worm) hypothetical protein 0.0011 0.002 0.002
Loa Loa (eye worm) MH1 domain-containing protein 0.0024 0.0171 0.0171
Echinococcus multilocularis atpase aaa+ type core atpase aaa type core 0.0829 0.9221 0.9221
Mycobacterium tuberculosis Probable hydrolase 0.0072 0.0709 0.126
Loa Loa (eye worm) hypothetical protein 0.0012 0.0032 0.0032
Loa Loa (eye worm) hypothetical protein 0.0072 0.0709 0.0709
Mycobacterium leprae Probable lipase LipE 0.0072 0.0709 1
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD2 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0023 0.016 0.0163
Loa Loa (eye worm) hypothetical protein 0.0012 0.0032 0.0032
Brugia malayi hypothetical protein 0.0012 0.0032 0.0022
Loa Loa (eye worm) hypothetical protein 0.001 0.0011 0.0011
Loa Loa (eye worm) hypothetical protein 0.001 0.0011 0.0011
Plasmodium vivax hypothetical protein, conserved 0.0072 0.0709 0.9423
Trypanosoma brucei isocitrate dehydrogenase, putative 0.0016 0.0078 0.0912
Brugia malayi AMP-binding enzyme family protein 0.0023 0.016 0.0149
Toxoplasma gondii ABC1 family protein 0.0072 0.0709 0.9431
Brugia malayi MH2 domain containing protein 0.0356 0.3903 0.3896
Brugia malayi Patched family protein 0.0012 0.0032 0.0022
Echinococcus granulosus mothers against decapentaplegic 2 0.0011 0.002 0.002
Trichomonas vaginalis PIKK family atypical protein kinase 0.0026 0.0189 0.2207
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.0065 0.0624 0.0624
Mycobacterium tuberculosis Possible penicillin-binding protein 0.0461 0.508 1
Toxoplasma gondii LsmAD domain-containing protein 0.0076 0.0752 1
Schistosoma mansoni hypothetical protein 0.0037 0.0309 0.0299
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0143 0.1511 0.1511
Trichomonas vaginalis D-aminoacylase, putative 0.0072 0.0709 0.8324
Echinococcus multilocularis Niemann Pick C1 protein 0.0282 0.3073 0.3073
Brugia malayi AMP-binding enzyme family protein 0.0023 0.016 0.0149
Echinococcus granulosus survival motor neuron protein 1 0.023 0.2488 0.2488
Brugia malayi Patched family protein 0.0012 0.0032 0.0022
Brugia malayi Isocitrate dehydrogenase 0.0016 0.0078 0.0068
Chlamydia trachomatis acylglycerophosphoethanolamine acyltransferase 0.0017 0.0094 1
Loa Loa (eye worm) hypothetical protein 0.0065 0.0624 0.0624
Trichomonas vaginalis PIKK family atypical protein kinase 0.0033 0.0264 0.3088
Brugia malayi beta-lactamase family protein 0.0072 0.0709 0.0699
Wolbachia endosymbiont of Brugia malayi NAD-dependent DNA ligase, Lig 0.001 0.0011 0.5
Loa Loa (eye worm) hypothetical protein 0.0012 0.0032 0.0032
Entamoeba histolytica acyl-CoA synthetase, putative 0.0023 0.016 0.0708
Brugia malayi Patched protein homolog 1 0.0012 0.0032 0.0022
Loa Loa (eye worm) hypothetical protein 0.0012 0.0032 0.0032
Loa Loa (eye worm) MH2 domain-containing protein 0.0011 0.002 0.002
Schistosoma mansoni lamin 0.0028 0.0208 0.0197
Schistosoma mansoni intermediate filament proteins 0.0028 0.0208 0.0197
Entamoeba histolytica acyl-coA synthetase, putative 0.0023 0.016 0.0708
Onchocerca volvulus 0.0028 0.0208 0.023
Leishmania major target of rapamycin kinase (TOR) kinase 3 0.0035 0.029 0.3295
Mycobacterium leprae PROBABLE FATTY-ACID-CoA LIGASE FADD2 (FATTY-ACID-CoA SYNTHETASE) (FATTY-ACID-CoA SYNTHASE) 0.0023 0.016 0.2139
Schistosoma mansoni hypothetical protein 0.0065 0.0624 0.0613
Loa Loa (eye worm) hypothetical protein 0.0012 0.0032 0.0032
Onchocerca volvulus 0.0072 0.0709 0.0816
Trichomonas vaginalis PIKK family atypical protein kinase 0.0035 0.0289 0.3387
Echinococcus multilocularis NADP dependent isocitrate dehydrogenase 0.0016 0.0078 0.0078
Brugia malayi isocitrate dehydrogenase 0.0016 0.0078 0.0068
Loa Loa (eye worm) hypothetical protein 0.0028 0.0208 0.0208
Echinococcus granulosus lamin dm0 0.0028 0.0208 0.0208
Echinococcus multilocularis replication factor c subunit 1 0.001 0.0011 0.0011
Echinococcus multilocularis survival motor neuron protein 1 0.023 0.2488 0.2488
Echinococcus granulosus mothers against decapentaplegic 5 0.0024 0.0171 0.0171
Toxoplasma gondii patched family protein 0.0012 0.0032 0.0413
Brugia malayi beta-lactamase family protein 0.0072 0.0709 0.0699
Schistosoma mansoni NADP-specific isocitrate dehydrogenase 0.0016 0.0078 0.0068
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0204 0.2192 0.2184
Loa Loa (eye worm) hypothetical protein 0.0012 0.0032 0.0032
Loa Loa (eye worm) hypothetical protein 0.0012 0.0032 0.0032
Mycobacterium ulcerans beta-lactamase 0.0072 0.0709 1
Echinococcus multilocularis dnaJ subfamily B 0.0419 0.4604 0.4604
Echinococcus multilocularis NADP dependent isocitrate dehydrogenase 0.0016 0.0078 0.0078
Mycobacterium tuberculosis Conserved protein 0.0072 0.0709 0.126
Echinococcus granulosus tar DNA binding protein 0.0062 0.0592 0.0592
Loa Loa (eye worm) hypothetical protein 0.0012 0.0032 0.0032
Echinococcus granulosus expressed conserved protein 0.0186 0.1985 0.1985
Onchocerca volvulus 0.0047 0.0426 0.0485
Entamoeba histolytica hypothetical protein 0.0037 0.0309 0.1415
Loa Loa (eye worm) hypothetical protein 0.0072 0.0709 0.0709
Trichomonas vaginalis PIKK family atypical protein kinase 0.0035 0.0289 0.3387
Entamoeba histolytica hypothetical protein 0.0037 0.0309 0.1415
Entamoeba histolytica phosphatidylinositol3-kinaseTor2, putative 0.0044 0.039 0.1798
Loa Loa (eye worm) hypothetical protein 0.0012 0.0032 0.0032
Loa Loa (eye worm) hypothetical protein 0.0023 0.016 0.016
Loa Loa (eye worm) hypothetical protein 0.0013 0.0042 0.0042
Echinococcus granulosus cadherin EGF LAG seven pass G type receptor 0.0065 0.0624 0.0624
Trichomonas vaginalis PIKK family atypical protein kinase 0.0015 0.0063 0.0722
Trichomonas vaginalis PIKK family atypical protein kinase 0.0024 0.0163 0.1903
Leishmania major 4-coumarate:coa ligase-like protein 0.0023 0.016 0.1414
Schistosoma mansoni TGF-beta signal transducer Smad2 0.0024 0.0171 0.016
Echinococcus multilocularis Ataxin 2, N terminal,domain containing protein 0.0034 0.0281 0.0281
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0062 0.0599 0.0588
Loa Loa (eye worm) nuclear factor I 0.0013 0.0049 0.0049
Mycobacterium leprae PROBABLE FATTY-ACID-CoA LIGASE FADD7 (FATTY-ACID-CoA SYNTHETASE) (FATTY-ACID-CoA SYNTHASE) 0.0023 0.016 0.2139
Trichomonas vaginalis PIKK family atypical protein kinase 0.0044 0.039 0.4573
Loa Loa (eye worm) hypothetical protein 0.0013 0.0049 0.0049
Trichomonas vaginalis esterase, putative 0.0072 0.0709 0.8324
Mycobacterium ulcerans acyl-CoA synthetase 0.0023 0.016 0.2139
Loa Loa (eye worm) patched family protein 0.0012 0.0032 0.0032
Trichomonas vaginalis PIKK family atypical protein kinase 0.0035 0.0289 0.3387
Trichomonas vaginalis PIKK family atypical protein kinase 0.0015 0.0063 0.0722
Loa Loa (eye worm) hypothetical protein 0.014 0.1466 0.1466
Trichomonas vaginalis PIKK family atypical protein kinase 0.0024 0.0164 0.1907
Entamoeba histolytica hypothetical protein 0.0037 0.0309 0.1415
Onchocerca volvulus Protein patched homolog 0.0012 0.0032 0.0025
Loa Loa (eye worm) hypothetical protein 0.0012 0.0032 0.0032
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD7 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0016 0.0083 0.0009
Loa Loa (eye worm) hypothetical protein 0.0012 0.0032 0.0032
Brugia malayi hypothetical protein 0.0012 0.0032 0.0022
Brugia malayi hypothetical protein 0.0771 0.8566 0.8565
Brugia malayi Iron-sulfur cluster assembly accessory protein 0.0047 0.0426 0.0416
Mycobacterium ulcerans long-chain-fatty-acid-CoA ligase 0.0023 0.016 0.2139
Loa Loa (eye worm) hypothetical protein 0.0012 0.0032 0.0032
Brugia malayi Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative 0.0072 0.0709 0.0699
Brugia malayi AMP-binding enzyme family protein 0.0023 0.016 0.0149
Trichomonas vaginalis RNA polymerase II ctd phosphatase, putative 0.001 0.0011 0.0111
Brugia malayi CXXC zinc finger family protein 0.0029 0.0228 0.0218
Schistosoma mansoni hypothetical protein 0.0082 0.0817 0.0807
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0204 0.2192 0.2192
Mycobacterium tuberculosis Probable chain -fatty-acid-CoA ligase FadD13 (fatty-acyl-CoA synthetase) 0.0023 0.016 0.0163
Loa Loa (eye worm) hypothetical protein 0.0382 0.4189 0.4189
Loa Loa (eye worm) hypothetical protein 0.0017 0.0094 0.0094
Brugia malayi Patched family protein 0.0012 0.0032 0.0022
Loa Loa (eye worm) hypothetical protein 0.0017 0.0094 0.0094
Trypanosoma cruzi phosphatidylinositol 3-related kinase, putative 0.0015 0.0063 0.0701
Schistosoma mansoni hypothetical protein 0.0706 0.7829 0.7827
Trichomonas vaginalis PIKK family atypical protein kinase 0.0012 0.003 0.0334
Loa Loa (eye worm) hypothetical protein 0.0012 0.0032 0.0032
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.0015 0.0063 0.0052
Loa Loa (eye worm) hypothetical protein 0.0072 0.0709 0.0709
Echinococcus multilocularis isocitrate dehydrogenase 0.0016 0.0078 0.0078
Brugia malayi Patched family protein 0.0012 0.0032 0.0022
Schistosoma mansoni ataxia telangiectasia mutated (atm)-related 0.0044 0.039 0.038
Loa Loa (eye worm) hypothetical protein 0.0012 0.0032 0.0032
Loa Loa (eye worm) hypothetical protein 0.0017 0.0094 0.0094
Trypanosoma brucei phosphatidylinositol 3-kinase tor, putative 0.0021 0.0131 0.1615
Trichomonas vaginalis chromosome transmission fidelity factor, putative 0.001 0.0011 0.0111
Schistosoma mansoni smad1 5 8 and 0.0024 0.0171 0.016
Echinococcus granulosus Protein patched homolog 1 0.0085 0.0851 0.0851
Echinococcus granulosus beta LACTamase domain containing family member 0.0072 0.0709 0.0709
Mycobacterium ulcerans fusion of enoyl-CoA hydratase, EchA21 and lipase, LipE 0.0072 0.0709 1
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0143 0.1511 0.1502
Trichomonas vaginalis conserved hypothetical protein 0.001 0.0011 0.0111
Mycobacterium tuberculosis Possible conserved lipoprotein LpqK 0.0072 0.0709 0.126
Brugia malayi hypothetical protein 0.0076 0.0752 0.0741
Echinococcus granulosus Niemann Pick C1 protein 0.0198 0.212 0.212
Trypanosoma brucei target of rapamycin kinase 3, putative 0.0035 0.029 0.3765

Activities

Activity type Activity value Assay description Source Reference
GI50 (functional) -4 PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the SN12C Renal cell line. (Class of assay: confirmatory) ChEMBL. No reference
GI50 (functional) -4 PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the NCI-H23 Non-Small Cell Lung cell line. (Class of assay: confirmatory) ChEMBL. No reference
GI50 (functional) -4 PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the UO-31 Renal cell line. (Class of assay: confirmatory) ChEMBL. No reference
GI50 (functional) -4 PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the ACHN Renal cell line. (Class of assay: confirmatory) ChEMBL. No reference
GI50 (functional) -4 PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the HL-60(TB) Leukemia cell line. (Class of assay: confirmatory) ChEMBL. No reference
GI50 (functional) -4 PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the SF-539 Central Nervous System cell line. (Class of assay: confirmatory) ChEMBL. No reference
GI50 (functional) -4 PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the MALME-3M Melanoma cell line. (Class of assay: confirmatory) ChEMBL. No reference
GI50 (functional) -4 PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the SK-MEL-5 Melanoma cell line. (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.
 
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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