Detailed information for compound 142972

Basic information

Technical information
  • TDR Targets ID: 142972
  • Name: (2S,3S,4R,5R)-2-[[1-amino-8-(3-aminopropylami no)octan-3-yl]sulfanylmethyl]-5-(6-aminopurin -9-yl)oxolane-3,4-diol
  • MW: 482.643 | Formula: C21H38N8O3S
  • H donors: 6 H acceptors: 5 LogP: -1.22 Rotable bonds: 15
    Rule of 5 violations (Lipinski): 2
  • SMILES: NCCCNCCCCCC(SC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N)CCN
  • InChi: 1S/C21H38N8O3S/c22-7-4-10-25-9-3-1-2-5-14(6-8-23)33-11-15-17(30)18(31)21(32-15)29-13-28-16-19(24)26-12-27-20(16)29/h12-15,17-18,21,25,30-31H,1-11,22-23H2,(H2,24,26,27)/t14?,15-,17-,18-,21-/m1/s1
  • InChiKey: IYEWZPHRHXRMCW-BWZSZYTASA-N  


Substructure search Similarity search

Network

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Synonyms

  • (2S,3S,4R,5R)-2-[[1-(2-aminoethyl)-6-(3-aminopropylamino)hexyl]sulfanylmethyl]-5-(6-aminopurin-9-yl)tetrahydrofuran-3,4-diol
  • (2S,3S,4R,5R)-2-[[[1-(2-aminoethyl)-6-(3-aminopropylamino)hexyl]thio]methyl]-5-(6-aminopurin-9-yl)tetrahydrofuran-3,4-diol
  • (2R,3R,4S,5S)-2-(6-aminopurin-9-yl)-5-[[1-azanyl-8-(3-azanylpropylamino)octan-3-yl]sulfanylmethyl]oxolane-3,4-diol
  • (2R,3R,4S,5S)-2-adenin-9-yl-5-[[[1-(2-aminoethyl)-6-(3-aminopropylamino)hexyl]thio]methyl]tetrahydrofuran-3,4-diol
  • S-adenosyl-1,12-diamino-3-thio-9-azadodecane
  • (2S,3S,4R,5R)-2-[[[1-(2-aminoethyl)-6-(3-aminopropylamino)hexyl]thio]methyl]-5-(6-amino-9-purinyl)tetrahydrofuran-3,4-diol
  • 118436-57-0
  • Adenosine, 5'-S-(1-(2-aminoethyl)-6-((3-aminopropyl)amino)hexyl)-5'-thio-
  • Adodatad

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens spermine synthase Starlite/ChEMBL References

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
Loa Loa (eye worm) exodeoxyribonuclease III family protein 0.002 0.0094 0.0147
Trypanosoma brucei DNA polymerase eta, putative 0.0019 0.0081 0.0134
Echinococcus granulosus apoptotic protease activating factor 1 0.0106 0.1243 0.2037
Schistosoma mansoni caspase-7 (C14 family) 0.0106 0.1243 0.2934
Echinococcus multilocularis geminin 0.0199 0.2497 0.4115
Brugia malayi hypothetical protein 0.0056 0.0575 0.0899
Schistosoma mansoni hypothetical protein 0.0324 0.4181 1
Echinococcus granulosus Ataxin 2 N terminaldomain containing protein 0.0025 0.0159 0.0242
Plasmodium falciparum spermidine synthase 0.0463 0.6051 1
Schistosoma mansoni zinc finger protein 0.0021 0.0102 0.0189
Schistosoma mansoni hypothetical protein 0.0106 0.1243 0.2934
Trypanosoma brucei unspecified product 0.0019 0.0081 0.0134
Trypanosoma cruzi DNA polymerase kappa, putative 0.0019 0.0081 0.0096
Schistosoma mansoni inhibitor of apoptosis protein 0.0324 0.4181 1
Echinococcus granulosus terminal deoxycytidyl transferase rev1 0.0019 0.0081 0.0113
Schistosoma mansoni lamin 0.003 0.0219 0.0471
Brugia malayi Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative 0.0118 0.1414 0.2293
Toxoplasma gondii LsmAD domain-containing protein 0.0056 0.0575 0.3642
Loa Loa (eye worm) cytochrome P450 family protein 0.0048 0.046 0.0752
Schistosoma mansoni rab geranylgeranyl transferase alpha subunit 0.0019 0.0081 0.0139
Brugia malayi hypothetical protein 0.0106 0.1243 0.2009
Echinococcus granulosus lamin 0.003 0.0219 0.0341
Brugia malayi Glycosyl hydrolases family 31 protein 0.0162 0.1992 0.3255
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0017 0.0055 0.0076
Trypanosoma brucei DNA polymerase kappa, putative 0.0019 0.0081 0.0134
Echinococcus multilocularis lamin 0.003 0.0219 0.0341
Echinococcus multilocularis dna polymerase kappa 0.0019 0.0081 0.0113
Loa Loa (eye worm) hypothetical protein 0.0324 0.4181 0.6907
Onchocerca volvulus 0.003 0.0219 0.0039
Trypanosoma cruzi PAB1-binding protein , putative 0.0056 0.0575 0.0915
Loa Loa (eye worm) hypothetical protein 0.0118 0.1414 0.233
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0118 0.1414 0.3345
Echinococcus multilocularis apoptotic protease activating factor 1 0.0106 0.1243 0.2037
Brugia malayi ImpB/MucB/SamB family protein 0.0019 0.0081 0.0078
Echinococcus multilocularis cpg binding protein 0.0032 0.025 0.0394
Leishmania major hypothetical protein, conserved 0.0056 0.0575 0.0915
Trichomonas vaginalis D-aminoacylase, putative 0.0118 0.1414 1
Loa Loa (eye worm) hypothetical protein 0.0118 0.1414 0.233
Mycobacterium ulcerans fusion of enoyl-CoA hydratase, EchA21 and lipase, LipE 0.0118 0.1414 0.2961
Trypanosoma brucei ISWI complex protein 0.0015 0.0023 0.0038
Echinococcus granulosus geminin 0.0199 0.2497 0.4115
Brugia malayi Bromodomain containing protein 0.0076 0.0836 0.1334
Plasmodium falciparum ataxin-2 like protein, putative 0.0056 0.0575 0.0807
Echinococcus multilocularis lysosomal alpha glucosidase 0.0162 0.1992 0.3279
Echinococcus granulosus bromodomain adjacent to zinc finger domain 0.006 0.0633 0.1028
Echinococcus multilocularis lysosomal alpha glucosidase 0.0162 0.1992 0.3279
Leishmania major DNA polymerase kappa, putative,DNA polymerase IV, putative 0.0019 0.0081 0.0096
Onchocerca volvulus 0.0106 0.1243 0.2614
Trichomonas vaginalis ap endonuclease, putative 0.002 0.0094 0.0101
Loa Loa (eye worm) hypothetical protein 0.0118 0.1414 0.233
Onchocerca volvulus 0.0118 0.1414 0.3043
Schistosoma mansoni cpg binding protein 0.0032 0.025 0.0547
Schistosoma mansoni intermediate filament proteins 0.003 0.0219 0.0471
Trichomonas vaginalis D-aminoacylase, putative 0.0118 0.1414 1
Trypanosoma cruzi spermidine synthase, putative 0.0463 0.6051 1
Echinococcus multilocularis lamin dm0 0.003 0.0219 0.0341
Loa Loa (eye worm) hypothetical protein 0.0056 0.0575 0.0942
Brugia malayi intermediate filament protein 0.003 0.0219 0.0307
Echinococcus multilocularis neutral alpha glucosidase AB 0.0036 0.0302 0.048
Brugia malayi Intermediate filament tail domain containing protein 0.003 0.0219 0.0307
Echinococcus granulosus lamin dm0 0.003 0.0219 0.0341
Mycobacterium ulcerans spermidine synthase 0.0354 0.4583 1
Loa Loa (eye worm) hypothetical protein 0.0029 0.0212 0.0341
Loa Loa (eye worm) hypothetical protein 0.0044 0.0407 0.0665
Brugia malayi PHD-finger family protein 0.0026 0.0172 0.023
Leishmania major DNA polymerase eta, putative 0.0019 0.0081 0.0096
Echinococcus multilocularis spermidine synthase 0.0463 0.6051 1
Mycobacterium tuberculosis Probable esterase LipL 0.0118 0.1414 0.1344
Echinococcus granulosus zinc finger protein 0.0021 0.0102 0.0147
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0148 0.1809 0.2975
Brugia malayi Inhibitor of Apoptosis domain containing protein 0.0324 0.4181 0.6892
Brugia malayi Glycosyl hydrolases family 31 protein 0.0036 0.0302 0.0446
Trypanosoma cruzi DNA polymerase kappa, putative 0.0019 0.0081 0.0096
Loa Loa (eye worm) beta-LACTamase domain containing family member 0.0118 0.1414 0.233
Echinococcus multilocularis Ataxin 2, N terminal,domain containing protein 0.0025 0.0159 0.0242
Brugia malayi hypothetical protein 0.0036 0.0307 0.0455
Echinococcus granulosus spermidine synthase 0.0463 0.6051 1
Schistosoma mansoni hypothetical protein 0.0199 0.2497 0.595
Schistosoma mansoni methyl-cpg binding protein mbd 0.0017 0.0046 0.0056
Trichomonas vaginalis neutral alpha-glucosidase ab precursor, putative 0.0036 0.0302 0.1662
Echinococcus granulosus neutral alpha glucosidase AB 0.0036 0.0302 0.048
Mycobacterium tuberculosis Conserved protein 0.0118 0.1414 0.1344
Echinococcus multilocularis caspase 2 0.0106 0.1243 0.2037
Trypanosoma cruzi hypothetical protein, conserved 0.0118 0.1414 0.2307
Schistosoma mansoni alpha glucosidase 0.0036 0.0302 0.0672
Brugia malayi ImpB/MucB/SamB family protein 0.0019 0.0081 0.0078
Loa Loa (eye worm) hypothetical protein 0.0118 0.1414 0.233
Echinococcus granulosus cpg binding protein 0.0032 0.025 0.0394
Loa Loa (eye worm) intermediate filament tail domain-containing protein 0.003 0.0219 0.0353
Entamoeba histolytica glycosyl hydrolase, family 31 protein 0.0036 0.0302 1
Loa Loa (eye worm) hypothetical protein 0.0118 0.1414 0.233
Loa Loa (eye worm) glycosyl hydrolase family 31 protein 0.0036 0.0302 0.0491
Mycobacterium tuberculosis Conserved protein 0.0118 0.1414 0.1344
Mycobacterium leprae conserved hypothetical protein 0.0118 0.1414 0.5
Loa Loa (eye worm) ImpB/MucB/SamB family protein 0.0019 0.0081 0.0125
Echinococcus multilocularis fetal alzheimer antigen, falz 0.0024 0.0141 0.0213
Loa Loa (eye worm) hypothetical protein 0.016 0.1977 0.3261
Loa Loa (eye worm) hypothetical protein 0.004 0.036 0.0587
Schistosoma mansoni DNA polymerase eta 0.0019 0.0081 0.0139
Trypanosoma brucei hypothetical protein, conserved 0.0118 0.1414 0.2336
Mycobacterium tuberculosis Probable exodeoxyribonuclease III protein XthA (exonuclease III) (EXO III) (AP endonuclease VI) 0.002 0.0094 0.0014
Echinococcus granulosus lysosomal alpha glucosidase 0.0162 0.1992 0.3279
Trypanosoma brucei spermidine synthase 0.0463 0.6051 1
Trichomonas vaginalis ap endonuclease, putative 0.002 0.0094 0.0101
Brugia malayi beta-lactamase 0.0118 0.1414 0.2293
Trypanosoma brucei DNA polymerase kappa, putative 0.0019 0.0081 0.0134
Toxoplasma gondii ABC1 family protein 0.0118 0.1414 1
Echinococcus granulosus methyl CpG binding domain protein 2 0.0017 0.0046 0.0056
Echinococcus multilocularis histone lysine methyltransferase setb histone lysine methyltransferase eggless 0.0017 0.0055 0.007
Trypanosoma cruzi hypothetical protein, conserved 0.0118 0.1414 0.2307
Trichomonas vaginalis D-aminoacylase, putative 0.0118 0.1414 1
Brugia malayi hypothetical protein 0.0154 0.1888 0.3082
Leishmania major DNA polymerase kappa, putative 0.0019 0.0081 0.0096
Schistosoma mansoni hypothetical protein 0.0199 0.2497 0.595
Schistosoma mansoni mixed-lineage leukemia protein mll 0.006 0.0632 0.1466
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0148 0.1809 0.295
Entamoeba histolytica exodeoxyribonuclease III, putative 0.002 0.0094 0.0606
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0148 0.1809 0.2983
Loa Loa (eye worm) hypothetical protein 0.0106 0.1243 0.2047
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0148 0.1809 0.2975
Loa Loa (eye worm) hypothetical protein 0.0017 0.0055 0.0082
Trypanosoma cruzi apurinic/apyrimidinic endonuclease 0.002 0.0094 0.0118
Trypanosoma cruzi hypothetical protein, conserved 0.0036 0.0302 0.0463
Onchocerca volvulus 0.0324 0.4181 1
Trichomonas vaginalis esterase, putative 0.0118 0.1414 1
Echinococcus multilocularis DNA (apurinic or apyrimidinic site) lyase 0.002 0.0094 0.0135
Loa Loa (eye worm) intermediate filament protein 0.003 0.0219 0.0353
Leishmania major spermidine synthase 0.0463 0.6051 1
Loa Loa (eye worm) beta-lactamase 0.0118 0.1414 0.233
Trichomonas vaginalis penicillin-binding protein, putative 0.0118 0.1414 1
Trypanosoma brucei DNA polymerase IV, putative 0.0019 0.0081 0.0134
Trichomonas vaginalis sucrase-isomaltase, putative 0.0036 0.0302 0.1662
Schistosoma mansoni hypothetical protein 0.002 0.0094 0.017
Trichomonas vaginalis alpha-glucosidase, putative 0.0036 0.0302 0.1662
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0148 0.1809 0.4295
Leishmania major alpha glucosidase II subunit, putative 0.0036 0.0302 0.0463
Loa Loa (eye worm) cytoplasmic intermediate filament protein 0.0016 0.0034 0.0047
Schistosoma mansoni alpha-glucosidase 0.0139 0.169 0.4009
Trypanosoma cruzi spermidine synthase, putative 0.0463 0.6051 1
Brugia malayi Inhibitor of Apoptosis domain containing protein 0.0324 0.4181 0.6892
Echinococcus granulosus bromodomain adjacent to zinc finger domain 0.0035 0.0297 0.047
Leishmania major apurinic/apyrimidinic endonuclease-redox protein 0.002 0.0094 0.0118
Brugia malayi beta-lactamase family protein 0.0118 0.1414 0.2293
Trichomonas vaginalis alpha-glucosidase, putative 0.0036 0.0302 0.1662
Trypanosoma brucei DNA polymerase IV, putative 0.0019 0.0081 0.0134
Echinococcus granulosus baculoviral IAP repeat containing protein 0.0324 0.4181 0.6903
Leishmania major hypothetical protein, conserved 0.0118 0.1414 0.2307
Loa Loa (eye worm) hypothetical protein 0.003 0.0219 0.0353
Plasmodium vivax ataxin-2 like protein, putative 0.0056 0.0575 0.0807
Loa Loa (eye worm) bromodomain containing protein 0.0017 0.0055 0.0081
Trypanosoma cruzi DNA polymerase kappa, putative 0.0019 0.0081 0.0096
Echinococcus granulosus intermediate filament protein 0.003 0.0219 0.0341
Loa Loa (eye worm) hypothetical protein 0.016 0.1977 0.3261
Toxoplasma gondii glycosyl hydrolase, family 31 protein 0.0036 0.0302 0.1577
Schistosoma mansoni bromodomain containing protein 0.0064 0.0681 0.1582
Trypanosoma brucei DNA polymerase kappa, putative 0.0019 0.0081 0.0134
Onchocerca volvulus 0.016 0.1977 0.4459
Trypanosoma cruzi DNA polymerase eta, putative 0.0019 0.0081 0.0096
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0148 0.1809 0.4295
Brugia malayi Cell death protein 3 precursor 0.0106 0.1243 0.2009
Loa Loa (eye worm) hypothetical protein 0.0106 0.1243 0.2047
Mycobacterium tuberculosis Probable conserved lipoprotein 0.0118 0.1414 0.1344
Loa Loa (eye worm) hypothetical protein 0.0118 0.1414 0.233
Trypanosoma brucei DNA polymerase kappa, putative 0.0019 0.0081 0.0134
Mycobacterium tuberculosis Conserved protein 0.0118 0.1414 0.1344
Loa Loa (eye worm) hypothetical protein 0.0019 0.0081 0.0125
Trypanosoma cruzi PAB1-binding protein , putative 0.0056 0.0575 0.0915
Toxoplasma gondii histone lysine methyltransferase SET1 0.0056 0.0577 0.3659
Trypanosoma cruzi apurinic/apyrimidinic endonuclease, putative 0.002 0.0094 0.0118
Mycobacterium ulcerans hypothetical protein 0.0118 0.1414 0.2961
Trypanosoma brucei DNA polymerase kappa, putative 0.0019 0.0081 0.0134
Schistosoma mansoni hypothetical protein 0.0025 0.0159 0.0326
Trichomonas vaginalis maltase-glucoamylase, putative 0.0036 0.0302 0.1662
Echinococcus granulosus caspase 2 0.0106 0.1243 0.2037
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0017 0.0055 0.0076
Loa Loa (eye worm) MH2 domain-containing protein 0.0119 0.1424 0.2346
Plasmodium falciparum ataxin-2 like protein, putative 0.0056 0.0575 0.0807
Trichomonas vaginalis alpha-glucosidase, putative 0.0036 0.0302 0.1662
Brugia malayi hypothetical protein 0.016 0.1977 0.3229
Plasmodium vivax spermidine synthase, putative 0.0463 0.6051 1
Echinococcus granulosus fetal alzheimer antigen falz 0.0024 0.0141 0.0213
Trypanosoma cruzi hypothetical protein, conserved 0.0036 0.0302 0.0463
Echinococcus multilocularis baculoviral IAP repeat containing protein 0.0324 0.4181 0.6903
Loa Loa (eye worm) spermidine synthase 0.0463 0.6051 1
Mycobacterium ulcerans exodeoxyribonuclease III protein XthA 0.002 0.0094 0.003
Treponema pallidum exodeoxyribonuclease (exoA) 0.002 0.0094 0.5
Schistosoma mansoni alpha-glucosidase 0.0139 0.169 0.4009
Mycobacterium tuberculosis Probable lipase LipE 0.0118 0.1414 0.1344
Echinococcus granulosus dna polymerase kappa 0.0019 0.0081 0.0113
Entamoeba histolytica glycosyl hydrolase, family 31 protein 0.0036 0.0302 1
Trichomonas vaginalis penicillin-binding protein, putative 0.0118 0.1414 1
Loa Loa (eye worm) hypothetical protein 0.016 0.1977 0.3261
Schistosoma mansoni cpg binding protein 0.0032 0.025 0.0547
Loa Loa (eye worm) hypothetical protein 0.0324 0.4181 0.6907
Trichomonas vaginalis neutral alpha-glucosidase ab precursor, putative 0.0036 0.0302 0.1662
Mycobacterium tuberculosis Possible conserved lipoprotein LpqK 0.0118 0.1414 0.1344
Echinococcus multilocularis terminal deoxycytidyl transferase rev1 0.0019 0.0081 0.0113
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0148 0.1809 0.2975
Giardia lamblia Endonuclease/Exonuclease/phosphatase 0.002 0.0094 1
Onchocerca volvulus Deterin homolog 0.0324 0.4181 1
Schistosoma mansoni acetyl-CoA C-acetyltransferase 0.0024 0.0141 0.0283
Trypanosoma brucei DNA polymerase kappa, putative 0.0019 0.0081 0.0134
Mycobacterium tuberculosis Probable esterase/lipase LipP 0.0118 0.1414 0.1344
Brugia malayi CXXC zinc finger family protein 0.0028 0.0203 0.0282
Loa Loa (eye worm) CXXC zinc finger family protein 0.0028 0.0203 0.0327
Loa Loa (eye worm) glycosyl hydrolase family 31 protein 0.0162 0.1992 0.3287
Echinococcus granulosus dna polymerase eta 0.0019 0.0081 0.0113
Echinococcus multilocularis bromodomain adjacent to zinc finger domain 0.0035 0.0297 0.047
Schistosoma mansoni methyl-cpg binding protein mbd 0.0017 0.0046 0.0056
Echinococcus multilocularis methyl CpG binding domain protein 2 0.0017 0.0046 0.0056
Onchocerca volvulus Cell death protein 3 homolog 0.0106 0.1243 0.2614
Schistosoma mansoni terminal deoxycytidyl transferase 0.0019 0.0081 0.0139
Mycobacterium tuberculosis Probable lipase LipD 0.0118 0.1414 0.1344
Loa Loa (eye worm) hypothetical protein 0.007 0.0758 0.1245
Onchocerca volvulus 0.0118 0.1414 0.3043
Loa Loa (eye worm) PHD-finger family protein 0.002 0.0094 0.0146
Brugia malayi Cytochrome P450 family protein 0.0048 0.046 0.0708
Trypanosoma brucei apurinic/apyrimidinic endonuclease, putative 0.002 0.0094 0.0156
Mycobacterium leprae Probable lipase LipE 0.0118 0.1414 0.5
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0148 0.1809 0.4295
Schistosoma mansoni lamin 0.003 0.0219 0.0471
Loa Loa (eye worm) transcription factor SMAD2 0.0119 0.1424 0.2346
Echinococcus multilocularis bromodomain adjacent to zinc finger domain 0.006 0.0633 0.1028
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0118 0.1414 0.3345
Echinococcus granulosus histone lysine methyltransferase setb 0.0017 0.0055 0.007
Loa Loa (eye worm) hypothetical protein 0.0154 0.1888 0.3114
Trypanosoma cruzi spermidine synthase, putative 0.0463 0.6051 1
Mycobacterium ulcerans lipase LipD 0.0118 0.1414 0.2961
Mycobacterium tuberculosis Probable hydrolase 0.0118 0.1414 0.1344
Trypanosoma cruzi DNA polymerase kappa, putative 0.0019 0.0081 0.0096
Plasmodium vivax hypothetical protein, conserved 0.0118 0.1414 0.2215
Onchocerca volvulus 0.0154 0.1888 0.4236
Trypanosoma brucei DNA polymerase kappa, putative 0.0019 0.0081 0.0134
Trypanosoma brucei DNA polymerase kappa, putative 0.0019 0.0081 0.0134
Onchocerca volvulus 0.003 0.0219 0.0039
Schistosoma mansoni cpg binding protein 0.0028 0.0203 0.0433
Brugia malayi Bromodomain containing protein 0.0038 0.0328 0.0489
Brugia malayi Spermidine synthase 0.0463 0.6051 1
Echinococcus multilocularis beta LACTamase domain containing family member 0.0118 0.1414 0.232
Trichomonas vaginalis alpha-glucosidase, putative 0.0036 0.0302 0.1662
Trichomonas vaginalis alpha-glucosidase, putative 0.0036 0.0302 0.1662
Echinococcus granulosus DNA apurinic or apyrimidinic site lyase 0.002 0.0094 0.0135
Trypanosoma brucei DNA polymerase IV, putative 0.0019 0.0081 0.0134
Trypanosoma brucei glucosidase, putative 0.0036 0.0302 0.05
Echinococcus multilocularis dna polymerase eta 0.0019 0.0081 0.0113
Loa Loa (eye worm) hypothetical protein 0.0014 0.0013 0.0012
Wolbachia endosymbiont of Brugia malayi exonuclease III 0.002 0.0094 0.5
Trypanosoma brucei DNA polymerase kappa, putative 0.0019 0.0081 0.0134
Echinococcus granulosus inhibitor of apoptosis protein 0.0324 0.4181 0.6903
Brugia malayi hypothetical protein 0.016 0.1977 0.3229
Mycobacterium ulcerans beta-lactamase 0.0118 0.1414 0.2961
Onchocerca volvulus 0.0093 0.1077 0.2196
Schistosoma mansoni inhibitor of apoptosis (iap) domain family member 0.0324 0.4181 1
Brugia malayi beta-lactamase family protein 0.0118 0.1414 0.2293
Trypanosoma brucei PAB1-binding protein , putative 0.0056 0.0575 0.095
Echinococcus multilocularis zinc finger protein 0.0021 0.0102 0.0147
Mycobacterium tuberculosis Probable spermidine synthase SpeE (putrescine aminopropyltransferase) (aminopropyltransferase) (SPDSY) 0.0354 0.4583 0.4539
Schistosoma mansoni ap endonuclease 0.002 0.0094 0.0171
Brugia malayi MH2 domain containing protein 0.0119 0.1424 0.231
Trypanosoma cruzi spermidine synthase, putative 0.0463 0.6051 1
Onchocerca volvulus 0.0118 0.1414 0.3043
Brugia malayi exodeoxyribonuclease III family protein 0.002 0.0094 0.01
Trypanosoma brucei DNA polymerase kappa, putative 0.0019 0.0081 0.0134
Echinococcus multilocularis inhibitor of apoptosis protein 0.0324 0.4181 0.6903
Echinococcus granulosus beta LACTamase domain containing family member 0.0118 0.1414 0.232
Mycobacterium ulcerans esterase/lipase LipP 0.0118 0.1414 0.2961
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0148 0.1809 0.2975
Loa Loa (eye worm) hypothetical protein 0.0038 0.0329 0.0535
Schistosoma mansoni ap endonuclease 0.002 0.0094 0.0171
Echinococcus multilocularis musashi 0.003 0.0219 0.0341

Activities

Activity type Activity value Assay description Source Reference
IC50 (binding) = 20 nM Inhibitory activity of the compound against spermine synthase ChEMBL. 11141084
IC50 (binding) = 20 nM Inhibitory activity of the compound against spermine synthase ChEMBL. 11141084

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

1 literature reference was collected for this gene.

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