Detailed information for compound 1209002

Basic information

Technical information
  • TDR Targets ID: 1209002
  • Name: 2-(2-tert-butylquinazolin-4-yl)sulfanyl-N-cyc lopentylacetamide
  • MW: 343.486 | Formula: C19H25N3OS
  • H donors: 1 H acceptors: 3 LogP: 4.71 Rotable bonds: 6
    Rule of 5 violations (Lipinski): 1
  • SMILES: O=C(NC1CCCC1)CSc1nc(nc2c1cccc2)C(C)(C)C
  • InChi: 1S/C19H25N3OS/c1-19(2,3)18-21-15-11-7-6-10-14(15)17(22-18)24-12-16(23)20-13-8-4-5-9-13/h6-7,10-11,13H,4-5,8-9,12H2,1-3H3,(H,20,23)
  • InChiKey: FCECGAZXBVSKDJ-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • 2-(2-tert-butylquinazolin-4-yl)sulfanyl-N-cyclopentyl-acetamide
  • 2-[(2-tert-butyl-4-quinazolinyl)thio]-N-cyclopentylacetamide
  • 2-[(2-tert-butylquinazolin-4-yl)thio]-N-cyclopentyl-acetamide
  • 2-(2-tert-butylquinazolin-4-yl)sulfanyl-N-cyclopentyl-ethanamide
  • 2-(2-tert-Butyl-quinazolin-4-ylsulfanyl)-N-cyclopentyl-acetamide
  • ASN 06532207
  • ZINC01342457

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens parathyroid hormone 1 receptor Starlite/ChEMBL No references
Homo sapiens APEX nuclease (multifunctional DNA repair enzyme) 1 Starlite/ChEMBL No references

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Entamoeba histolytica exodeoxyribonuclease III, putative Get druggable targets OG5_126768 All targets in OG5_126768
Trypanosoma cruzi apurinic/apyrimidinic endonuclease Get druggable targets OG5_126768 All targets in OG5_126768
Plasmodium falciparum AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative Get druggable targets OG5_126768 All targets in OG5_126768
Schistosoma japonicum DNA-(apurinic or apyrimidinic site) lyase 2, putative Get druggable targets OG5_126768 All targets in OG5_126768
Trypanosoma cruzi apurinic/apyrimidinic endonuclease, putative Get druggable targets OG5_126768 All targets in OG5_126768
Trypanosoma congolense apurinic/apyrimidinic endonuclease, putative Get druggable targets OG5_126768 All targets in OG5_126768
Schistosoma mansoni ap endonuclease Get druggable targets OG5_126768 All targets in OG5_126768
Schistosoma mansoni ap endonuclease Get druggable targets OG5_126768 All targets in OG5_126768
Mycobacterium ulcerans exodeoxyribonuclease III protein XthA Get druggable targets OG5_126768 All targets in OG5_126768
Giardia lamblia Endonuclease/Exonuclease/phosphatase Get druggable targets OG5_126768 All targets in OG5_126768
Neospora caninum hypothetical protein Get druggable targets OG5_126768 All targets in OG5_126768
Plasmodium berghei AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative Get druggable targets OG5_126768 All targets in OG5_126768
Plasmodium vivax AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative Get druggable targets OG5_126768 All targets in OG5_126768
Toxoplasma gondii exonuclease III APE Get druggable targets OG5_126768 All targets in OG5_126768
Leishmania donovani apurinic/apyrimidinic endonuclease-redox protein Get druggable targets OG5_126768 All targets in OG5_126768
Schistosoma japonicum ko:K10772 AP endonuclease 2, putative Get druggable targets OG5_126768 All targets in OG5_126768
Loa Loa (eye worm) exodeoxyribonuclease III family protein Get druggable targets OG5_126768 All targets in OG5_126768
Schistosoma japonicum DNA-(apurinic or apyrimidinic site) lyase 2, putative Get druggable targets OG5_126768 All targets in OG5_126768
Wolbachia endosymbiont of Brugia malayi exonuclease III Get druggable targets OG5_126768 All targets in OG5_126768
Trichomonas vaginalis ap endonuclease, putative Get druggable targets OG5_126768 All targets in OG5_126768
Schistosoma japonicum ko:K10771 AP endonuclease 1, putative Get druggable targets OG5_126768 All targets in OG5_126768
Trypanosoma brucei apurinic/apyrimidinic endonuclease, putative Get druggable targets OG5_126768 All targets in OG5_126768
Echinococcus multilocularis DNA (apurinic or apyrimidinic site) lyase Get druggable targets OG5_126768 All targets in OG5_126768
Schistosoma japonicum ko:K04588 secretin receptor, putative Get druggable targets OG5_139196 All targets in OG5_139196
Leishmania mexicana apurinic/apyrimidinic endonuclease-redox protein,AP-endonuclease Get druggable targets OG5_126768 All targets in OG5_126768
Leishmania major apurinic/apyrimidinic endonuclease-redox protein Get druggable targets OG5_126768 All targets in OG5_126768
Treponema pallidum exodeoxyribonuclease (exoA) Get druggable targets OG5_126768 All targets in OG5_126768
Candida albicans similar to S. cerevisiae APN2 (YBL019W) DNA repair apurinic/apyrimidinic endonuclease Get druggable targets OG5_126768 All targets in OG5_126768
Plasmodium knowlesi AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative Get druggable targets OG5_126768 All targets in OG5_126768
Theileria parva hypothetical protein Get druggable targets OG5_126768 All targets in OG5_126768
Brugia malayi exodeoxyribonuclease III family protein Get druggable targets OG5_126768 All targets in OG5_126768
Leishmania infantum apurinic/apyrimidinic endonuclease-redox protein Get druggable targets OG5_126768 All targets in OG5_126768
Trichomonas vaginalis ap endonuclease, putative Get druggable targets OG5_126768 All targets in OG5_126768
Leishmania braziliensis apurinic/apyrimidinic endonuclease-redox protein Get druggable targets OG5_126768 All targets in OG5_126768
Candida albicans similar to S. cerevisiae APN2 (YBL019W) DNA repair apurinic/apyrimidinic endonuclease Get druggable targets OG5_126768 All targets in OG5_126768
Echinococcus granulosus DNA apurinic or apyrimidinic site lyase Get druggable targets OG5_126768 All targets in OG5_126768
Plasmodium yoelii putative AP endonuclease-related Get druggable targets OG5_126768 All targets in OG5_126768
Cryptosporidium hominis dna-(apurinic or apyrimidinic site) lyase Get druggable targets OG5_126768 All targets in OG5_126768
Trypanosoma brucei gambiense apurinic/apyrimidinic endonuclease, putative Get druggable targets OG5_126768 All targets in OG5_126768
Mycobacterium tuberculosis Probable exodeoxyribonuclease III protein XthA (exonuclease III) (EXO III) (AP endonuclease VI) Get druggable targets OG5_126768 All targets in OG5_126768
Cryptosporidium parvum conserved hypothetical protein Get druggable targets OG5_126768 All targets in OG5_126768
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
Mycobacterium tuberculosis Probable chain -fatty-acid-CoA ligase FadD13 (fatty-acyl-CoA synthetase) 0.0027 0.0212 0.1311
Entamoeba histolytica acetyltransferase, GNAT family 0.0043 0.0391 1
Schistosoma mansoni hypothetical protein 0.0019 0.0118 0.0495
Trypanosoma brucei DNA polymerase kappa, putative 0.0022 0.0155 0.9464
Echinococcus granulosus histone lysine N methyltransferase MLL3 0.0012 0.0038 0.0091
Loa Loa (eye worm) hypothetical protein 0.002 0.0134 0.0158
Schistosoma mansoni zinc finger protein 0.0017 0.0095 0.0384
Trypanosoma brucei DNA polymerase kappa, putative 0.0022 0.0155 0.9464
Brugia malayi Matrixin family protein 0.0066 0.0648 0.0845
Trypanosoma cruzi DNA polymerase kappa, putative 0.0022 0.0155 0.9316
Echinococcus granulosus bromodomain adjacent to zinc finger domain 0.0072 0.0714 0.2694
Leishmania major 4-coumarate:coa ligase-like protein 0.0027 0.0212 1
Trypanosoma brucei DNA polymerase kappa, putative 0.0022 0.0155 0.9464
Echinococcus granulosus histone acetyltransferase KAT2B 0.0156 0.1658 0.6333
Brugia malayi Pre-SET motif family protein 0.0034 0.0284 0.0322
Mycobacterium tuberculosis Probable exodeoxyribonuclease III protein XthA (exonuclease III) (EXO III) (AP endonuclease VI) 0.0023 0.0159 0.0544
Mycobacterium ulcerans DNA polymerase IV 0.0022 0.0155 0.0304
Echinococcus granulosus cadherin EGF LAG seven pass G type receptor 0.0019 0.0118 0.0398
Echinococcus granulosus dna polymerase eta 0.0022 0.0155 0.054
Mycobacterium ulcerans long-chain-fatty-acid-CoA ligase 0.0027 0.0212 0.115
Loa Loa (eye worm) hypothetical protein 0.0066 0.0648 0.0893
Echinococcus multilocularis methyl CpG binding domain protein 2 0.0019 0.0116 0.0102
Mycobacterium ulcerans hydrolase 0.0081 0.0811 1
Treponema pallidum exodeoxyribonuclease (exoA) 0.0023 0.0159 0.5
Loa Loa (eye worm) pigment dispersing factor receptor c 0.006 0.058 0.0795
Echinococcus granulosus 5'partial|histone lysine N methyltransferase SETDB2 0.0032 0.0262 0.0954
Trypanosoma brucei DNA polymerase kappa, putative 0.0022 0.0155 0.9464
Plasmodium vivax SET domain protein, putative 0.0034 0.0284 0.6123
Echinococcus granulosus histone lysine methyltransferase setb 0.0053 0.0497 0.1858
Brugia malayi acetyltransferase, GNAT family protein 0.0163 0.1738 0.2412
Brugia malayi Pre-SET motif family protein 0.0232 0.2504 0.3512
Schistosoma mansoni cpg binding protein 0.0039 0.0339 0.1555
Trypanosoma brucei DNA polymerase IV, putative 0.0022 0.0155 0.9464
Loa Loa (eye worm) hypothetical protein 0.0043 0.0382 0.0512
Plasmodium falciparum histone acetyltransferase GCN5 0.0043 0.0391 1
Brugia malayi Bromodomain containing protein 0.0089 0.0904 0.1213
Entamoeba histolytica exodeoxyribonuclease III, putative 0.0023 0.0159 0.0187
Brugia malayi Matrixin family protein 0.0066 0.0648 0.0845
Onchocerca volvulus 0.0094 0.0959 0.2821
Loa Loa (eye worm) hypothetical protein 0.0041 0.0366 0.0489
Loa Loa (eye worm) hypothetical protein 0.0049 0.0456 0.0617
Schistosoma mansoni hypothetical protein 0.0017 0.0095 0.0384
Trypanosoma brucei DNA polymerase kappa, putative 0.0022 0.0155 0.9464
Echinococcus multilocularis zinc finger protein 0.0028 0.0214 0.02
Echinococcus multilocularis DNA (apurinic or apyrimidinic site) lyase 0.0023 0.0159 0.0145
Brugia malayi ImpB/MucB/SamB family protein 0.0022 0.0155 0.0135
Leishmania major DNA polymerase kappa, putative,DNA polymerase IV, putative 0.0022 0.0155 0.5117
Trichomonas vaginalis cat eye syndrome critical region protein 2, cscr2, putative 0.005 0.0464 0.1144
Loa Loa (eye worm) matrixin family protein 0.0147 0.1555 0.2189
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.0019 0.0118 0.0398
Loa Loa (eye worm) hypothetical protein 0.002 0.0134 0.0158
Trypanosoma brucei DNA polymerase kappa, putative 0.0022 0.0155 0.9464
Schistosoma mansoni cpg binding protein 0.0039 0.0339 0.1555
Schistosoma mansoni terminal deoxycytidyl transferase 0.0022 0.0155 0.0671
Echinococcus granulosus methyl CpG binding domain protein 2 0.0019 0.0116 0.0393
Mycobacterium ulcerans fatty-acid-CoA ligase 0.0027 0.0212 0.115
Loa Loa (eye worm) ImpB/MucB/SamB family protein 0.0022 0.0155 0.0187
Echinococcus multilocularis terminal deoxycytidyl transferase rev1 0.0022 0.0155 0.014
Echinococcus multilocularis gcn5proteinral control of amino acid synthesis 0.0163 0.1738 0.1726
Trypanosoma cruzi DNA polymerase kappa, putative 0.0022 0.0155 0.9316
Trypanosoma brucei DNA polymerase eta, putative 0.0022 0.0155 0.9464
Loa Loa (eye worm) pre-SET domain-containing protein family protein 0.0232 0.2504 0.3546
Brugia malayi Matrixin family protein 0.0066 0.0648 0.0845
Onchocerca volvulus 0.0034 0.0284 0.0274
Loa Loa (eye worm) hypothetical protein 0.0081 0.0811 0.1125
Plasmodium falciparum AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.0023 0.0159 0.0973
Brugia malayi Matrixin family protein 0.0066 0.0648 0.0845
Echinococcus multilocularis histone lysine methyltransferase setb histone lysine methyltransferase eggless 0.0053 0.0497 0.0483
Schistosoma mansoni ap endonuclease 0.0023 0.0159 0.0692
Brugia malayi Matrixin family protein 0.016 0.1704 0.2362
Loa Loa (eye worm) histone methyltransferase 0.0012 0.0038 0.0021
Entamoeba histolytica acyl-coA synthetase, putative 0.0027 0.0212 0.2425
Brugia malayi Bromodomain containing protein 0.0046 0.0425 0.0524
Schistosoma mansoni hypothetical protein 0.0019 0.0118 0.0495
Mycobacterium ulcerans long-chain-fatty-acid--CoA ligase 0.0027 0.0212 0.115
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.0019 0.0118 0.0104
Loa Loa (eye worm) hypothetical protein 0.0027 0.0212 0.0269
Onchocerca volvulus Matrix metalloproteinase homolog 0.0147 0.1555 0.5068
Echinococcus granulosus GPCR family 2 0.0019 0.0118 0.0398
Brugia malayi AMP-binding enzyme family protein 0.0027 0.0212 0.0218
Schistosoma mansoni hypothetical protein 0.0094 0.0959 0.4524
Echinococcus granulosus dna polymerase kappa 0.0022 0.0155 0.054
Plasmodium vivax AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.0023 0.0159 0.3424
Echinococcus multilocularis GPCR, family 2 0.0019 0.0118 0.0104
Schistosoma mansoni bromodomain containing protein 0.0076 0.0758 0.3562
Mycobacterium ulcerans acyl-CoA synthetase 0.0027 0.0212 0.115
Mycobacterium ulcerans acyl-CoA synthetase 0.0027 0.0212 0.115
Brugia malayi Hemopexin family protein 0.0094 0.0959 0.1292
Trypanosoma cruzi apurinic/apyrimidinic endonuclease, putative 0.0023 0.0159 1
Mycobacterium tuberculosis Possible DNA-damage-inducible protein P DinP (DNA polymerase V) (pol IV 2) (DNA nucleotidyltransferase (DNA-directed)) 0.0022 0.0155 0.048
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0053 0.0497 0.2308
Schistosoma mansoni polycystin 1-related 0.0027 0.0209 0.0931
Brugia malayi exodeoxyribonuclease III family protein 0.0023 0.0159 0.0142
Echinococcus multilocularis dna polymerase eta 0.0022 0.0155 0.014
Loa Loa (eye worm) hypothetical protein 0.0019 0.0118 0.0135
Schistosoma mansoni matrix metallopeptidase-7 (M10 family) 0.0066 0.0648 0.3035
Brugia malayi Angiotensin-converting enzyme family protein 0.0634 0.7017 1
Mycobacterium ulcerans DNA polymerase IV 0.0022 0.0155 0.0304
Schistosoma mansoni bromodomain containing protein 0.0011 0.0024 0.0045
Echinococcus multilocularis bromodomain adjacent to zinc finger domain 0.004 0.0351 0.0337
Mycobacterium ulcerans exodeoxyribonuclease III protein XthA 0.0023 0.0159 0.0369
Trypanosoma cruzi apurinic/apyrimidinic endonuclease 0.0023 0.0159 1
Trypanosoma brucei apurinic/apyrimidinic endonuclease, putative 0.0023 0.0159 1
Schistosoma mansoni hypothetical protein 0.0196 0.2103 1
Loa Loa (eye worm) bromodomain containing protein 0.0024 0.0168 0.0207
Loa Loa (eye worm) hypothetical protein 0.002 0.0134 0.0158
Loa Loa (eye worm) hypothetical protein 0.002 0.0134 0.0158
Loa Loa (eye worm) hypothetical protein 0.0066 0.0648 0.0893
Echinococcus granulosus matrix metallopeptidase 7 M10 family 0.0241 0.261 1
Trypanosoma brucei ISWI complex protein 0.0017 0.0095 0.2162
Trichomonas vaginalis set domain proteins, putative 0.0264 0.2862 1
Schistosoma mansoni methyl-cpg binding protein mbd 0.0019 0.0116 0.0488
Mycobacterium ulcerans hypothetical protein 0.0027 0.0212 0.115
Schistosoma mansoni zinc finger protein 0.0028 0.0214 0.0956
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.0019 0.0118 0.0083
Trichomonas vaginalis ap endonuclease, putative 0.0023 0.0159 0.0016
Trypanosoma brucei DNA polymerase IV, putative 0.0022 0.0155 0.9464
Echinococcus granulosus histone acetyltransferase KAT2B 0.005 0.0464 0.1733
Trypanosoma brucei unspecified product 0.0022 0.0155 0.9464
Brugia malayi ImpB/MucB/SamB family protein 0.0022 0.0155 0.0135
Trypanosoma brucei DNA polymerase kappa, putative 0.0022 0.0155 0.9464
Brugia malayi Matrix metalloprotease, N-terminal domain containing protein 0.0081 0.0811 0.1078
Leishmania major DNA polymerase kappa, putative 0.0022 0.0155 0.5117
Schistosoma mansoni hypothetical protein 0.0023 0.0161 0.0702
Loa Loa (eye worm) hypothetical protein 0.0022 0.0155 0.0187
Brugia malayi PHD-finger family protein 0.0034 0.0281 0.0317
Echinococcus multilocularis histone lysine N methyltransferase SETMAR 0.0034 0.0284 0.027
Mycobacterium ulcerans long-chain fatty-acid CoA ligase 0.0027 0.0212 0.115
Echinococcus granulosus geminin 0.0196 0.2103 0.8047
Mycobacterium tuberculosis Probable peptidoglycan hydrolase 0.0081 0.0811 1
Loa Loa (eye worm) hypothetical protein 0.0066 0.0648 0.0893
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0053 0.0497 0.2308
Giardia lamblia Endonuclease/Exonuclease/phosphatase 0.0023 0.0159 0.0187
Toxoplasma gondii histone lysine acetyltransferase GCN5-A 0.005 0.0464 0.5358
Echinococcus multilocularis histone lysine N methyltransferase MLL3 0.0012 0.0038 0.0024
Brugia malayi AMP-binding enzyme family protein 0.0027 0.0212 0.0218
Trichomonas vaginalis bromodomain-containing protein, putative 0.005 0.0464 0.1144
Echinococcus multilocularis cadherin EGF LAG seven pass G type receptor 0.0019 0.0118 0.0104
Toxoplasma gondii histone lysine methyltransferase SET1 0.0073 0.0729 1
Onchocerca volvulus 0.0066 0.0648 0.1647
Schistosoma mansoni ap endonuclease 0.0023 0.0159 0.0692
Plasmodium vivax histone acetyltransferase GCN5, putative 0.005 0.0464 1
Echinococcus multilocularis geminin 0.0196 0.2103 0.2092
Wolbachia endosymbiont of Brugia malayi extracellular metallopeptidase 0.0309 0.3373 1
Schistosoma mansoni methyl-cpg binding protein mbd 0.0019 0.0116 0.0488
Loa Loa (eye worm) hypothetical protein 0.0078 0.0785 0.1088
Mycobacterium leprae PROBABLE HYDROLASE 0.0081 0.0811 1
Echinococcus granulosus zinc finger protein 0.0028 0.0214 0.077
Mycobacterium tuberculosis Conserved hypothetical protein 0.0022 0.0155 0.048
Trypanosoma brucei DNA polymerase kappa, putative 0.0022 0.0155 0.9464
Loa Loa (eye worm) hypothetical protein 0.002 0.0134 0.0158
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0034 0.0284 0.1292
Onchocerca volvulus 0.0264 0.2862 1
Echinococcus multilocularis cpg binding protein 0.0039 0.0339 0.0325
Trypanosoma cruzi DNA polymerase kappa, putative 0.0022 0.0155 0.9316
Schistosoma mansoni acetyl-CoA C-acetyltransferase 0.0027 0.0207 0.0922
Brugia malayi Latrophilin receptor protein 2 0.0019 0.0118 0.0083
Mycobacterium ulcerans acyl-CoA synthetase 0.0027 0.0212 0.115
Entamoeba histolytica acyl-CoA synthetase, putative 0.0027 0.0212 0.2425
Echinococcus granulosus DNA apurinic or apyrimidinic site lyase 0.0023 0.0159 0.0557
Trichomonas vaginalis ap endonuclease, putative 0.0023 0.0159 0.0016
Echinococcus multilocularis fetal alzheimer antigen, falz 0.0027 0.0207 0.0193
Echinococcus multilocularis dna polymerase kappa 0.0022 0.0155 0.014
Schistosoma mansoni hypothetical protein 0.0019 0.0118 0.0495
Loa Loa (eye worm) hypothetical protein 0.0027 0.0212 0.0269
Plasmodium vivax acyl-CoA synthetase, putative 0.002 0.0134 0.2887
Loa Loa (eye worm) CXXC zinc finger family protein 0.0035 0.0293 0.0385
Trypanosoma brucei DNA polymerase kappa, putative 0.0022 0.0155 0.9464
Trypanosoma brucei DNA polymerase kappa, putative 0.0022 0.0155 0.9464
Toxoplasma gondii histone lysine acetyltransferase GCN5-B 0.005 0.0464 0.5358
Loa Loa (eye worm) hypothetical protein 0.0053 0.0502 0.0683
Loa Loa (eye worm) hypothetical protein 0.0053 0.0497 0.0676
Mycobacterium tuberculosis Fatty-acid-AMP ligase FadD30 (fatty-acid-AMP synthetase) (fatty-acid-AMP synthase) 0.002 0.0134 0.0182
Trypanosoma brucei DNA polymerase IV, putative 0.0022 0.0155 0.9464
Loa Loa (eye worm) hypothetical protein 0.0027 0.0212 0.0269
Schistosoma mansoni rab geranylgeranyl transferase alpha subunit 0.0022 0.0155 0.0671
Trypanosoma cruzi DNA polymerase kappa, putative 0.0022 0.0155 0.9316
Loa Loa (eye worm) matrixin family protein 0.016 0.1704 0.2402
Leishmania major 4-coumarate:coa ligase-like protein 0.0027 0.0212 1
Onchocerca volvulus Matrilysin homolog 0.0066 0.0648 0.1647
Brugia malayi AMP-binding enzyme family protein 0.0027 0.0212 0.0218
Loa Loa (eye worm) acetyltransferase 0.0163 0.1738 0.2452
Leishmania major apurinic/apyrimidinic endonuclease-redox protein 0.0023 0.0159 0.5493
Schistosoma mansoni histone-lysine n-methyltransferase suv9 0.0034 0.0284 0.1292
Echinococcus granulosus fetal alzheimer antigen falz 0.0027 0.0207 0.0742
Schistosoma mansoni hypothetical protein 0.0019 0.0118 0.0495
Loa Loa (eye worm) matrix metalloproteinase 0.0066 0.0648 0.0893
Onchocerca volvulus 0.0035 0.0293 0.0308
Schistosoma mansoni cpg binding protein 0.0035 0.0293 0.1335
Echinococcus multilocularis matrix metallopeptidase 7 (M10 family) 0.0241 0.261 0.2599
Leishmania major DNA polymerase eta, putative 0.0022 0.0155 0.5117
Trypanosoma cruzi DNA polymerase eta, putative 0.0022 0.0155 0.9316
Toxoplasma gondii histone lysine methyltransferase SET/SUV39 0.0034 0.0284 0.2199
Schistosoma mansoni DNA polymerase eta 0.0022 0.0155 0.0671
Schistosoma mansoni gcn5proteinral control of amino-acid synthesis 5-like 2 gcnl2 0.0163 0.1738 0.8253
Echinococcus granulosus terminal deoxycytidyl transferase rev1 0.0022 0.0155 0.054
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD2 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0027 0.0212 0.1311
Loa Loa (eye worm) hypothetical protein 0.006 0.058 0.0795
Echinococcus granulosus cpg binding protein 0.0039 0.0339 0.1251
Giardia lamblia Histone acetyltransferase GCN5 0.0043 0.0391 1
Echinococcus granulosus bromodomain adjacent to zinc finger domain 0.004 0.0351 0.1298
Loa Loa (eye worm) PHD-finger family protein 0.0023 0.0161 0.0196
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.006 0.058 0.0746
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0075 0.0743 0.3489
Schistosoma mansoni hypothetical protein 0.0196 0.2103 1
Brugia malayi Calcitonin receptor-like protein seb-1 0.006 0.058 0.0746
Onchocerca volvulus Matrilysin homolog 0.0147 0.1555 0.5068
Loa Loa (eye worm) exodeoxyribonuclease III family protein 0.0023 0.0159 0.0193
Loa Loa (eye worm) angiotensin-converting enzyme family protein 0.0634 0.7017 1
Brugia malayi CXXC zinc finger family protein 0.0035 0.0293 0.0335
Schistosoma mansoni hypothetical protein 0.0041 0.0366 0.1683
Entamoeba histolytica acyl-CoA synthetase, putative 0.0027 0.0212 0.2425
Brugia malayi latrophilin 2 splice variant baaae 0.0041 0.0366 0.0439
Echinococcus multilocularis bromodomain adjacent to zinc finger domain 0.0072 0.0714 0.07
Chlamydia trachomatis acylglycerophosphoethanolamine acyltransferase 0.002 0.0134 0.5
Leishmania major 4-coumarate:coa ligase-like protein 0.0027 0.0212 1
Loa Loa (eye worm) latrophilin receptor protein 2 0.0019 0.0118 0.0135

Activities

Activity type Activity value Assay description Source Reference
Potency (functional) 5.3233 uM PubChem BioAssay. qHTS Assay for Inhibitors of the Human Apurinic/apyrimidinic Endonuclease 1 (APE1). (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 7.3048 uM PUBCHEM_BIOASSAY: qHTS for Inhibitors of binding or entry into cells for Lassa Virus. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID463114, AID540249] ChEMBL. No reference
Potency (functional) 15.8489 uM PubChem BioAssay. qHTS of PTHR Inhibitors: Primary Screen. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) = 22.3872 um PUBCHEM_BIOASSAY: qHTS Assay for Agonists of the Relaxin Receptor RXFP1. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 22.3872 uM PUBCHEM_BIOASSAY: qHTS for Inhibitors of TGF-b: Cytotox Counterscreen. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID588855, AID588860] ChEMBL. No reference
Potency (functional) 25.1189 uM PUBCHEM_BIOASSAY: qHTS for Inhibitors of TGF-b. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID588856, AID588860] ChEMBL. No reference
Potency (functional) 35.4813 uM PubChem BioAssay. qHTS of TDP-43 Inhibitors. (Class of assay: confirmatory) ChEMBL. No reference

Phenotypes

Whole-cell/tissue/organism interactions

Species name Source Reference Is orphan
Homo sapiens 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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