Detailed information for compound 1453753

Basic information

Technical information
  • TDR Targets ID: 1453753
  • Name: 5-oxo-2-(phenylamino)-N-(thiophen-2-ylmethyl) -[1,3,4]thiadiazolo[2,3-b]quinazoline-8-carbo xamide
  • MW: 433.506 | Formula: C21H15N5O2S2
  • H donors: 2 H acceptors: 2 LogP: 3.52 Rotable bonds: 6
    Rule of 5 violations (Lipinski): 1
  • SMILES: O=C(c1ccc2c(c1)nc1n(c2=O)nc(s1)Nc1ccccc1)NCc1cccs1
  • InChi: 1S/C21H15N5O2S2/c27-18(22-12-15-7-4-10-29-15)13-8-9-16-17(11-13)24-21-26(19(16)28)25-20(30-21)23-14-5-2-1-3-6-14/h1-11H,12H2,(H,22,27)(H,23,25)
  • InChiKey: BBOIWRCLFPLFMR-UHFFFAOYSA-N  


Substructure search Similarity search

Network

Hover on a compound node to display the structore

Synonyms

  • 5-oxo-2-(phenylamino)-N-(2-thienylmethyl)-[1,3,4]thiadiazolo[2,3-b]quinazoline-8-carboxamide
  • 5-keto-2-(phenylamino)-N-(2-thienylmethyl)-[1,3,4]thiadiazolo[2,3-b]quinazoline-8-carboxamide
  • K284-7846
  • NCGC00138831-01

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens polymerase (DNA directed), beta Starlite/ChEMBL No references
Homo sapiens glucagon-like peptide 1 receptor Starlite/ChEMBL No references
Homo sapiens apolipoprotein B mRNA editing enzyme, catalytic polypeptide-like 3G Starlite/ChEMBL No references
Homo sapiens Werner syndrome, RecQ helicase-like Starlite/ChEMBL No references
Homo sapiens SMAD family member 2 Starlite/ChEMBL No references
Homo sapiens lamin A/C Starlite/ChEMBL No references
Homo sapiens tumor protein p53 Starlite/ChEMBL No references
Homo sapiens apolipoprotein B mRNA editing enzyme, catalytic polypeptide-like 3D Starlite/ChEMBL No references
Homo sapiens Bloom syndrome, RecQ helicase-like Starlite/ChEMBL No references
Homo sapiens microtubule-associated protein tau Starlite/ChEMBL No references

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Echinococcus multilocularis tumor protein p63 Get druggable targets OG5_140038 All targets in OG5_140038
Echinococcus multilocularis microtubule associated protein 2 Get druggable targets OG5_133504 All targets in OG5_133504
Schistosoma japonicum ko:K07611 lamin, putative Get druggable targets OG5_128723 All targets in OG5_128723
Brugia malayi intermediate filament protein Get druggable targets OG5_128723 All targets in OG5_128723
Echinococcus granulosus lamin Get druggable targets OG5_128723 All targets in OG5_128723
Leishmania donovani ATP-dependent DEAD/H DNA helicase recQ, putative Get druggable targets OG5_126644 All targets in OG5_126644
Leishmania mexicana mitochondrial DNA polymerase beta Get druggable targets OG5_130965 All targets in OG5_130965
Cryptosporidium parvum RecQ bloom helicase (RNA helicase+hrdc) Get druggable targets OG5_126644 All targets in OG5_126644
Giardia lamblia Sgs1 DNA helicase, putative Get druggable targets OG5_126644 All targets in OG5_126644
Loa Loa (eye worm) intermediate filament tail domain-containing protein Get druggable targets OG5_128723 All targets in OG5_128723
Echinococcus multilocularis lamin Get druggable targets OG5_128723 All targets in OG5_128723
Schistosoma mansoni lamin Get druggable targets OG5_128723 All targets in OG5_128723
Onchocerca volvulus Get druggable targets OG5_128723 All targets in OG5_128723
Schistosoma mansoni DNA helicase recq5 Get druggable targets OG5_126644 All targets in OG5_126644
Mycobacterium ulcerans hypothetical protein Get druggable targets OG5_130965 All targets in OG5_130965
Loa Loa (eye worm) RecQ helicase Get druggable targets OG5_126644 All targets in OG5_126644
Echinococcus granulosus bloom syndrome protein Get druggable targets OG5_126644 All targets in OG5_126644
Echinococcus granulosus tumor protein p63 Get druggable targets OG5_140038 All targets in OG5_140038
Leishmania major ATP-dependent DEAD/H DNA helicase recQ, putative Get druggable targets OG5_126644 All targets in OG5_126644
Trypanosoma cruzi ATP-dependent DEAD/H DNA helicase recQ, putative Get druggable targets OG5_126644 All targets in OG5_126644
Echinococcus multilocularis musashi Get druggable targets OG5_128723 All targets in OG5_128723
Schistosoma mansoni intermediate filament proteins Get druggable targets OG5_128723 All targets in OG5_128723
Plasmodium knowlesi ATP-dependent DNA helicase Q1, putative Get druggable targets OG5_126644 All targets in OG5_126644
Schistosoma japonicum ko:K03654 ATP-dependent DNA helicase RecQ, putative Get druggable targets OG5_126644 All targets in OG5_126644
Brugia malayi ATP-dependent DNA helicase, RecQ family protein Get druggable targets OG5_126644 All targets in OG5_126644
Candida albicans DNA helicase Get druggable targets OG5_126644 All targets in OG5_126644
Plasmodium knowlesi ADP-dependent DNA helicase RecQ, putative Get druggable targets OG5_126644 All targets in OG5_126644
Trypanosoma cruzi mitochondrial DNA polymerase beta, putative Get druggable targets OG5_130965 All targets in OG5_130965
Trichomonas vaginalis DNA helicase recq, putative Get druggable targets OG5_126644 All targets in OG5_126644
Plasmodium vivax ADP-dependent DNA helicase RecQ, putative Get druggable targets OG5_126644 All targets in OG5_126644
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_126644 All targets in OG5_126644
Leishmania infantum mitochondrial DNA polymerase beta Get druggable targets OG5_130965 All targets in OG5_130965
Neospora caninum hypothetical protein Get druggable targets OG5_126644 All targets in OG5_126644
Echinococcus multilocularis bloom syndrome protein Get druggable targets OG5_126644 All targets in OG5_126644
Cryptosporidium hominis DEAD/DEAH box helicase Get druggable targets OG5_126644 All targets in OG5_126644
Echinococcus granulosus ATP dependent DNA helicase Q5 Get druggable targets OG5_126644 All targets in OG5_126644
Trypanosoma cruzi mitochondrial DNA polymerase beta, putative Get druggable targets OG5_130965 All targets in OG5_130965
Schistosoma japonicum Intermediate filament protein ifa-1, putative Get druggable targets OG5_128723 All targets in OG5_128723
Brugia malayi Intermediate filament tail domain containing protein Get druggable targets OG5_128723 All targets in OG5_128723
Loa Loa (eye worm) intermediate filament protein Get druggable targets OG5_128723 All targets in OG5_128723
Echinococcus multilocularis cytoplasmic intermediate filament protein Get druggable targets OG5_128723 All targets in OG5_128723
Echinococcus multilocularis ATP dependent DNA helicase Q5 Get druggable targets OG5_126644 All targets in OG5_126644
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_128723 All targets in OG5_128723
Loa Loa (eye worm) transcription factor SMAD2 Get druggable targets OG5_131716 All targets in OG5_131716
Brugia malayi Bloom's syndrome protein homolog Get druggable targets OG5_126644 All targets in OG5_126644
Schistosoma japonicum Lamin-C, putative Get druggable targets OG5_128723 All targets in OG5_128723
Toxoplasma gondii ATP-dependent DNA helicase, RecQ family protein Get druggable targets OG5_126644 All targets in OG5_126644
Schistosoma mansoni lamin Get druggable targets OG5_128723 All targets in OG5_128723
Loa Loa (eye worm) MH2 domain-containing protein Get druggable targets OG5_131716 All targets in OG5_131716
Echinococcus granulosus intermediate filament protein Get druggable targets OG5_128723 All targets in OG5_128723
Babesia bovis ATP-dependent DNA helicase, RecQ family protein Get druggable targets OG5_126644 All targets in OG5_126644
Mycobacterium tuberculosis Conserved hypothetical protein Get druggable targets OG5_130965 All targets in OG5_130965
Echinococcus granulosus microtubule associated protein 2 Get druggable targets OG5_133504 All targets in OG5_133504
Trypanosoma brucei gambiense ATP-dependent DEAD/H DNA helicase recQ, putative Get druggable targets OG5_126644 All targets in OG5_126644
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_126644 All targets in OG5_126644
Trypanosoma brucei ATP-dependent DEAD/H DNA helicase recQ, putative Get druggable targets OG5_126644 All targets in OG5_126644
Plasmodium falciparum ATP-dependent DNA helicase Q1 Get druggable targets OG5_126644 All targets in OG5_126644
Toxoplasma gondii ATP-dependent DNA helicase, RecQ family protein Get druggable targets OG5_126644 All targets in OG5_126644
Schistosoma japonicum expressed protein Get druggable targets OG5_128723 All targets in OG5_128723
Entamoeba histolytica recQ family helicase, putative Get druggable targets OG5_126644 All targets in OG5_126644
Toxoplasma gondii ATP-dependent DNA helicase, RecQ family protein Get druggable targets OG5_126644 All targets in OG5_126644
Echinococcus granulosus cytoplasmic intermediate filament protein Get druggable targets OG5_128723 All targets in OG5_128723
Schistosoma japonicum ko:K04380 microtubule-associated protein tau, putative Get druggable targets OG5_133504 All targets in OG5_133504
Trypanosoma congolense mitochondrial DNA polymerase beta, putative Get druggable targets OG5_130965 All targets in OG5_130965
Echinococcus granulosus lamin dm0 Get druggable targets OG5_128723 All targets in OG5_128723
Entamoeba histolytica recQ family DNA helicase Get druggable targets OG5_126644 All targets in OG5_126644
Leishmania infantum ATP-dependent DEAD/H DNA helicase recQ, putative Get druggable targets OG5_126644 All targets in OG5_126644
Trypanosoma cruzi ATP-dependent DEAD/H DNA helicase recQ, putative Get druggable targets OG5_126644 All targets in OG5_126644
Schistosoma mansoni DNA helicase recq1 Get druggable targets OG5_126644 All targets in OG5_126644
Onchocerca volvulus Get druggable targets OG5_128723 All targets in OG5_128723
Leishmania braziliensis ATP-dependent DEAD/H DNA helicase recQ, putative Get druggable targets OG5_126644 All targets in OG5_126644
Trichomonas vaginalis DNA helicase recq1, putative Get druggable targets OG5_126644 All targets in OG5_126644
Schistosoma japonicum Bloom syndrome protein homolog, putative Get druggable targets OG5_126644 All targets in OG5_126644
Leishmania major mitochondrial DNA polymerase beta Get druggable targets OG5_130965 All targets in OG5_130965
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_128723 All targets in OG5_128723
Leishmania donovani mitochondrial DNA polymerase beta Get druggable targets OG5_130965 All targets in OG5_130965
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_128723 All targets in OG5_128723
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_128723 All targets in OG5_128723
Echinococcus granulosus ATP dependent DNA helicase Q1 Get druggable targets OG5_126644 All targets in OG5_126644
Schistosoma mansoni microtubule-associated protein tau Get druggable targets OG5_133504 All targets in OG5_133504
Trypanosoma cruzi ATP-dependent DEAD/H DNA helicase recQ, putative Get druggable targets OG5_126644 All targets in OG5_126644
Babesia bovis ATP-dependent DNA helicase, RecQ family protein Get druggable targets OG5_126644 All targets in OG5_126644
Leishmania mexicana ATP-dependent DEAD/H DNA helicase recQ, putative Get druggable targets OG5_126644 All targets in OG5_126644
Echinococcus multilocularis lamin dm0 Get druggable targets OG5_128723 All targets in OG5_128723
Plasmodium berghei ADP-dependent DNA helicase RecQ, putative Get druggable targets OG5_126644 All targets in OG5_126644
Trichomonas vaginalis DNA helicase recq, putative Get druggable targets OG5_126644 All targets in OG5_126644
Trypanosoma brucei gambiense mitochondrial DNA polymerase beta Get druggable targets OG5_130965 All targets in OG5_130965
Plasmodium yoelii ATP-dependent DNA helicase-related Get druggable targets OG5_126644 All targets in OG5_126644
Plasmodium falciparum ADP-dependent DNA helicase RecQ Get druggable targets OG5_126644 All targets in OG5_126644
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_128723 All targets in OG5_128723
Theileria parva DNA helicase, putative Get druggable targets OG5_126644 All targets in OG5_126644
Trypanosoma brucei mitochondrial DNA polymerase beta Get druggable targets OG5_130965 All targets in OG5_130965
Schistosoma mansoni blooms syndrome DNA helicase Get druggable targets OG5_126644 All targets in OG5_126644
Schistosoma japonicum expressed protein Get druggable targets OG5_128723 All targets in OG5_128723
Leishmania braziliensis mitochondrial DNA polymerase beta Get druggable targets OG5_130965 All targets in OG5_130965
Theileria parva hypothetical protein Get druggable targets OG5_126644 All targets in OG5_126644
Candida albicans DNA helicase Get druggable targets OG5_126644 All targets in OG5_126644
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_126644 All targets in OG5_126644
Brugia malayi MH2 domain containing protein Get druggable targets OG5_131716 All targets in OG5_131716
Loa Loa (eye worm) ATP-dependent DNA helicase Get druggable targets OG5_126644 All targets in OG5_126644
Echinococcus multilocularis ATP dependent DNA helicase Q1 Get druggable targets OG5_126644 All targets in OG5_126644
Treponema pallidum ATP-dependent DNA helicase Get druggable targets OG5_126644 All targets in OG5_126644
Brugia malayi ATP-dependent DNA helicase, RecQ family protein Get druggable targets OG5_126644 All targets in OG5_126644
Neospora caninum hypothetical protein Get druggable targets OG5_126644 All targets in OG5_126644
Plasmodium yoelii ATP-dependent DNA helicase recQ-related Get druggable targets OG5_126644 All targets in OG5_126644
Plasmodium berghei ATP-dependent DNA helicase Q1, putative Get druggable targets OG5_126644 All targets in OG5_126644
By sequence similarity to non orthologous known druggable targets
Species Potential target Known druggable target Length Alignment span Identity
Loa Loa (eye worm) pigment dispersing factor receptor c glucagon-like peptide 1 receptor 463 aa 388 aa 25.8 %
Brugia malayi MH2 domain containing protein SMAD family member 2 467 aa 405 aa 31.6 %
Trypanosoma cruzi mitochondrial DNA polymerase beta-PAK, putative polymerase (DNA directed), beta 335 aa 303 aa 32.3 %
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Brugia malayi ATP-dependent DNA helicase, RecQ family protein 0.0023 0.0091 0.0107
Echinococcus multilocularis cadherin EGF LAG seven pass G type receptor 0.012 0.1278 0.1272
Leishmania major mitochondrial DNA polymerase beta 0.0365 0.4273 1
Brugia malayi MH2 domain containing protein 0.0019 0.0044 0.0043
Echinococcus granulosus lamin 0.0033 0.0213 0.0206
Loa Loa (eye worm) MH2 domain-containing protein 0.0019 0.0044 0.006
Loa Loa (eye worm) RNA binding protein 0.0598 0.7122 0.9705
Loa Loa (eye worm) MH2 domain-containing protein 0.0042 0.0328 0.0447
Brugia malayi MH2 domain containing protein 0.0042 0.0328 0.043
Brugia malayi MH2 domain containing protein 0.0616 0.7338 1
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.012 0.1278 0.1272
Brugia malayi RNA recognition motif domain containing protein 0.0598 0.7122 0.9704
Echinococcus granulosus bloom syndrome protein 0.0055 0.0484 0.0477
Loa Loa (eye worm) hypothetical protein 0.0166 0.185 0.2521
Schistosoma mansoni smad1 5 8 and 0.0042 0.0328 0.0315
Schistosoma mansoni hypothetical protein 0.012 0.1278 0.1267
Brugia malayi Bloom's syndrome protein homolog 0.0055 0.0484 0.0644
Schistosoma mansoni blooms syndrome DNA helicase 0.0043 0.0344 0.0331
Trypanosoma cruzi PAB1-binding protein , putative 0.0053 0.0467 0.1066
Echinococcus multilocularis TGF beta signal transducer SmadC 0.0042 0.0328 0.0321
Echinococcus multilocularis isocitrate dehydrogenase 2 (NADP+) 0.0016 0.0013 0.0006
Echinococcus multilocularis GPCR, family 2 0.012 0.1278 0.1272
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.012 0.1278 0.1728
Schistosoma mansoni TGF-beta signal transducer Smad2 0.0042 0.0328 0.0315
Brugia malayi MH1 domain containing protein 0.0042 0.0328 0.043
Loa Loa (eye worm) hypothetical protein 0.0023 0.0099 0.0134
Mycobacterium tuberculosis Conserved hypothetical protein 0.0192 0.2163 1
Brugia malayi MH1 domain containing protein 0.0042 0.0328 0.043
Brugia malayi hypothetical protein 0.0053 0.0467 0.062
Schistosoma mansoni DNA helicase recq5 0.0023 0.0091 0.0079
Loa Loa (eye worm) hypothetical protein 0.0032 0.0206 0.0281
Leishmania major mitochondrial DNA polymerase beta-PAK, putative 0.0173 0.1925 0.4488
Echinococcus multilocularis NADP dependent isocitrate dehydrogenase 0.0016 0.0013 0.0006
Loa Loa (eye worm) MH1 domain-containing protein 0.0042 0.0328 0.0447
Loa Loa (eye worm) RecQ helicase 0.0055 0.0484 0.066
Loa Loa (eye worm) intermediate filament protein 0.0033 0.0213 0.0291
Echinococcus multilocularis mothers against decapentaplegic 2 0.0019 0.0044 0.0037
Echinococcus granulosus mothers against decapentaplegic 5 0.0042 0.0328 0.0321
Plasmodium vivax ataxin-2 like protein, putative 0.0053 0.0467 1
Echinococcus multilocularis ATP dependent DNA helicase Q1 0.0023 0.0091 0.0084
Brugia malayi ATP-dependent DNA helicase, RecQ family protein 0.0023 0.0091 0.0107
Echinococcus granulosus TGF beta signal transducer SmadC 0.0042 0.0328 0.0321
Echinococcus granulosus lamin dm0 0.0033 0.0213 0.0206
Trypanosoma cruzi DNA polymerase beta thumb, putative 0.0051 0.0442 0.1007
Brugia malayi Smad1 0.0042 0.0328 0.043
Echinococcus granulosus tar DNA binding protein 0.0598 0.7122 0.712
Loa Loa (eye worm) hypothetical protein 0.0016 0.0007 0.001
Echinococcus granulosus ATP dependent DNA helicase Q1 0.0023 0.0091 0.0084
Schistosoma mansoni tar DNA-binding protein 0.0598 0.7122 0.7118
Schistosoma mansoni smad1 5 8 and 0.0042 0.0328 0.0315
Toxoplasma gondii ATP-dependent DNA helicase, RecQ family protein 0.0023 0.0091 0.1508
Brugia malayi MH1 domain containing protein 0.0023 0.0099 0.0117
Trichomonas vaginalis DNA helicase recq, putative 0.0055 0.0484 1
Echinococcus granulosus cadherin EGF LAG seven pass G type receptor 0.012 0.1278 0.1272
Brugia malayi mothers against decapentaplegic homolog 3 0.0019 0.0044 0.0043
Loa Loa (eye worm) ATP-dependent DNA helicase 0.0023 0.0091 0.0125
Loa Loa (eye worm) hypothetical protein 0.012 0.1278 0.1742
Loa Loa (eye worm) Smad1 0.0042 0.0328 0.0447
Trypanosoma cruzi mitochondrial DNA polymerase beta-PAK, putative 0.0062 0.0579 0.1329
Schistosoma mansoni microtubule-associated protein tau 0.0833 1 1
Schistosoma mansoni tar DNA-binding protein 0.0598 0.7122 0.7118
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0378 0.444 0.605
Schistosoma mansoni hypothetical protein 0.012 0.1278 0.1267
Brugia malayi RNA binding protein 0.0598 0.7122 0.9704
Toxoplasma gondii LsmAD domain-containing protein 0.0053 0.0467 0.8711
Plasmodium falciparum ataxin-2 like protein, putative 0.0053 0.0467 1
Loa Loa (eye worm) hypothetical protein 0.006 0.0545 0.0743
Onchocerca volvulus Rap guanine nucleotide exchange factor 1 homolog 0.0185 0.2073 0.4795
Echinococcus granulosus mothers against decapentaplegic 6 0.0019 0.0044 0.0037
Schistosoma mansoni DNA helicase recq1 0.0023 0.0091 0.0079
Echinococcus multilocularis tar DNA binding protein 0.0598 0.7122 0.712
Echinococcus multilocularis smad 0.0042 0.0328 0.0321
Schistosoma mansoni lamin 0.0033 0.0213 0.0201
Plasmodium falciparum ADP-dependent DNA helicase RecQ 0.0048 0.0403 0.8595
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0378 0.444 0.6043
Loa Loa (eye worm) intermediate filament tail domain-containing protein 0.0033 0.0213 0.0291
Echinococcus granulosus GPCR family 2 0.012 0.1278 0.1272
Loa Loa (eye worm) latrophilin receptor protein 2 0.012 0.1278 0.1742
Schistosoma mansoni Smad4 0.0019 0.0044 0.0032
Brugia malayi Calcitonin receptor-like protein seb-1 0.0378 0.444 0.6043
Onchocerca volvulus 0.0365 0.4276 1
Loa Loa (eye worm) cytoplasmic intermediate filament protein 0.0017 0.0028 0.0039
Leishmania major hypothetical protein, conserved 0.0053 0.0467 0.1066
Onchocerca volvulus 0.006 0.0545 0.1184
Trichomonas vaginalis DNA helicase recq1, putative 0.0055 0.0484 1
Echinococcus multilocularis ATP dependent DNA helicase Q5 0.0023 0.0091 0.0084
Echinococcus multilocularis Ataxin 2, N terminal,domain containing protein 0.0024 0.0108 0.01
Echinococcus granulosus ATP dependent DNA helicase Q5 0.0023 0.0091 0.0084
Loa Loa (eye worm) hypothetical protein 0.0023 0.0091 0.0125
Echinococcus multilocularis NADP dependent isocitrate dehydrogenase 0.0016 0.0013 0.0006
Echinococcus multilocularis lamin 0.0033 0.0213 0.0206
Onchocerca volvulus 0.0033 0.0213 0.0399
Loa Loa (eye worm) hypothetical protein 0.0259 0.2976 0.4056
Echinococcus multilocularis musashi 0.0033 0.0213 0.0206
Loa Loa (eye worm) hypothetical protein 0.0365 0.4276 0.5826
Schistosoma mansoni smad 0.0042 0.0328 0.0315
Brugia malayi MH2 domain containing protein 0.0042 0.0328 0.043
Plasmodium falciparum ataxin-2 like protein, putative 0.0053 0.0467 1
Loa Loa (eye worm) hypothetical protein 0.0185 0.2073 0.2825
Echinococcus granulosus tumor protein p63 0.0408 0.4802 0.4798
Brugia malayi Intermediate filament tail domain containing protein 0.0033 0.0213 0.0274
Echinococcus multilocularis microtubule associated protein 2 0.0833 1 1
Loa Loa (eye worm) hypothetical protein 0.0033 0.0213 0.0291
Echinococcus multilocularis lamin dm0 0.0033 0.0213 0.0206
Plasmodium falciparum ATP-dependent DNA helicase Q1 0.0023 0.0091 0.1731
Brugia malayi intermediate filament protein 0.0033 0.0213 0.0274
Echinococcus granulosus Ataxin 2 N terminaldomain containing protein 0.0024 0.0108 0.01
Plasmodium vivax ADP-dependent DNA helicase RecQ, putative 0.0037 0.0268 0.5613
Schistosoma mansoni hypothetical protein 0.012 0.1278 0.1267
Echinococcus multilocularis tumor protein p63 0.0408 0.4802 0.4798
Brugia malayi N-terminal motif family protein 0.0185 0.2073 0.2812
Trypanosoma cruzi mitochondrial DNA polymerase beta, putative 0.0365 0.4273 1
Loa Loa (eye worm) MH1 domain-containing protein 0.0019 0.0044 0.006
Schistosoma mansoni hypothetical protein 0.0024 0.0108 0.0095
Toxoplasma gondii ATP-dependent DNA helicase, RecQ family protein 0.0037 0.0262 0.4786
Echinococcus granulosus intermediate filament protein 0.0033 0.0213 0.0206
Schistosoma mansoni hypothetical protein 0.0259 0.2976 0.2967
Echinococcus multilocularis mothers against decapentaplegic 6 0.0019 0.0044 0.0037
Brugia malayi MH1 domain containing protein 0.0023 0.0099 0.0117
Echinococcus multilocularis isocitrate dehydrogenase 0.0016 0.0013 0.0006
Schistosoma mansoni Smad4 0.0042 0.0328 0.0315
Onchocerca volvulus 0.0033 0.0213 0.0399
Schistosoma mansoni smad1 5 8 and 0.0042 0.0328 0.0315
Schistosoma mansoni hypothetical protein 0.012 0.1278 0.1267
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.012 0.1278 0.1272
Toxoplasma gondii ATP-dependent DNA helicase, RecQ family protein 0.0023 0.0091 0.1508
Schistosoma mansoni tar DNA-binding protein 0.0598 0.7122 0.7118
Echinococcus granulosus smad 0.0042 0.0328 0.0321
Trypanosoma cruzi PAB1-binding protein , putative 0.0053 0.0467 0.1066
Giardia lamblia Sgs1 DNA helicase, putative 0.0023 0.0091 0.5
Brugia malayi TAR-binding protein 0.0598 0.7122 0.9704
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.0598 0.7122 0.9705
Trypanosoma brucei mitochondrial DNA polymerase beta 0.0365 0.4273 1
Trypanosoma brucei PAB1-binding protein , putative 0.0053 0.0467 0.1066
Schistosoma mansoni smad 0.0019 0.0044 0.0032
Echinococcus granulosus Smad4 0.0042 0.0328 0.0321
Brugia malayi hypothetical protein 0.0365 0.4276 0.5819
Schistosoma mansoni Smad4 0.0019 0.0044 0.0032
Loa Loa (eye worm) hypothetical protein 0.0378 0.444 0.605
Loa Loa (eye worm) transcription factor SMAD2 0.0616 0.7338 1
Loa Loa (eye worm) isocitrate dehydrogenase 0.0016 0.0013 0.0017
Entamoeba histolytica recQ family helicase, putative 0.0029 0.0173 0.5
Loa Loa (eye worm) hypothetical protein 0.0053 0.0467 0.0636
Echinococcus granulosus NADP dependent isocitrate dehydrogenase 0.0016 0.0013 0.0006
Echinococcus multilocularis bloom syndrome protein 0.0055 0.0484 0.0477
Loa Loa (eye worm) hypothetical protein 0.0019 0.0044 0.006
Brugia malayi Latrophilin receptor protein 2 0.012 0.1278 0.1728
Echinococcus multilocularis mothers against decapentaplegic 5 0.0042 0.0328 0.0321
Echinococcus multilocularis Smad4 0.0042 0.0328 0.0321
Echinococcus multilocularis NADP dependent isocitrate dehydrogenase 0.0016 0.0013 0.0006
Schistosoma mansoni tar DNA-binding protein 0.0598 0.7122 0.7118
Brugia malayi cytoplasmic intermediate filament protein 0.0017 0.0028 0.0021
Trypanosoma brucei mitochondrial DNA polymerase beta-PAK 0.0173 0.1925 0.4488
Trypanosoma brucei ATP-dependent DEAD/H DNA helicase recQ, putative 0.0029 0.0173 0.0375
Schistosoma mansoni lamin 0.0033 0.0213 0.0201
Loa Loa (eye worm) nuclear factor I 0.0023 0.0099 0.0134
Trypanosoma cruzi ATP-dependent DEAD/H DNA helicase recQ, putative 0.0029 0.0173 0.0375
Trypanosoma cruzi mitochondrial DNA polymerase beta, putative 0.0365 0.4273 1
Trypanosoma cruzi DNA polymerase beta thumb, putative 0.0051 0.0442 0.1007
Trypanosoma brucei DNA polymerase beta thumb, putative 0.0051 0.0442 0.1007
Toxoplasma gondii hypothetical protein 0.0059 0.0534 1
Leishmania major ATP-dependent DEAD/H DNA helicase recQ, putative 0.0029 0.0173 0.0375
Schistosoma mansoni cellular tumor antigen P53 0.006 0.0545 0.0533
Trypanosoma cruzi mitochondrial DNA polymerase beta-PAK, putative 0.0051 0.0442 0.1007
Brugia malayi hypothetical protein 0.0034 0.0236 0.0305
Trypanosoma cruzi mitochondrial DNA polymerase beta-PAK, putative 0.0173 0.1925 0.4488
Schistosoma mansoni intermediate filament proteins 0.0033 0.0213 0.0201
Echinococcus granulosus mothers against decapentaplegic 2 0.0019 0.0044 0.0037
Loa Loa (eye worm) TAR-binding protein 0.0598 0.7122 0.9705
Brugia malayi latrophilin 2 splice variant baaae 0.0259 0.2976 0.4045
Loa Loa (eye worm) MH2 domain-containing protein 0.0616 0.7338 1
Schistosoma mansoni tar DNA-binding protein 0.0598 0.7122 0.7118
Mycobacterium ulcerans hypothetical protein 0.0192 0.2163 0.5

Activities

Activity type Activity value Assay description Source Reference
Potency (functional) 0.3548 uM PubChem BioAssay. qHTS of GLP-1 Receptor Inverse Agonists (Inhibition Mode). (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) = 2.5119 um PUBCHEM_BIOASSAY: qHTS Assay for Modulators of Lamin A Splicing. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 3.1623 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) 3.1623 uM PubChem BioAssay. qHTS for Inhibitors of Vif-A3G Interactions: qHTS. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 3.1623 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) 3.4111 uM PubChem BioAssay. qHTS for Inhibitors of WRN Helicase: BLM Helicase Counterscreen for WRN Inhibitors. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 3.5481 uM PUBCHEM_BIOASSAY: qHTS for Inhibitors of Vif-A3F Interactions: qHTS. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) = 3.9811 um PUBCHEM_BIOASSAY: qHTS Screen for Compounds that Selectively Target Cancer Cells with p53 Mutations: Cytotoxicity of p53ts Cells at the Permissive Temperature. (Class of assay: confirmatory) [Related pubchem assays: 902 ] ChEMBL. No reference
Potency (functional) = 6.3096 um PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of DNA Polymerase Beta. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 19.1821 uM PubChem BioAssay. qHTS for Inhibitors of WRN Helicase: Confirmatory Assay for Cherry-picked Compounds.. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) = 19.9526 um PUBCHEM_BIOASSAY: qHTS for Inhibitors of Tau Fibril Formation, Fluorescence Polarization. (Class of assay: confirmatory) [Related pubchem assays: 596 ] ChEMBL. No reference
Potency (functional) = 35.4813 um PUBCHEM_BIOASSAY: qHTS Assay for the Inhibitors of Schistosoma Mansoni Peroxiredoxins. (Class of assay: confirmatory) [Related pubchem assays: 1011 (Confirmation Concentration-Response Assay for Inhibitors of the Schistosoma mansoni Redox Cascade ), 448 (Schistosoma Mansoni Peroxiredoxins (Prx2) and thioredoxin glutathione reductase (TGR) coupled assay)] ChEMBL. No reference
Potency (functional) = 35.4813 um PUBCHEM_BIOASSAY: qHTS Assay for Agonists of the Relaxin Receptor RXFP1. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 63.0957 uM PUBCHEM_BIOASSAY: qHTS for Inhibitors of Polymerase Eta. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID588636] ChEMBL. No reference
Potency (functional) 75.193 uM PubChem BioAssay. qHTS for Inhibitors of Polymerase Iota: Confirmatory Assay for Cherry-picked Compounds. (Class of assay: confirmatory) ChEMBL. No reference
Potency (binding) = 79.4328 um PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Tyrosyl-DNA Phosphodiesterase (TDP1). (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 79.4328 uM PubChem BioAssay. qHTS Assay to Find Inhibitors of Pin1. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 89.1251 uM PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of JMJD2A-Tudor Domain. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID504402] ChEMBL. No reference
Potency (functional) 100 uM PUBCHEM_BIOASSAY: HTS for Inhibitors of HP1-beta Chromodomain Interactions with Methylated Histone Tails. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488962] 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.
 
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.

If you have references for this compound, please enter them in a user comment (below) or Contact us.