Detailed information for compound 1428951

Basic information

Technical information
  • TDR Targets ID: 1428951
  • Name: 2-[(3-methyl-4-oxo-[1,3,4]thiadiazolo[5,4-c][ 1,2,4]triazin-7-yl)sulfanyl]-N-(1,3-thiazol-2 -yl)acetamide
  • MW: 340.405 | Formula: C10H8N6O2S3
  • H donors: 1 H acceptors: 3 LogP: 1.49 Rotable bonds: 5
    Rule of 5 violations (Lipinski): 1
  • SMILES: O=C(Nc1nccs1)CSc1nn2c(s1)nnc(c2=O)C
  • InChi: 1S/C10H8N6O2S3/c1-5-7(18)16-9(14-13-5)21-10(15-16)20-4-6(17)12-8-11-2-3-19-8/h2-3H,4H2,1H3,(H,11,12,17)
  • InChiKey: PJJASBCDJTUNAN-UHFFFAOYSA-N  


Substructure search Similarity search

Network

Hover on a compound node to display the structore

Synonyms

  • 2-[(3-methyl-4-oxo-[1,3,4]thiadiazolo[5,4-c][1,2,4]triazin-7-yl)sulfanyl]-N-thiazol-2-yl-acetamide
  • 2-[(3-methyl-4-oxo-[1,3,4]thiadiazolo[5,4-c][1,2,4]triazin-7-yl)thio]-N-(2-thiazolyl)acetamide
  • 2-[(4-keto-3-methyl-[1,3,4]thiadiazolo[5,4-c][1,2,4]triazin-7-yl)thio]-N-thiazol-2-yl-acetamide
  • 2-[(3-methyl-4-oxo-[1,3,4]thiadiazolo[5,4-c][1,2,4]triazin-7-yl)sulfanyl]-N-(1,3-thiazol-2-yl)ethanamide
  • MLS000724903
  • SMR000237047

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Escherichia coli penicillin-binding protein Starlite/ChEMBL No references
Homo sapiens geminin, DNA replication inhibitor Starlite/ChEMBL No references
Homo sapiens ataxin 2 Starlite/ChEMBL No references
Homo sapiens microtubule-associated protein tau Starlite/ChEMBL No references
Homo sapiens ATPase family, AAA domain containing 5 Starlite/ChEMBL No references
Homo sapiens pyruvate kinase, muscle Starlite/ChEMBL No references

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Trypanosoma brucei pyruvate kinase 1, putative Get druggable targets OG5_126685 All targets in OG5_126685
Leishmania braziliensis pyruvate kinase Get druggable targets OG5_126685 All targets in OG5_126685
Loa Loa (eye worm) pyruvate kinase-PB Get druggable targets OG5_126685 All targets in OG5_126685
Leishmania mexicana pyruvate kinase Get druggable targets OG5_126685 All targets in OG5_126685
Echinococcus granulosus microtubule associated protein 2 Get druggable targets OG5_133504 All targets in OG5_133504
Schistosoma japonicum ko:K00873 pyruvate kinase [EC2.7.1.40], putative Get druggable targets OG5_126685 All targets in OG5_126685
Leishmania major pyruvate kinase Get druggable targets OG5_126685 All targets in OG5_126685
Echinococcus granulosus pyruvate kinase Get druggable targets OG5_126685 All targets in OG5_126685
Trypanosoma brucei gambiense pyruvate kinase 1, putative Get druggable targets OG5_126685 All targets in OG5_126685
Schistosoma mansoni microtubule-associated protein tau Get druggable targets OG5_133504 All targets in OG5_133504
Echinococcus multilocularis pyruvate kinase Get druggable targets OG5_126685 All targets in OG5_126685
Leishmania infantum pyruvate kinase Get druggable targets OG5_126685 All targets in OG5_126685
Loa Loa (eye worm) pyruvate kinase Get druggable targets OG5_126685 All targets in OG5_126685
Leishmania mexicana pyruvate kinase, putative Get druggable targets OG5_126685 All targets in OG5_126685
Entamoeba histolytica pyruvate kinase, putative Get druggable targets OG5_126685 All targets in OG5_126685
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_126685 All targets in OG5_126685
Plasmodium vivax pyruvate kinase, putative Get druggable targets OG5_126685 All targets in OG5_126685
Echinococcus multilocularis pyruvate kinase Get druggable targets OG5_126685 All targets in OG5_126685
Loa Loa (eye worm) pyruvate kinase Get druggable targets OG5_126685 All targets in OG5_126685
Trypanosoma cruzi pyruvate kinase 2, putative Get druggable targets OG5_126685 All targets in OG5_126685
Cryptosporidium hominis pyruvate kinase Get druggable targets OG5_126685 All targets in OG5_126685
Schistosoma japonicum Pyruvate kinase isozyme R, putative Get druggable targets OG5_126685 All targets in OG5_126685
Onchocerca volvulus Pyruvate kinase homolog Get druggable targets OG5_126685 All targets in OG5_126685
Leishmania braziliensis pyruvate kinase Get druggable targets OG5_126685 All targets in OG5_126685
Mycobacterium leprae Probable pyruvate kinase PykA Get druggable targets OG5_126685 All targets in OG5_126685
Theileria parva pyruvate kinase, putative Get druggable targets OG5_126685 All targets in OG5_126685
Trypanosoma congolense pyruvate kinase 1, putative Get druggable targets OG5_126685 All targets in OG5_126685
Schistosoma japonicum ko:K04380 microtubule-associated protein tau, putative Get druggable targets OG5_133504 All targets in OG5_133504
Plasmodium yoelii pyruvate kinase Get druggable targets OG5_126685 All targets in OG5_126685
Schistosoma mansoni pyruvate kinase Get druggable targets OG5_126685 All targets in OG5_126685
Babesia bovis pyruvate kinase, putative Get druggable targets OG5_126685 All targets in OG5_126685
Leishmania infantum pyruvate kinase Get druggable targets OG5_126685 All targets in OG5_126685
Brugia malayi Pyruvate kinase, muscle isozyme Get druggable targets OG5_126685 All targets in OG5_126685
Schistosoma mansoni pyruvate kinase Get druggable targets OG5_126685 All targets in OG5_126685
Cryptosporidium parvum pyruvate kinase Get druggable targets OG5_126685 All targets in OG5_126685
Candida albicans pyruvate kinase Get druggable targets OG5_126685 All targets in OG5_126685
Plasmodium knowlesi pyruvate kinase, putative Get druggable targets OG5_126685 All targets in OG5_126685
Echinococcus multilocularis pyruvate kinase Get druggable targets OG5_126685 All targets in OG5_126685
Mycobacterium tuberculosis Probable pyruvate kinase PykA Get druggable targets OG5_126685 All targets in OG5_126685
Giardia lamblia Pyruvate kinase Get druggable targets OG5_126685 All targets in OG5_126685
Trypanosoma cruzi pyruvate kinase 2, putative Get druggable targets OG5_126685 All targets in OG5_126685
Leishmania major pyruvate kinase Get druggable targets OG5_126685 All targets in OG5_126685
Trypanosoma brucei pyruvate kinase 1 Get druggable targets OG5_126685 All targets in OG5_126685
Trypanosoma brucei gambiense pyruvate kinase 1, putative Get druggable targets OG5_126685 All targets in OG5_126685
Plasmodium berghei pyruvate kinase, putative Get druggable targets OG5_126685 All targets in OG5_126685
Mycobacterium ulcerans pyruvate kinase Get druggable targets OG5_126685 All targets in OG5_126685
Brugia malayi Pyruvate kinase, M2 isozyme Get druggable targets OG5_126685 All targets in OG5_126685
Trichomonas vaginalis pyruvate kinase, putative Get druggable targets OG5_126685 All targets in OG5_126685
Echinococcus multilocularis microtubule associated protein 2 Get druggable targets OG5_133504 All targets in OG5_133504
Loa Loa (eye worm) pyruvate kinase Get druggable targets OG5_126685 All targets in OG5_126685
Trichomonas vaginalis pyruvate kinase, putative Get druggable targets OG5_126685 All targets in OG5_126685
Leishmania donovani pyruvate kinase, putative Get druggable targets OG5_126685 All targets in OG5_126685
Echinococcus granulosus pyruvate kinase Get druggable targets OG5_126685 All targets in OG5_126685
Echinococcus multilocularis atpase aaa+ type core atpase aaa type core Get druggable targets OG5_139225 All targets in OG5_139225
Candida albicans pyruvate kinase Get druggable targets OG5_126685 All targets in OG5_126685
Toxoplasma gondii pyruvate kinase PyK1 Get druggable targets OG5_126685 All targets in OG5_126685
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_126685 All targets in OG5_126685
Chlamydia trachomatis pyruvate kinase Get druggable targets OG5_126685 All targets in OG5_126685
Neospora caninum Pyruvate kinase (EC 2.7.1.40), related Get druggable targets OG5_126685 All targets in OG5_126685
Mycobacterium tuberculosis Possible penicillin-binding protein Get druggable targets OG5_149948 All targets in OG5_149948
Plasmodium falciparum pyruvate kinase Get druggable targets OG5_126685 All targets in OG5_126685
Onchocerca volvulus Pyruvate kinase homolog Get druggable targets OG5_126685 All targets in OG5_126685
Onchocerca volvulus Pyruvate kinase homolog Get druggable targets OG5_126685 All targets in OG5_126685
Leishmania braziliensis pyruvate kinase Get druggable targets OG5_126685 All targets in OG5_126685
By sequence similarity to non orthologous known druggable targets
Species Potential target Known druggable target Length Alignment span Identity
Echinococcus granulosus pyruvate kinase pyruvate kinase, muscle 605 aa 521 aa 34.9 %
Brugia malayi Hypothetical 65.5 kDa Trp-Asp repeats containing protein F02E8.5 inchromosome X geminin, DNA replication inhibitor 209 aa 176 aa 27.8 %
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Trichomonas vaginalis D-aminoacylase, putative 0.0043 0.0174 0.0387
Echinococcus multilocularis pyruvate kinase 0.004 0.0141 0.0141
Trypanosoma cruzi PAB1-binding protein , putative 0.003 0.0038 0.0083
Trichomonas vaginalis Clan SC, family S33, methylesterase-like serine peptidase 0.0456 0.4503 1
Brugia malayi Pyruvate kinase, M2 isozyme 0.004 0.0141 0.0256
Mycobacterium ulcerans amidase 0.0067 0.0417 0.0926
Mycobacterium tuberculosis Probable lipase LipE 0.0043 0.0174 0.0387
Mycobacterium ulcerans aspartyl/glutamyl-tRNA amidotransferase subunit A 0.0067 0.0417 0.0926
Brugia malayi Amidase family protein 0.0067 0.0417 0.0756
Loa Loa (eye worm) hypothetical protein 0.0043 0.0174 0.0316
Loa Loa (eye worm) hypothetical protein 0.0043 0.0174 0.0316
Trichomonas vaginalis pyruvate kinase, putative 0.004 0.0141 0.0313
Echinococcus multilocularis fatty acid amide hydrolase 1 0.0552 0.5513 0.5513
Brugia malayi beta-lactamase family protein 0.0043 0.0174 0.0316
Leishmania major pyruvate kinase 0.004 0.0141 0.0313
Schistosoma mansoni amidase 0.0552 0.5513 0.6511
Trypanosoma brucei pyruvate kinase 1 0.004 0.0141 0.0313
Entamoeba histolytica hydrolase, alpha/beta fold family domain containing protein 0.0456 0.4503 1
Mycobacterium leprae PROBABLE GLUTAMYL-TRNA(GLN) AMIDOTRANSFERASE (SUBUNIT A) GATA (Glu-ADT SUBUNIT A) 0.0067 0.0417 0.0633
Mycobacterium tuberculosis Probable amidase AmiA2 (aminohydrolase) 0.0067 0.0417 0.0926
Loa Loa (eye worm) hypothetical protein 0.0028 0.0013 0.0023
Trypanosoma cruzi monoglyceride lipase, putative 0.0456 0.4503 1
Leishmania major pyruvate kinase 0.004 0.0141 0.0313
Mycobacterium ulcerans hypothetical protein 0.0456 0.4503 1
Mycobacterium tuberculosis Probable amidase AmiD (acylamidase) (acylase) 0.0067 0.0417 0.0926
Brugia malayi beta-lactamase family protein 0.0043 0.0174 0.0316
Echinococcus multilocularis geminin 0.0205 0.1867 0.1867
Mycobacterium tuberculosis Possible conserved lipoprotein LpqK 0.0043 0.0174 0.0387
Leishmania major hypothetical protein, conserved 0.0067 0.0417 0.0926
Plasmodium vivax glutamyl-tRNA(Gln) amidotransferase subunit A, putative 0.0067 0.0417 0.0926
Mycobacterium ulcerans amidase 0.0067 0.0417 0.0926
Trypanosoma cruzi PAB1-binding protein , putative 0.003 0.0038 0.0083
Trichomonas vaginalis Clan SC, family S33, methylesterase-like serine peptidase 0.0456 0.4503 1
Loa Loa (eye worm) hypothetical protein 0.0043 0.0174 0.0316
Mycobacterium tuberculosis Probable pyruvate kinase PykA 0.004 0.0141 0.0313
Echinococcus granulosus fatty acid amide hydrolase 1 0.0067 0.0417 0.0492
Plasmodium falciparum ataxin-2 like protein, putative 0.003 0.0038 0.0083
Trypanosoma cruzi pyruvate kinase 2, putative 0.004 0.0141 0.0313
Loa Loa (eye worm) beta-lactamase 0.0043 0.0174 0.0316
Mycobacterium ulcerans peptide amidase, GatA 0.0067 0.0417 0.0926
Mycobacterium tuberculosis Probable amidase AmiB2 (aminohydrolase) 0.0067 0.0417 0.0926
Entamoeba histolytica hydrolase, alpha/beta fold family domain containing protein 0.0456 0.4503 1
Trypanosoma brucei monoglyceride lipase, putative 0.0456 0.4503 1
Trypanosoma cruzi pyruvate kinase 2, putative 0.004 0.0141 0.0313
Chlamydia trachomatis pyruvate kinase 0.004 0.0141 0.3379
Mycobacterium ulcerans amidase 0.0067 0.0417 0.0926
Loa Loa (eye worm) pyruvate kinase 0.004 0.0141 0.0256
Mycobacterium ulcerans amidase 0.0067 0.0417 0.0926
Trichomonas vaginalis Clan SC, family S33, methylesterase-like serine peptidase 0.0456 0.4503 1
Mycobacterium ulcerans beta-lactamase 0.0043 0.0174 0.0387
Toxoplasma gondii pyruvate kinase PyK1 0.004 0.0141 0.8077
Echinococcus granulosus pyruvate kinase 0.004 0.0141 0.0166
Trypanosoma cruzi hypothetical protein, conserved 0.0043 0.0174 0.0387
Trypanosoma brucei monoglyceride lipase, putative 0.0456 0.4503 1
Mycobacterium ulcerans lipase LipD 0.0043 0.0174 0.0387
Onchocerca volvulus 0.0043 0.0174 1
Echinococcus multilocularis glutamyl tRNA(Gln) amidotransferase subunit A 0.0067 0.0417 0.0417
Trichomonas vaginalis conserved hypothetical protein 0.0456 0.4503 1
Onchocerca volvulus 0.0043 0.0174 1
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0043 0.0174 0.0206
Mycobacterium ulcerans lysophospholipase 0.0456 0.4503 1
Mycobacterium leprae Probable lipase LipE 0.0043 0.0174 0.0077
Leishmania major hypothetical protein, conserved 0.0043 0.0174 0.0387
Schistosoma mansoni pyruvate kinase 0.004 0.0141 0.0166
Brugia malayi beta-lactamase 0.0043 0.0174 0.0316
Mycobacterium tuberculosis Probable hydrolase 0.0043 0.0174 0.0387
Mycobacterium tuberculosis Probable esterase/lipase LipP 0.0043 0.0174 0.0387
Loa Loa (eye worm) beta-LACTamase domain containing family member 0.0043 0.0174 0.0316
Plasmodium vivax PST-A protein 0.0456 0.4503 1
Loa Loa (eye worm) pyruvate kinase 0.004 0.0141 0.0256
Plasmodium falciparum pyruvate kinase 0.004 0.0141 0.0313
Plasmodium falciparum ataxin-2 like protein, putative 0.003 0.0038 0.0083
Mycobacterium tuberculosis Probable esterase LipL 0.0043 0.0174 0.0387
Plasmodium falciparum lysophospholipase, putative 0.0456 0.4503 1
Mycobacterium ulcerans esterase/lipase LipP 0.0043 0.0174 0.0387
Wolbachia endosymbiont of Brugia malayi aspartyl/glutamyl-tRNA amidotransferase subunit A 0.0067 0.0417 0.5
Treponema pallidum aspartyl/glutamyl-tRNA amidotransferase subunit A 0.0067 0.0417 0.5
Loa Loa (eye worm) hypothetical protein 0.004 0.0141 0.0256
Mycobacterium tuberculosis Probable conserved lipoprotein 0.0043 0.0174 0.0387
Mycobacterium tuberculosis Conserved protein 0.0043 0.0174 0.0387
Echinococcus multilocularis pyruvate kinase 0.004 0.0141 0.0141
Mycobacterium tuberculosis Conserved protein 0.0043 0.0174 0.0387
Schistosoma mansoni fatty-acid amide hydrolase 0.0067 0.0417 0.0492
Schistosoma mansoni hypothetical protein 0.0205 0.1867 0.2204
Schistosoma mansoni hypothetical protein 0.0205 0.1867 0.2204
Mycobacterium tuberculosis Conserved protein 0.0043 0.0174 0.0387
Loa Loa (eye worm) pyruvate kinase-PB 0.0028 0.0013 0.0023
Trichomonas vaginalis D-aminoacylase, putative 0.0043 0.0174 0.0387
Plasmodium falciparum esterase, putative 0.0456 0.4503 1
Brugia malayi Amidase family protein 0.0067 0.0417 0.0756
Mycobacterium leprae POSSIBLE LYSOPHOSPHOLIPASE 0.0456 0.4503 1
Trichomonas vaginalis valacyclovir hydrolase, putative 0.0456 0.4503 1
Plasmodium falciparum lysophospholipase, putative 0.0456 0.4503 1
Echinococcus multilocularis pyruvate kinase 0.0032 0.0052 0.0052
Loa Loa (eye worm) pyruvate kinase 0.004 0.0141 0.0256
Echinococcus granulosus fatty acid amide hydrolase 1 0.0552 0.5513 0.6511
Leishmania major hypothetical protein, conserved 0.003 0.0038 0.0083
Trypanosoma brucei hypothetical protein, conserved 0.0043 0.0174 0.0387
Schistosoma mansoni pyruvate kinase 0.004 0.0141 0.0166
Toxoplasma gondii ABC1 family protein 0.0043 0.0174 1
Echinococcus multilocularis beta LACTamase domain containing family member 0.0043 0.0174 0.0174
Mycobacterium ulcerans fusion of enoyl-CoA hydratase, EchA21 and lipase, LipE 0.0043 0.0174 0.0387
Echinococcus granulosus microtubule associated protein 2 0.0833 0.8468 1
Mycobacterium leprae PROBABLE AMIDASE AMIC (AMINOHYDROLASE) 0.0067 0.0417 0.0633
Loa Loa (eye worm) hypothetical protein 0.0043 0.0174 0.0316
Trypanosoma brucei pyruvate kinase 1, putative 0.004 0.0141 0.0313
Echinococcus granulosus geminin 0.0205 0.1867 0.2204
Schistosoma mansoni glutamyl-tRNA(Gln) amidotransferase subunit A 0.0067 0.0417 0.0492
Brugia malayi putative amidase 0.0067 0.0417 0.0756
Trypanosoma cruzi amidase, putative 0.0067 0.0417 0.0926
Echinococcus multilocularis fatty acid amide hydrolase 1 0.0552 0.5513 0.5513
Echinococcus granulosus fatty acid amide hydrolase 1 0.0552 0.5513 0.6511
Mycobacterium tuberculosis Possible amidase (aminohydrolase) 0.0067 0.0417 0.0926
Trichomonas vaginalis pyruvate kinase, putative 0.004 0.0141 0.0313
Echinococcus granulosus beta LACTamase domain containing family member 0.0043 0.0174 0.0206
Schistosoma mansoni microtubule-associated protein tau 0.0833 0.8468 1
Plasmodium vivax hypothetical protein, conserved 0.0043 0.0174 0.0387
Trichomonas vaginalis conserved hypothetical protein 0.0456 0.4503 1
Mycobacterium ulcerans pyruvate kinase 0.004 0.0141 0.0313
Mycobacterium ulcerans amidase 0.0067 0.0417 0.0926
Echinococcus granulosus pyruvate kinase 0.004 0.0141 0.0166
Mycobacterium ulcerans hypothetical protein 0.0043 0.0174 0.0387
Mycobacterium leprae conserved hypothetical protein 0.0043 0.0174 0.0077
Schistosoma mansoni fatty-acid amide hydrolase 0.0552 0.5513 0.6511
Echinococcus granulosus glutamyl tRNAGln amidotransferase subunit A 0.0067 0.0417 0.0492
Giardia lamblia Pyruvate kinase 0.004 0.0141 1
Brugia malayi Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative 0.0043 0.0174 0.0316
Brugia malayi hypothetical protein 0.003 0.0038 0.0068
Echinococcus multilocularis microtubule associated protein 2 0.0833 0.8468 0.8468
Chlamydia trachomatis glutamyl-tRNA(Gln) amidotransferase subunit A 0.0067 0.0417 1
Echinococcus multilocularis fatty acid amide hydrolase 1 0.0067 0.0417 0.0417
Trypanosoma brucei fatty-acid amide hydrolase, putative 0.0067 0.0417 0.0926
Trichomonas vaginalis D-aminoacylase, putative 0.0043 0.0174 0.0387
Trichomonas vaginalis esterase, putative 0.0043 0.0174 0.0387
Mycobacterium tuberculosis Probable amidase AmiC (aminohydrolase) 0.0067 0.0417 0.0926
Loa Loa (eye worm) amidase 0.0067 0.0417 0.0756
Trypanosoma brucei PAB1-binding protein , putative 0.003 0.0038 0.0083
Mycobacterium tuberculosis Possible penicillin-binding protein 0.0278 0.2635 0.5851
Plasmodium falciparum lysophospholipase, putative 0.0456 0.4503 1
Trypanosoma cruzi hypothetical protein, conserved 0.0043 0.0174 0.0387
Loa Loa (eye worm) hypothetical protein 0.0043 0.0174 0.0316
Leishmania major monoglyceride lipase, putative 0.0456 0.4503 1
Plasmodium falciparum glutamyl-tRNA(Gln) amidotransferase subunit A 0.0067 0.0417 0.0926
Mycobacterium tuberculosis Probable lipase LipD 0.0043 0.0174 0.0387
Toxoplasma gondii LsmAD domain-containing protein 0.003 0.0038 0.2152
Loa Loa (eye worm) hypothetical protein 0.0043 0.0174 0.0316
Trichomonas vaginalis penicillin-binding protein, putative 0.0043 0.0174 0.0387
Loa Loa (eye worm) hypothetical protein 0.003 0.0038 0.0068
Brugia malayi Pyruvate kinase, muscle isozyme 0.004 0.0141 0.0256
Plasmodium vivax ataxin-2 like protein, putative 0.003 0.0038 0.0083
Plasmodium vivax pyruvate kinase, putative 0.004 0.0141 0.0313
Onchocerca volvulus 0.0043 0.0174 1
Trichomonas vaginalis Clan SC, family S33, methylesterase-like serine peptidase 0.0456 0.4503 1
Loa Loa (eye worm) amidase 0.0067 0.0417 0.0756
Trypanosoma cruzi amidase, putative 0.0067 0.0417 0.0926
Trichomonas vaginalis penicillin-binding protein, putative 0.0043 0.0174 0.0387
Brugia malayi amidase 0.0552 0.5513 1
Trichomonas vaginalis Clan SC, family S33, methylesterase-like serine peptidase 0.0456 0.4503 1
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0043 0.0174 0.0206
Loa Loa (eye worm) hypothetical protein 0.0552 0.5513 1
Mycobacterium tuberculosis Possible lysophospholipase 0.0456 0.4503 1
Entamoeba histolytica pyruvate kinase, putative 0.0028 0.0013 0.0029

Activities

Activity type Activity value Assay description Source Reference
Potency (functional) 0.0224 uM PubChem BioAssay. qHTS for Inhibitors of ATXN expression. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 0.7308 uM PubChem BioAssay. A quantitative high throughput screen for small molecules that induce DNA re-replication in SW480 colon adenocarcinoma cells. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) = 1.4125 um PUBCHEM_BIOASSAY: qHTS Assay for Activators of Human Muscle isoform 2 Pyruvate Kinase. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) = 1.4125 um PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Human Muscle isoform 2 Pyruvate Kinase. (Class of assay: confirmatory) [Related pubchem assays: 1379 ] ChEMBL. No reference
Potency (functional) 1.6511 uM PUBCHEM_BIOASSAY: Primary qHTS for delayed death inhibitors of the malarial parasite plastid, 96 hour incubation. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488745, AID488752, AID488774, AID504848, AID504850] ChEMBL. No reference
Potency (functional) = 5.0119 um PUBCHEM_BIOASSAY: qHTS Inhibitors of AmpC Beta-Lactamase (assay with detergent). (Class of assay: confirmatory) [Related pubchem assays: 1002 (Confirmation Concentration-Response Assay for Inhibitors of AmpC Beta-Lactamase (assay with detergent)), 585 (Promiscuous and Specific Inhibitors of AmpC Beta-Lactamase (assay without detergent) - a screen old NIH MLSMR collection), 584 (Promiscuous and Specific Inhibitors of AmpC Beta-Lactamase (assay with detergent) - a screen of the old NIH MLSMR collection), 1003 (Confirmation Cuvette-Based Assay for Inhibitors of AmpC Beta-Lactamase (assay with detergent))] ChEMBL. No reference
Potency (functional) 13.1154 uM PUBCHEM_BIOASSAY: Primary qHTS for delayed death inhibitors of the malarial parasite plastid, 48 hour incubation. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488752, AID488774, AID504848, AID504850] ChEMBL. No reference
Potency (binding) = 14.1254 um PUBCHEM_BIOASSAY: qHTS for Inhibitors of Tau Fibril Formation, Thioflavin T Binding. (Class of assay: confirmatory) [Related pubchem assays: 596 ] ChEMBL. No reference
Potency (functional) 18.3564 uM PUBCHEM_BIOASSAY: qHTS screen for small molecules that inhibit ELG1-dependent DNA repair in human embryonic kidney (HEK293T) cells expressing luciferase-tagged ELG1. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID493107, AID493125] ChEMBL. No reference
Potency (functional) = 25.1189 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) = 28.1838 um PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Influenza NS1 Protein Function. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) = 79.4328 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) 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
Plasmodium falciparum 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.

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