Detailed information for compound 924817

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 322.318 | Formula: C17H14N4O3
  • H donors: 1 H acceptors: 3 LogP: 3.61 Rotable bonds: 5
    Rule of 5 violations (Lipinski): 1
  • SMILES: COc1ccc2c(c1)nccc2N/N=C/c1cccc(c1)[N+](=O)[O-]
  • InChi: 1S/C17H14N4O3/c1-24-14-5-6-15-16(7-8-18-17(15)10-14)20-19-11-12-3-2-4-13(9-12)21(22)23/h2-11H,1H3,(H,18,20)/b19-11+
  • InChiKey: CISBMECUZMVLQO-YBFXNURJSA-N  


Substructure search Similarity search

Network

Hover on a compound node to display the structore

Synonyms

No synonyms found for this compound

Targets

Known targets for this compound

No curated genes were found associated with this compound

Predicted pathogen targets for this compound

By orthology
No druggable targets predicted by orthology data
By sequence similarity to non orthologous known druggable targets
No druggable targets predicted by sequence similarity
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Echinococcus multilocularis tyrosine kinase 0.003 0.013 0.013
Echinococcus multilocularis Niemann Pick C1 protein 0.01 0.0883 0.0883
Echinococcus granulosus nmda type glutamate receptor 0.003 0.013 0.013
Onchocerca volvulus 0.003 0.013 0.0541
Toxoplasma gondii PHD-finger domain-containing protein 0.0057 0.0416 0.0416
Echinococcus granulosus lysine specific demethylase 5A 0.0071 0.0564 0.0564
Brugia malayi Bromodomain containing protein 0.0057 0.0416 0.0416
Echinococcus granulosus glutamate receptor 2 0.003 0.013 0.013
Echinococcus multilocularis sterol regulatory element binding protein 0.0043 0.0265 0.0265
Loa Loa (eye worm) RGC/RGC protein kinase 0.003 0.013 0.013
Mycobacterium tuberculosis Conserved hypothetical membrane protein 0.0414 0.4254 1
Echinococcus multilocularis glutamate receptor 2 0.003 0.013 0.013
Leishmania major protein kinase A catalytic subunit isoform 2 0.0039 0.0225 0.0225
Plasmodium vivax cAMP-dependent protein kinase catalytic subunit, putative 0.0039 0.0225 0.0225
Loa Loa (eye worm) AGC/PKA protein kinase 0.0039 0.0225 0.0225
Echinococcus multilocularis geminin 0.0172 0.1657 0.1657
Entamoeba histolytica prenyl cysteine carboxyl methyltransferase, putative 0.0947 1 1
Plasmodium falciparum protein-S-isoprenylcysteine O-methyltransferase, putative 0.0947 1 1
Onchocerca volvulus Poor gastrulation protein homolog 0.0053 0.0368 0.2425
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0037 0.0197 0.0197
Toxoplasma gondii PHD-finger domain-containing protein 0.0019 0.0003 0.0003
Echinococcus multilocularis lysine specific demethylase 5A 0.0069 0.0546 0.0546
Echinococcus multilocularis Glutamate receptor, ionotropic kainate 2 0.003 0.013 0.013
Brugia malayi metabotropic glutamate receptor subtype 5a (mGluR5a), putative 0.0294 0.2962 0.2962
Loa Loa (eye worm) hypothetical protein 0.003 0.013 0.013
Trypanosoma brucei prenyl protein specific carboxyl methyltransferase 0.0947 1 1
Entamoeba histolytica PH domain containing protein kinase, putative 0.0039 0.0225 0.0165
Echinococcus granulosus Glutamate receptor ionotropic kainate 2 0.003 0.013 0.013
Schistosoma mansoni cpg binding protein 0.0029 0.0117 0.0117
Loa Loa (eye worm) hypothetical protein 0.003 0.013 0.013
Schistosoma mansoni protein kinase 0.003 0.013 0.013
Brugia malayi CXXC zinc finger family protein 0.0029 0.0117 0.0117
Loa Loa (eye worm) hypothetical protein 0.003 0.013 0.013
Leishmania major 4-coumarate:coa ligase-like protein 0.0024 0.0061 0.0061
Brugia malayi metabotropic GABA-B receptor subtype 2 0.003 0.013 0.013
Loa Loa (eye worm) hypothetical protein 0.0039 0.0225 0.0225
Brugia malayi Receptor family ligand binding region containing protein 0.003 0.013 0.013
Onchocerca volvulus 0.0142 0.1326 1
Mycobacterium leprae PROBABLE FATTY-ACID-CoA LIGASE FADD7 (FATTY-ACID-CoA SYNTHETASE) (FATTY-ACID-CoA SYNTHASE) 0.0024 0.0061 0.5
Echinococcus multilocularis cAMP dependent protein kinase catalytic subunit 0.0039 0.0225 0.0225
Leishmania major 4-coumarate:coa ligase-like protein 0.0024 0.0061 0.0061
Echinococcus multilocularis peregrin 0.0057 0.0416 0.0416
Loa Loa (eye worm) glutamate receptor 0.0324 0.329 0.329
Brugia malayi Receptor family ligand binding region containing protein 0.0083 0.0696 0.0696
Echinococcus multilocularis Transcription factor, JmjC domain containing protein 0.0187 0.1815 0.1815
Trichomonas vaginalis conserved hypothetical protein 0.0043 0.0265 0.0041
Schistosoma mansoni tyrosine kinase 0.003 0.013 0.013
Echinococcus granulosus cAMP dependent protein kinase catalytic subunit 0.0039 0.0225 0.0225
Brugia malayi Guanylyl cyclase protein 23 0.003 0.013 0.013
Brugia malayi PHD-finger family protein 0.002 0.002 0.002
Echinococcus multilocularis glutamate receptor 2 0.003 0.013 0.013
Schistosoma mansoni hypothetical protein 0.0057 0.0416 0.0416
Loa Loa (eye worm) hypothetical protein 0.0399 0.4096 0.4096
Schistosoma mansoni protein-s-isoprenylcysteine o-methyltransferase 0.0947 1 1
Echinococcus multilocularis PHD finger protein rhinoceros 0.0057 0.0416 0.0416
Leishmania major prenyl protein specific carboxyl methyltransferase, putative 0.0947 1 1
Loa Loa (eye worm) RGC/RGC protein kinase 0.003 0.013 0.013
Brugia malayi hypothetical protein 0.0037 0.0197 0.0197
Echinococcus granulosus sterol regulatory element binding protein 0.0043 0.0265 0.0265
Leishmania major extracellular receptor, putative 0.003 0.013 0.013
Onchocerca volvulus 0.0141 0.1318 0.9937
Brugia malayi jmjC domain containing protein 0.0187 0.1815 0.1815
Loa Loa (eye worm) glutamate receptor 0.0127 0.1174 0.1174
Echinococcus multilocularis cAMP dependent protein kinase catalytic subunit 0.0039 0.0225 0.0225
Schistosoma mansoni tyrosine kinase 0.003 0.013 0.013
Loa Loa (eye worm) hypothetical protein 0.002 0.002 0.002
Loa Loa (eye worm) hypothetical protein 0.01 0.0883 0.0883
Echinococcus multilocularis 0.0947 1 1
Plasmodium falciparum phd finger protein, putative 0.0057 0.0416 0.0416
Onchocerca volvulus 0.003 0.013 0.0541
Leishmania major protein kinase A catalytic subunit 0.0039 0.0225 0.0225
Entamoeba histolytica hypothetical protein 0.0037 0.0197 0.0136
Schistosoma mansoni niemann-pick C1 (NPC1) 0.0102 0.0899 0.0899
Onchocerca volvulus Atrial natriuretic peptide receptor 3 homolog 0.003 0.013 0.0541
Entamoeba histolytica hypothetical protein 0.0037 0.0197 0.0136
Brugia malayi Niemann-Pick C1 protein precursor 0.01 0.0883 0.0883
Loa Loa (eye worm) AGC/PKA protein kinase 0.0039 0.0225 0.0225
Entamoeba histolytica PH domain containing protein kinase, putative 0.0039 0.0225 0.0165
Echinococcus granulosus enhancer of mRNA decapping protein 4 0.0039 0.0217 0.0217
Loa Loa (eye worm) PHD-finger family protein 0.0057 0.0416 0.0416
Brugia malayi Metabotropic glutamate receptor precursor. 0.0324 0.329 0.329
Trypanosoma cruzi prenyl protein specific carboxyl methyltransferase, putative 0.0947 1 1
Entamoeba histolytica hypothetical protein 0.003 0.013 0.0069
Trichomonas vaginalis protein-S isoprenylcysteine O-methyltransferase, putative 0.0947 1 1
Schistosoma mansoni glutamate receptor NMDA 0.003 0.013 0.013
Loa Loa (eye worm) CXXC zinc finger family protein 0.0029 0.0117 0.0117
Loa Loa (eye worm) hypothetical protein 0.0053 0.037 0.037
Echinococcus multilocularis rho associated protein kinase 0.0142 0.1326 0.1326
Echinococcus multilocularis Glutamate receptor, ionotropic kainate 2 0.003 0.013 0.013
Echinococcus multilocularis expressed conserved protein 0.0094 0.0817 0.0817
Echinococcus multilocularis metabotropic glutamate receptor 5 0.0399 0.4096 0.4096
Schistosoma mansoni serine/threonine protein kinase 0.0039 0.0225 0.0225
Mycobacterium leprae PROBABLE FATTY-ACID-CoA LIGASE FADD2 (FATTY-ACID-CoA SYNTHETASE) (FATTY-ACID-CoA SYNTHASE) 0.0024 0.0061 0.5
Echinococcus multilocularis atpase aaa+ type core atpase aaa type core 0.0825 0.868 0.868
Entamoeba histolytica prenyl cysteine carboxyl methyltransferase, putative 0.0947 1 1
Echinococcus granulosus Glutamate receptor ionotropic kainate 2 0.003 0.013 0.013
Toxoplasma gondii PHD-finger domain-containing protein 0.0057 0.0416 0.0416
Trypanosoma cruzi cAMP-dependent protein kinase catalytic subunit 2 0.0039 0.0225 0.0225
Echinococcus granulosus dnaJ subfamily B 0.0417 0.4293 0.4293
Plasmodium falciparum conserved Plasmodium membrane protein, unknown function 0.002 0.0022 0.0022
Schistosoma mansoni hypothetical protein 0.0417 0.4293 0.4293
Echinococcus granulosus Transcription factor JmjC domain containing protein 0.0187 0.1815 0.1815
Echinococcus granulosus Jumonji AT rich interactive domain 1B 0.002 0.0018 0.0018
Brugia malayi metabotropic GABA-B receptor subtype 2 0.0053 0.0368 0.0368
Entamoeba histolytica Niemann-Pick C1 protein, putative 0.01 0.0883 0.0826
Schistosoma mansoni hypothetical protein 0.0172 0.1657 0.1657
Toxoplasma gondii protein kinase, cAMP-dependent, catalytic chain 0.0039 0.0225 0.0225
Schistosoma mansoni cpg binding protein 0.0031 0.0135 0.0135
Brugia malayi metabotropic glutamate receptor type 2 0.0158 0.1502 0.1502
Echinococcus granulosus geminin 0.0172 0.1657 0.1657
Echinococcus granulosus tyrosine kinase 0.003 0.013 0.013
Trichomonas vaginalis protein-S isoprenylcysteine O-methyltransferase, putative 0.0947 1 1
Trypanosoma cruzi cAMP-dependent protein kinase catalytic subunit 1 0.0039 0.0225 0.0225
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0046 0.0296 0.0296
Onchocerca volvulus Metabotropic glutamate receptor homolog 0.0053 0.0368 0.2425
Schistosoma mansoni cpg binding protein 0.0031 0.0135 0.0135
Mycobacterium ulcerans hypothetical protein 0.0414 0.4254 1
Echinococcus granulosus glutamate receptor 2 0.003 0.013 0.013
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0046 0.0296 0.0296
Loa Loa (eye worm) metabotropic GABA-B receptor subtype 2 0.0083 0.0696 0.0696
Echinococcus granulosus metabotropic glutamate receptor 2 0.0271 0.2724 0.2724
Echinococcus multilocularis dnaJ subfamily B 0.0417 0.4293 0.4293
Schistosoma mansoni hypothetical protein 0.0037 0.0197 0.0197
Echinococcus granulosus Niemann Pick C1 protein 0.01 0.0883 0.0883
Schistosoma mansoni hypothetical protein 0.0172 0.1657 0.1657
Plasmodium falciparum cAMP-dependent protein kinase catalytic subunit 0.0039 0.0225 0.0225
Echinococcus multilocularis Jumonji, AT rich interactive domain 1B 0.002 0.0018 0.0018
Echinococcus multilocularis Niemann Pick C1 protein 0.0143 0.1346 0.1346
Schistosoma mansoni hypothetical protein 0.0042 0.0249 0.0249
Echinococcus multilocularis nmda type glutamate receptor 0.003 0.013 0.013
Schistosoma mansoni metabotropic glutamate receptor 0.0158 0.1502 0.1502
Echinococcus granulosus Niemann Pick C1 protein 0.0143 0.1346 0.1346
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0046 0.0296 0.0296
Loa Loa (eye worm) hypothetical protein 0.0024 0.0061 0.0061
Trichomonas vaginalis protein-S isoprenylcysteine O-methyltransferase, putative 0.0947 1 1
Loa Loa (eye worm) metabotropic glutamate receptor 8 0.003 0.013 0.013
Echinococcus multilocularis cpg binding protein 0.0031 0.0135 0.0135
Echinococcus granulosus protein S isoprenylcysteine O methyltransferase 0.0947 1 1
Giardia lamblia Isoprenylcysteine carboxyl methyltransferase 0.0947 1 1
Loa Loa (eye worm) receptor family ligand binding region containing protein 0.0083 0.0696 0.0696
Loa Loa (eye worm) hypothetical protein 0.0057 0.0416 0.0416
Brugia malayi F/Y-rich N-terminus family protein 0.0028 0.0099 0.0099
Echinococcus multilocularis receptor type guanylyl cyclase 0.003 0.013 0.013
Onchocerca volvulus 0.0029 0.0117 0.0441
Brugia malayi AMP-binding enzyme family protein 0.0024 0.0061 0.0061
Schistosoma mansoni hypothetical protein 0.0042 0.0249 0.0249
Echinococcus granulosus Glutamate receptor ionotropic kainate 2 0.003 0.013 0.013
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0026 0.0081 0.0081
Toxoplasma gondii isoprenylcysteine carboxyl methyltransferase (icmt) family protein 0.0947 1 1
Onchocerca volvulus Alhambra homolog 0.0057 0.0416 0.2809
Echinococcus multilocularis cAMP dependent protein kinase catalytic subunit 0.0039 0.0225 0.0225
Plasmodium vivax hypothetical protein, conserved 0.002 0.0022 0.0022
Trypanosoma cruzi prenyl protein specific carboxyl methyltransferase, putative 0.0947 1 1
Toxoplasma gondii AGC kinase 0.0039 0.0225 0.0225
Leishmania major protein kinase A catalytic subunit isoform 1 0.0039 0.0225 0.0225
Brugia malayi AMP-binding enzyme family protein 0.0024 0.0061 0.0061
Trypanosoma brucei PHD-zinc-finger like domain containing protein, putative 0.0019 0.0003 0.0003
Trypanosoma brucei cAMP-dependent protein kinase catalytic subunit 1 0.0039 0.0225 0.0225
Schistosoma mansoni jumonji/arid domain-containing protein 0.0071 0.0564 0.0564
Loa Loa (eye worm) hypothetical protein 0.0083 0.0696 0.0696
Loa Loa (eye worm) hypothetical protein 0.003 0.013 0.013
Echinococcus multilocularis atrial natriuretic peptide receptor 0.003 0.013 0.013
Echinococcus granulosus receptor type guanylyl cyclase 0.003 0.013 0.013
Echinococcus multilocularis protein dispatched 1 0.0049 0.0331 0.0331
Trypanosoma brucei PHD-zinc-finger like domain containing protein, putative 0.0019 0.0003 0.0003
Plasmodium vivax protein-S-isoprenylcysteine O-methyltransferase, putative 0.0947 1 1
Entamoeba histolytica hypothetical protein 0.0037 0.0197 0.0136
Echinococcus granulosus cAMP dependent protein kinase catalytic subunit 0.0039 0.0225 0.0225
Echinococcus granulosus peregrin 0.0057 0.0416 0.0416
Echinococcus multilocularis GPCR, family 3, C terminal 0.0053 0.0368 0.0368
Brugia malayi Protein kinase domain containing protein 0.0439 0.4527 0.4527
Schistosoma mansoni bromodomain-containing nuclear protein 1 brd1 0.0057 0.0416 0.0416
Toxoplasma gondii histone lysine methyltransferase SET1 0.0055 0.0399 0.0399
Loa Loa (eye worm) hypothetical protein 0.0024 0.0061 0.0061
Leishmania major 4-coumarate:coa ligase-like protein 0.0024 0.0061 0.0061
Schistosoma mansoni hypothetical protein 0.0042 0.0249 0.0249
Echinococcus multilocularis metabotropic glutamate receptor 2 0.0271 0.2724 0.2724
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0046 0.0296 0.0296
Loa Loa (eye worm) jmjC domain-containing protein 0.0071 0.0564 0.0564
Trypanosoma cruzi cAMP-dependent protein kinase catalytic subunit 3 0.0039 0.0225 0.0225
Schistosoma mansoni hypothetical protein 0.0019 0.0003 0.0003
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0046 0.0296 0.0296
Brugia malayi jmjC domain containing protein 0.0071 0.0564 0.0564
Brugia malayi hypothetical protein 0.003 0.013 0.013
Echinococcus granulosus PHD finger protein rhinoceros 0.0057 0.0416 0.0416
Giardia lamblia PHD finger protein 15 0.0057 0.0416 0.0196
Loa Loa (eye worm) hypothetical protein 0.003 0.013 0.013
Schistosoma mansoni metabotropic glutamate receptor 0.0271 0.2724 0.2724
Loa Loa (eye worm) hypothetical protein 0.0053 0.0368 0.0368
Trypanosoma brucei protein kinase A catalytic subunit, putative 0.0039 0.0225 0.0225
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0046 0.0296 0.0296
Echinococcus granulosus jumonji domain containing protein 0.0079 0.0657 0.0657
Trypanosoma cruzi cAMP-dependent protein kinase catalytic subunit 3 0.0039 0.0225 0.0225
Loa Loa (eye worm) hypothetical protein 0.0043 0.0265 0.0265
Schistosoma mansoni jumonji domain containing protein 0.0149 0.1401 0.1401
Echinococcus granulosus cAMP dependent protein kinase catalytic subunit 0.0039 0.0225 0.0225
Loa Loa (eye worm) protein-S isoprenylcysteine O-methyltransferase 0.0947 1 1
Echinococcus granulosus GPCR family 3 C terminal 0.0053 0.0368 0.0368
Schistosoma mansoni metabotropic glutamate receptor 2 3 (mglur group 2) 0.0368 0.3768 0.3768
Schistosoma mansoni serine/threonine protein kinase 0.0039 0.0225 0.0225
Loa Loa (eye worm) hypothetical protein 0.003 0.013 0.013
Echinococcus granulosus expressed conserved protein 0.0094 0.0817 0.0817
Schistosoma mansoni hypothetical protein 0.0042 0.0249 0.0249
Loa Loa (eye worm) jmjC domain-containing protein 0.0118 0.1071 0.1071
Echinococcus granulosus metabotropic glutamate receptor 5 0.0399 0.4096 0.4096
Loa Loa (eye worm) hypothetical protein 0.003 0.013 0.013
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0046 0.0296 0.0296
Echinococcus granulosus atrial natriuretic peptide receptor 0.003 0.013 0.013
Trypanosoma brucei cAMP-dependent protein kinase catalytic subunit 2 0.0039 0.0225 0.0225
Schistosoma mansoni serine/threonine protein kinase 0.0142 0.1326 0.1326
Entamoeba histolytica hypothetical protein 0.0037 0.0197 0.0136
Loa Loa (eye worm) abnormal chemotaxis protein 14 0.0043 0.0265 0.0265
Echinococcus multilocularis protein patched 0.0043 0.0265 0.0265
Loa Loa (eye worm) hypothetical protein 0.0098 0.0856 0.0856
Toxoplasma gondii WD domain, G-beta repeat-containing protein 0.0019 0.0003 0.0003
Schistosoma mansoni hypothetical protein 0.0053 0.0368 0.0368
Toxoplasma gondii AGC kinase 0.0039 0.0225 0.0225
Echinococcus multilocularis Glutamate receptor, ionotropic kainate 2 0.003 0.013 0.013
Echinococcus granulosus rho-associated protein kinase 1 0.0142 0.1326 0.1326
Brugia malayi PHD-finger family protein 0.0057 0.0416 0.0416
Echinococcus granulosus glutamate receptor ionotrophic AMPA 3 0.003 0.013 0.013
Echinococcus multilocularis glutamate receptor, ionotrophic, AMPA 3 0.003 0.013 0.013
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0046 0.0296 0.0296
Echinococcus granulosus Protein patched homolog 1 0.0043 0.0265 0.0265
Brugia malayi AMP-binding enzyme family protein 0.0024 0.0061 0.0061
Schistosoma mansoni serine/threonine protein kinase 0.0039 0.0225 0.0225
Schistosoma mansoni patched 1 0.0043 0.0265 0.0265
Loa Loa (eye worm) RGC/RGC protein kinase 0.003 0.013 0.013
Echinococcus granulosus cpg binding protein 0.0031 0.0135 0.0135
Trypanosoma cruzi extracellular receptor, putative 0.003 0.013 0.013
Brugia malayi CHE-14 protein 0.0043 0.0265 0.0265
Echinococcus multilocularis jumonji domain containing protein 0.0079 0.0657 0.0657
Plasmodium vivax hypothetical protein, conserved 0.0057 0.0416 0.0416
Echinococcus multilocularis enhancer of mRNA decapping protein 4 0.0039 0.0217 0.0217
Loa Loa (eye worm) AGC/DMPK/ROCK protein kinase 0.0439 0.4527 0.4527
Schistosoma mansoni transcription factor LCR-F1 0.0037 0.0197 0.0197
Schistosoma mansoni jumonji/arid domain-containing protein 0.0071 0.0564 0.0564
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0046 0.0296 0.0296
Echinococcus multilocularis cAMP dependent protein kinase catalytic subunit 0.0039 0.0225 0.0225
Brugia malayi cAMP-dependent protein kinase catalytic subunit, putative 0.0039 0.0225 0.0225
Loa Loa (eye worm) hypothetical protein 0.0024 0.0061 0.0061
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0062 0.047 0.047
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0037 0.0197 0.0197
Brugia malayi AF-10 protein 0.0019 0.0003 0.0003

Activities

Activity type Activity value Assay description Source Reference
Inhibition (functional) = -3.16 % ST_JUDE_LEISH: Cytotoxicity at 2uM final concentration against transgenic Leishmania Mexicana promastigotes LmPfHT that are glucose transport deficient and complemented with the Plasmodium falciparum hexose transporter. Activity is measured by by DNA content using SYBR green in vitro ChEMBL. No reference
Inhibition (functional) = -2.24 % ST_JUDE_LEISH: Cytotoxicity at 2uM final concentration against transgenic Leishmania Mexicana promastigotes LmGLUT1 that are glucose transport deficient and complemented with the human glucose transporter GLUT1. Activity is measured by DNA content using SYBR green in vitro ChEMBL. No reference
Inhibition (functional) = -0.29 % ST_JUDE_LEISH: Cytotoxicity at 2uM final concentration against transgenic Leishmania Mexicana promastigotes LmGT2 that are glucose transport deficient and complemented with the L. Mexicana glucose transporter 2. Activity is measured by by DNA content using SYBR green in vitro ChEMBL. No reference
Inhibition (functional) = 0 % GSK_TCMDC: Percent inhibition of human HepG2 cell line. Test compounds present at 10uM. ChEMBL. 20485427
Inhibition (functional) = 5 % GSK_TCMDC: Inhibition of Plasmodium falciparum 3D7 LDH activity, using an LDH reporter assay. Test compounds present at 2uM ChEMBL. 20485427
Inhibition (functional) = 99 % GSK_TCMDC: Inhibition of Plasmodium falciparum Dd2 in whole red blood cells, using parasite LDH activity as an index of growth. Test compounds present at 2uM ChEMBL. 20485427
Inhibition (functional) = 100 % GSK_TCMDC: Inhibition of Plasmodium falciparum 3D7 in whole red blood cells, using parasite LDH activity as an index of growth. Test compounds present at 2uM ChEMBL. 20485427
XC50 (functional) = 0.8456 uM GSK_TCMDC: Inhibition of Plasmodium falciparum 3D7 in whole erythrocytes, using parasite LDH activity as an index of growth. ChEMBL. 20485427

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.

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