Detailed information for compound 1562090

Basic information

Technical information
  • TDR Targets ID: 1562090
  • Name: [2-(tert-butylamino)-2-oxoethyl] 5-bromopyrid ine-3-carboxylate
  • MW: 315.163 | Formula: C12H15BrN2O3
  • H donors: 1 H acceptors: 3 LogP: 1.73 Rotable bonds: 6
    Rule of 5 violations (Lipinski): 1
  • SMILES: O=C(NC(C)(C)C)COC(=O)c1cncc(c1)Br
  • InChi: 1S/C12H15BrN2O3/c1-12(2,3)15-10(16)7-18-11(17)8-4-9(13)6-14-5-8/h4-6H,7H2,1-3H3,(H,15,16)
  • InChiKey: OLXJZFCAHOYHSL-UHFFFAOYSA-N  


Substructure search Similarity search

Network

Hover on a compound node to display the structore

Synonyms

  • [2-(tert-butylamino)-2-oxo-ethyl] 5-bromopyridine-3-carboxylate
  • 5-bromo-3-pyridinecarboxylic acid [2-(tert-butylamino)-2-oxoethyl] ester
  • 5-bromonicotinic acid [2-(tert-butylamino)-2-keto-ethyl] ester
  • T0515-3913
  • MLS000568493
  • SMR000154642
  • ZINC03296356

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens K(lysine) acetyltransferase 2A Starlite/ChEMBL No references
Homo sapiens APEX nuclease (multifunctional DNA repair enzyme) 1 Starlite/ChEMBL No references
Homo sapiens ataxin 2 Starlite/ChEMBL No references
Homo sapiens cytochrome P450, family 3, subfamily A, polypeptide 4 Starlite/ChEMBL No references
Homo sapiens cytochrome P450, family 1, subfamily A, polypeptide 2 Starlite/ChEMBL No references

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Schistosoma japonicum ko:K10771 AP endonuclease 1, putative 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
Echinococcus granulosus histone acetyltransferase KAT2B Get druggable targets OG5_127781 All targets in OG5_127781
Echinococcus multilocularis DNA (apurinic or apyrimidinic site) lyase Get druggable targets OG5_126768 All targets in OG5_126768
Plasmodium berghei histone acetyltransferase GCN5, putative Get druggable targets OG5_127781 All targets in OG5_127781
Candida albicans similar to S. cerevisiae APN2 (YBL019W) DNA repair apurinic/apyrimidinic endonuclease Get druggable targets OG5_126768 All targets in OG5_126768
Loa Loa (eye worm) CYP4Cod1 Get druggable targets OG5_126554 All targets in OG5_126554
Trypanosoma cruzi cytochrome P450, putative Get druggable targets OG5_126554 All targets in OG5_126554
Leishmania donovani cytochrome p450-like protein Get druggable targets OG5_126554 All targets in OG5_126554
Schistosoma japonicum ko:K06062 p300/CBP-associated factor, putative Get druggable targets OG5_127781 All targets in OG5_127781
Toxoplasma gondii histone lysine acetyltransferase GCN5-B Get druggable targets OG5_127781 All targets in OG5_127781
Brugia malayi Cytochrome P450 family protein Get druggable targets OG5_126554 All targets in OG5_126554
Giardia lamblia Histone acetyltransferase GCN5 Get druggable targets OG5_127781 All targets in OG5_127781
Cryptosporidium hominis dna-(apurinic or apyrimidinic site) lyase 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
Leishmania braziliensis apurinic/apyrimidinic endonuclease-redox protein Get druggable targets OG5_126768 All targets in OG5_126768
Entamoeba histolytica acetyltransferase, GNAT family Get druggable targets OG5_127781 All targets in OG5_127781
Candida albicans bromodomain protein similar to S. cerevisiae GCN5 (YGR252W) histone acetyltransferase Get druggable targets OG5_127781 All targets in OG5_127781
Loa Loa (eye worm) acetyltransferase Get druggable targets OG5_127781 All targets in OG5_127781
Trypanosoma congolense apurinic/apyrimidinic endonuclease, putative Get druggable targets OG5_126768 All targets in OG5_126768
Plasmodium knowlesi histone acetyltransferase GCN5, putative Get druggable targets OG5_127781 All targets in OG5_127781
Trypanosoma brucei cytochrome P450, putative Get druggable targets OG5_126554 All targets in OG5_126554
Plasmodium vivax histone acetyltransferase GCN5, putative Get druggable targets OG5_127781 All targets in OG5_127781
Echinococcus granulosus histone acetyltransferase KAT2B Get druggable targets OG5_127781 All targets in OG5_127781
Echinococcus granulosus DNA apurinic or apyrimidinic site lyase Get druggable targets OG5_126768 All targets in OG5_126768
Plasmodium yoelii histone acetyltransferase GCN5-related Get druggable targets OG5_127781 All targets in OG5_127781
Loa Loa (eye worm) exodeoxyribonuclease III family protein 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
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 Get druggable targets OG5_126768 All targets in OG5_126768
Candida albicans bromodomain protein similar to S. cerevisiae GCN5 (YGR252W) histone acetyltransferase Get druggable targets OG5_127781 All targets in OG5_127781
Cryptosporidium hominis histone acetyltransferase Get druggable targets OG5_127781 All targets in OG5_127781
Wolbachia endosymbiont of Brugia malayi exonuclease III Get druggable targets OG5_126768 All targets in OG5_126768
Loa Loa (eye worm) cytochrome P450 family protein Get druggable targets OG5_126554 All targets in OG5_126554
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_126554 All targets in OG5_126554
Brugia malayi acetyltransferase, GNAT family protein Get druggable targets OG5_127781 All targets in OG5_127781
Trypanosoma cruzi cytochrome P450, putative Get druggable targets OG5_126554 All targets in OG5_126554
Plasmodium knowlesi AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative Get druggable targets OG5_126768 All targets in OG5_126768
Babesia bovis histone acetyltransferase Get druggable targets OG5_127781 All targets in OG5_127781
Candida albicans closely related to C.maltosa N-alkane-inducible cytochrome P-450, alkane hydroxylating monooxygenase CYP52A3-b aka P450Alk1A (BA Get druggable targets OG5_126554 All targets in OG5_126554
Leishmania donovani apurinic/apyrimidinic endonuclease-redox protein Get druggable targets OG5_126768 All targets in OG5_126768
Candida albicans similar to C.maltosa N-alkane inducible cytochrome P-450, ALK8 CYP52A11 Get druggable targets OG5_126554 All targets in OG5_126554
Leishmania major cytochrome p450-like protein Get druggable targets OG5_126554 All targets in OG5_126554
Schistosoma japonicum ko:K10772 AP endonuclease 2, 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
Plasmodium berghei AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative Get druggable targets OG5_126768 All targets in OG5_126768
Mycobacterium ulcerans cytochrome P450 185A4 Cyp185A4 Get druggable targets OG5_126554 All targets in OG5_126554
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
Candida albicans cytochrome P450 56 Get druggable targets OG5_126554 All targets in OG5_126554
Entamoeba histolytica exodeoxyribonuclease III, 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
Plasmodium falciparum histone acetyltransferase GCN5 Get druggable targets OG5_127781 All targets in OG5_127781
Leishmania braziliensis cytochrome p450-like protein Get druggable targets OG5_126554 All targets in OG5_126554
Schistosoma mansoni ap endonuclease Get druggable targets OG5_126768 All targets in OG5_126768
Trypanosoma brucei gambiense cytochrome P450, putative Get druggable targets OG5_126554 All targets in OG5_126554
Trypanosoma congolense cytochrome P450, putative Get druggable targets OG5_126554 All targets in OG5_126554
Neospora caninum Bromodomain containing protein, related Get druggable targets OG5_127781 All targets in OG5_127781
Loa Loa (eye worm) cytochrome P450 family protein Get druggable targets OG5_126554 All targets in OG5_126554
Brugia malayi exodeoxyribonuclease III family protein 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
Theileria parva hypothetical protein 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
Cryptosporidium parvum GCN5 like acetylase + bromodomain Get druggable targets OG5_127781 All targets in OG5_127781
Candida albicans similar to S. cerevisiae APN2 (YBL019W) DNA repair apurinic/apyrimidinic endonuclease Get druggable targets OG5_126768 All targets in OG5_126768
Neospora caninum hypothetical protein Get druggable targets OG5_127781 All targets in OG5_127781
Schistosoma mansoni ap endonuclease 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 vivax AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative Get druggable targets OG5_126768 All targets in OG5_126768
Schistosoma mansoni gcn5proteinral control of amino-acid synthesis 5-like 2 gcnl2 Get druggable targets OG5_127781 All targets in OG5_127781
Leishmania infantum apurinic/apyrimidinic endonuclease-redox protein Get druggable targets OG5_126768 All targets in OG5_126768
Leishmania mexicana apurinic/apyrimidinic endonuclease-redox protein,AP-endonuclease Get druggable targets OG5_126768 All targets in OG5_126768
Candida albicans cytochrome P450 556 Get druggable targets OG5_126554 All targets in OG5_126554
Theileria parva histone acetyltransferase Gcn5, putative Get druggable targets OG5_127781 All targets in OG5_127781
Treponema pallidum exodeoxyribonuclease (exoA) Get druggable targets OG5_126768 All targets in OG5_126768
Leishmania infantum cytochrome p450-like protein Get druggable targets OG5_126554 All targets in OG5_126554
Trypanosoma brucei gambiense apurinic/apyrimidinic endonuclease, putative Get druggable targets OG5_126768 All targets in OG5_126768
Echinococcus multilocularis gcn5proteinral control of amino acid synthesis Get druggable targets OG5_127781 All targets in OG5_127781
Trichomonas vaginalis ap endonuclease, putative Get druggable targets OG5_126768 All targets in OG5_126768
Leishmania mexicana cytochrome p450-like protein Get druggable targets OG5_126554 All targets in OG5_126554
Toxoplasma gondii histone lysine acetyltransferase GCN5-A Get druggable targets OG5_127781 All targets in OG5_127781
Candida albicans similar to C.maltosa N-alkane inducible cytochrome P-450, ALK8 CYP52A11 Get druggable targets OG5_126554 All targets in OG5_126554
Trichomonas vaginalis ap endonuclease, putative 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 parvum conserved hypothetical protein Get druggable targets OG5_126768 All targets in OG5_126768
Brugia malayi Cytochrome P450 family protein Get druggable targets OG5_126554 All targets in OG5_126554
Trichomonas vaginalis bromodomain-containing protein, putative Get druggable targets OG5_127781 All targets in OG5_127781
Trichomonas vaginalis cat eye syndrome critical region protein 2, cscr2, putative Get druggable targets OG5_127781 All targets in OG5_127781
By sequence similarity to non orthologous known druggable targets
Species Potential target Known druggable target Length Alignment span Identity
Brugia malayi cytochrome P450 cytochrome P450, family 3, subfamily A, polypeptide 4 502 aa 492 aa 24.2 %
Brugia malayi Cytochrome P450 family protein cytochrome P450, family 1, subfamily A, polypeptide 2 516 aa 470 aa 26.2 %
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Loa Loa (eye worm) exodeoxyribonuclease III family protein 0.0023 0.0075 0.0075
Loa Loa (eye worm) pip kinase 2 0.0161 0.2985 0.2985
Treponema pallidum exodeoxyribonuclease (exoA) 0.0023 0.0075 0.5
Echinococcus multilocularis phosphatidylinositol 5 phosphate 4 kinase type 2 0.0161 0.2985 0.6054
Toxoplasma gondii isocitrate dehydrogenase 0.0048 0.0612 0.8887
Loa Loa (eye worm) glutaminase 2 0.027 0.5266 0.5266
Brugia malayi Isocitrate dehydrogenase 0.0048 0.0612 0.0612
Echinococcus multilocularis GPCR, family 2 0.0157 0.289 0.5855
Trypanosoma cruzi isocitrate dehydrogenase [NADP], mitochondrial precursor, putative 0.0048 0.0612 1
Toxoplasma gondii histone lysine acetyltransferase GCN5-A 0.0051 0.0679 1
Schistosoma mansoni glutaminase 0.027 0.5266 0.7825
Brugia malayi Latrophilin receptor protein 2 0.0157 0.289 0.289
Toxoplasma gondii isocitrate dehydrogenase 0.0048 0.0612 0.8887
Trypanosoma cruzi isocitrate dehydrogenase, putative 0.0048 0.0612 1
Schistosoma mansoni hypothetical protein 0.0157 0.289 0.4243
Schistosoma mansoni tar DNA-binding protein 0.0252 0.4882 0.7246
Trypanosoma brucei isocitrate dehydrogenase, putative 0.0048 0.0612 1
Echinococcus multilocularis NADP dependent isocitrate dehydrogenase 0.0048 0.0612 0.1116
Loa Loa (eye worm) TAR-binding protein 0.0252 0.4882 0.4882
Loa Loa (eye worm) hypothetical protein 0.0339 0.6709 0.6709
Trypanosoma brucei isocitrate dehydrogenase [NADP], mitochondrial precursor, putative 0.0048 0.0612 1
Echinococcus granulosus NADP dependent isocitrate dehydrogenase 0.0048 0.0612 0.1116
Loa Loa (eye worm) glutaminase 0.027 0.5266 0.5266
Mycobacterium tuberculosis Probable isocitrate dehydrogenase [NADP] Icd1 (oxalosuccinate decarboxylase) (IDH) (NADP+-specific ICDH) (IDP) 0.0048 0.0612 1
Loa Loa (eye worm) hypothetical protein 0.0161 0.2985 0.2985
Plasmodium vivax isocitrate dehydrogenase [NADP], mitochondrial, putative 0.0048 0.0612 0.8887
Schistosoma mansoni NADP-specific isocitrate dehydrogenase 0.0048 0.0612 0.0809
Onchocerca volvulus 0.0161 0.2985 0.5
Echinococcus multilocularis tar DNA binding protein 0.0252 0.4882 1
Plasmodium falciparum histone acetyltransferase GCN5 0.0047 0.0589 0.9575
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.0157 0.289 0.289
Brugia malayi Pip kinase protein 2 0.0161 0.2985 0.2985
Loa Loa (eye worm) isocitrate dehydrogenase 0.0048 0.0612 0.0612
Brugia malayi isocitrate dehydrogenase 0.0048 0.0612 0.0612
Trypanosoma cruzi apurinic/apyrimidinic endonuclease 0.0023 0.0075 0.123
Schistosoma mansoni phosphatidylinositol-4-phosphate 5-kinase type II 0.0161 0.2985 0.4387
Schistosoma mansoni tar DNA-binding protein 0.0252 0.4882 0.7246
Plasmodium falciparum ataxin-2 like protein, putative 0.003 0.0237 0.3024
Echinococcus multilocularis cadherin EGF LAG seven pass G type receptor 0.0157 0.289 0.5855
Schistosoma mansoni hypothetical protein 0.0157 0.289 0.4243
Brugia malayi latrophilin 2 splice variant baaae 0.0339 0.6709 0.6709
Trypanosoma cruzi PAB1-binding protein , putative 0.003 0.0237 0.3881
Loa Loa (eye worm) acetyltransferase 0.0175 0.3271 0.3271
Giardia lamblia Histone acetyltransferase GCN5 0.0047 0.0589 1
Plasmodium falciparum isocitrate dehydrogenase [NADP], mitochondrial 0.0048 0.0612 1
Brugia malayi hypothetical protein 0.002 0.0011 0.0011
Schistosoma mansoni tar DNA-binding protein 0.0252 0.4882 0.7246
Brugia malayi RNA recognition motif domain containing protein 0.0252 0.4882 0.4882
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.0157 0.289 0.5855
Trypanosoma brucei PAB1-binding protein , putative 0.003 0.0237 0.3881
Loa Loa (eye worm) latrophilin receptor protein 2 0.0157 0.289 0.289
Echinococcus granulosus histone acetyltransferase KAT2B 0.0051 0.0679 0.1256
Mycobacterium ulcerans exodeoxyribonuclease III protein XthA 0.0023 0.0075 0.0143
Echinococcus multilocularis isocitrate dehydrogenase 0.0048 0.0612 0.1116
Loa Loa (eye worm) RNA binding protein 0.0252 0.4882 0.4882
Mycobacterium ulcerans glutaminase 0.027 0.5266 1
Trypanosoma brucei apurinic/apyrimidinic endonuclease, putative 0.0023 0.0075 0.123
Schistosoma mansoni phosphatidylinositol-4-phosphate 5-kinase type II 0.0161 0.2985 0.4387
Toxoplasma gondii LsmAD domain-containing protein 0.003 0.0237 0.2687
Schistosoma mansoni hypothetical protein 0.0157 0.289 0.4243
Echinococcus multilocularis NADP dependent isocitrate dehydrogenase 0.0048 0.0612 0.1116
Plasmodium vivax ataxin-2 like protein, putative 0.003 0.0237 0.2687
Toxoplasma gondii histone lysine acetyltransferase GCN5-B 0.0051 0.0679 1
Schistosoma mansoni hypothetical protein 0.0157 0.289 0.4243
Echinococcus granulosus GPCR family 2 0.0157 0.289 0.5855
Schistosoma mansoni tar DNA-binding protein 0.0252 0.4882 0.7246
Brugia malayi exodeoxyribonuclease III family protein 0.0023 0.0075 0.0075
Leishmania major apurinic/apyrimidinic endonuclease-redox protein 0.0023 0.0075 0.123
Schistosoma mansoni hypothetical protein 0.0339 0.6709 1
Loa Loa (eye worm) hypothetical protein 0.0496 1 1
Wolbachia endosymbiont of Brugia malayi exonuclease III 0.0023 0.0075 0.5
Brugia malayi Calcitonin receptor-like protein seb-1 0.0496 1 1
Leishmania major hypothetical protein, conserved 0.003 0.0237 0.3881
Trichomonas vaginalis bromodomain-containing protein, putative 0.0051 0.0679 0.1163
Echinococcus granulosus histone acetyltransferase KAT2B 0.017 0.3168 0.6435
Leishmania major isocitrate dehydrogenase [NADP], mitochondrial precursor, putative 0.0048 0.0612 1
Echinococcus multilocularis NADP dependent isocitrate dehydrogenase 0.0048 0.0612 0.1116
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0496 1 1
Brugia malayi acetyltransferase, GNAT family protein 0.0175 0.3271 0.3271
Loa Loa (eye worm) hypothetical protein 0.003 0.0237 0.0237
Loa Loa (eye worm) hypothetical protein 0.0157 0.289 0.289
Schistosoma mansoni tar DNA-binding protein 0.0252 0.4882 0.7246
Echinococcus granulosus cadherin EGF LAG seven pass G type receptor 0.0157 0.289 0.5855
Brugia malayi glutaminase DH11.1 0.027 0.5266 0.5266
Trypanosoma cruzi PAB1-binding protein , putative 0.003 0.0237 0.3881
Plasmodium falciparum ataxin-2 like protein, putative 0.003 0.0237 0.3024
Echinococcus multilocularis gcn5proteinral control of amino acid synthesis 0.0175 0.3271 0.6649
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.0252 0.4882 0.4882
Echinococcus multilocularis isocitrate dehydrogenase 2 (NADP+) 0.0048 0.0612 0.1116
Trypanosoma cruzi apurinic/apyrimidinic endonuclease, putative 0.0023 0.0075 0.123
Brugia malayi TAR-binding protein 0.0252 0.4882 0.4882
Trichomonas vaginalis cat eye syndrome critical region protein 2, cscr2, putative 0.0051 0.0679 0.1163
Brugia malayi hypothetical protein 0.003 0.0237 0.0237
Plasmodium vivax histone acetyltransferase GCN5, putative 0.0051 0.0679 1
Entamoeba histolytica acetyltransferase, GNAT family 0.0047 0.0589 1
Trichomonas vaginalis glutaminase, putative 0.027 0.5266 1
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.0157 0.289 0.5855
Brugia malayi RNA binding protein 0.0252 0.4882 0.4882
Echinococcus granulosus phosphatidylinositol 5 phosphate 4 kinase type 2 0.0161 0.2985 0.6054
Schistosoma mansoni gcn5proteinral control of amino-acid synthesis 5-like 2 gcnl2 0.0175 0.3271 0.4818
Echinococcus granulosus tar DNA binding protein 0.0252 0.4882 1

Activities

Activity type Activity value Assay description Source Reference
AC50 (functional) PUBCHEM_BIOASSAY: Cytochrome panel assay with activity outcomes. (Class of assay: other) Panel member name: p450-cyp2d6 Compounds with AC50 equal or less than 10 uM are considered active ChEMBL. No reference
AC50 (functional) PUBCHEM_BIOASSAY: Cytochrome panel assay with activity outcomes. (Class of assay: other) Panel member name: p450-cyp2c9 Compounds with AC50 equal or less than 10 uM are considered active ChEMBL. No reference
AC50 (functional) = 15.84893192 uM PUBCHEM_BIOASSAY: Cytochrome panel assay with activity outcomes. (Class of assay: other) Panel member name: p450-cyp3a4 Compounds with AC50 equal or less than 10 uM are considered active ChEMBL. No reference
AC50 (functional) = 19.95262315 uM PUBCHEM_BIOASSAY: Cytochrome panel assay with activity outcomes. (Class of assay: other) Panel member name: p450-cyp1a2 Compounds with AC50 equal or less than 10 uM are considered active ChEMBL. No reference
AC50 (functional) = 22.38721139 uM PUBCHEM_BIOASSAY: Cytochrome panel assay with activity outcomes. (Class of assay: other) Panel member name: p450-cyp2c19 Compounds with AC50 equal or less than 10 uM are considered active ChEMBL. No reference
Potency (functional) 0.8913 uM PubChem BioAssay. qHTS Assay for Inhibitors of the Human Apurinic/apyrimidinic Endonuclease 1 (APE1). (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 3.9811 uM PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of GCN5L2. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID504398] ChEMBL. No reference
Potency (functional) 10 uM PubChem BioAssay. qHTS for Inhibitors of ATXN expression. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 22.3872 uM PubChem BioAssay. qHTS for Inhibitors of Glutaminase (GLS). (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 29.9349 uM PubChem BioAssay. qHTS for Inhibitors of PLK1-PDB (polo-like kinase 1 - polo-box domain): Primary Screen. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 112.2018 uM PUBCHEM_BIOASSAY: qHTS for Inhibitors of Polymerase Iota. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID588623] 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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