Detailed information for compound 281511

Basic information

Technical information
  • TDR Targets ID: 281511
  • Name: 131613-17-7
  • MW: 281.352 | Formula: C17H19N3O
  • H donors: 1 H acceptors: 2 LogP: 2.77 Rotable bonds: 2
    Rule of 5 violations (Lipinski): 1
  • SMILES: CC1Cn2c(O)nc3c2c(CN1C/C=C(/C#C)\C)ccc3
  • InChi: 1S/C17H19N3O/c1-4-12(2)8-9-19-11-14-6-5-7-15-16(14)20(10-13(19)3)17(21)18-15/h1,5-8,13H,9-11H2,2-3H3,(H,18,21)/b12-8+
  • InChiKey: PKYXXBMHZKYHSP-XYOKQWHBSA-N  


Substructure search Similarity search

Network

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Synonyms

  • 131515-02-1
  • Imidazo(4,5,1-jk)(1,4)benzodiazepin-2(1H)-one, 4,5,6,7-tetrahydro-5-methyl-6-(3-Methyl-2-penten-4-yn-1-yl)
  • 6(3Me-2Penten-4yn)TIBO-2-one
  • AIDS-002441
  • 6(3Me-2-Penten-4-yn)TIBO-2-one
  • AIDS-002438
  • AIDS002438
  • Imidazo-[4,5,1-jk][1,4]-benzodiazepin-2(1H)-one, 4,5,6,7-tetrahydro-5-methyl-6-(3-Methyl-2-penten-4-yn-1-yl)
  • Imidazo(4,5,1-jk)(1,4)benzodiazepin-2(1H)-one, 4,5,6,7-tetrahydro-5-methyl-6-(3-methyl-2-penten-4-ynyl)-, (E)-(1)-
  • Imidazo[4,5,1-jk][1,4]benzodiazepin-2(1H)-one, 4,5,6,7-tetrahydro-5-methyl-6-(3-methyl-2-penten-4-ynyl)-, (E)-(1)-
  • AIDS002441

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 solute carrier family 2 facilitated glucose 0.0108 0.2074 0.2957
Plasmodium vivax hexose transporter 0.0108 0.2074 0.2074
Trypanosoma cruzi prolyl-tRNA synthetase, putative 0.0038 0.0485 0.5028
Toxoplasma gondii methionine aminopeptidase 0.0044 0.0638 0.0977
Echinococcus multilocularis glutamate receptor, ionotrophic, AMPA 3 0.013 0.2587 0.3756
Schistosoma mansoni hypothetical protein 0.0108 0.2074 0.7874
Brugia malayi Receptor family ligand binding region containing protein 0.0044 0.0633 0.1206
Echinococcus multilocularis glutamyl tRNA synthetase cytoplasmic 0.0032 0.0364 0.0292
Echinococcus multilocularis glutamate receptor 2 0.0086 0.1585 0.2195
Toxoplasma gondii calcium-dependent protein kinase CDPK2A 0.0033 0.038 0.0581
Echinococcus granulosus calcium:calmodulin dependent protein kinase type 0.0033 0.0379 0.0316
Plasmodium falciparum calcium-dependent protein kinase 1 0.0033 0.038 0.038
Toxoplasma gondii calcium-dependent protein kinase CDPK3 0.0033 0.038 0.0581
Leishmania major hypothetical protein, conserved 0.0059 0.0965 1
Brugia malayi Methionine aminopeptidase protein type I 0.0044 0.0638 0.1221
Loa Loa (eye worm) glutamate receptor 1 0.0086 0.1585 0.3723
Leishmania major glucose transporter, lmgt3 0.0033 0.0389 0.4026
Onchocerca volvulus 0.019 0.396 1
Trichomonas vaginalis sugar transporter, putative 0.0033 0.0389 0.0726
Trypanosoma cruzi lysyl-tRNA synthetase, putative 0.0024 0.0176 0.1826
Toxoplasma gondii cell-cycle-associated protein kinase MAPK, putative 0.0174 0.3579 0.5478
Plasmodium vivax mitogen-activated protein kinase 2, putative 0.0174 0.3579 0.3579
Echinococcus multilocularis methionyl aminopeptidase 1 (M24 family) 0.0028 0.0269 0.0145
Schistosoma mansoni glutamate receptor kainate 0.0086 0.1585 0.5844
Brugia malayi metabotropic GABA-B receptor subtype 2 0.0044 0.0633 0.1206
Leishmania major prolyl-tRNA synthetase, putative,bifunctional aminoacyl-tRNA synthetase, putative 0.0038 0.0485 0.5028
Echinococcus multilocularis NMDA receptor 0.0086 0.1585 0.2195
Loa Loa (eye worm) receptor family ligand binding region containing protein 0.0044 0.0633 0.1206
Trichomonas vaginalis low molecular weight protein-tyrosine-phosphatase, putative 0.019 0.396 1
Echinococcus granulosus General substrate transporter 0.0092 0.1731 0.2422
Plasmodium falciparum lysine--tRNA ligase 0.0024 0.0176 0.0176
Brugia malayi Low molecular weight phosphotyrosine protein phosphatase containing protein 0.019 0.396 1
Brugia malayi hypothetical protein 0.0044 0.0633 0.1206
Leishmania major glucose transporter, lmgt1 0.0033 0.0389 0.4026
Schistosoma mansoni protein kinase 0.0033 0.0379 0.0841
Trypanosoma brucei glucose transporter 2A 0.0033 0.0389 0.4026
Loa Loa (eye worm) metabotropic glutamate receptor 8 0.0044 0.0633 0.1206
Trichomonas vaginalis low molecular weight protein tyrosine phosphatase, putative 0.019 0.396 1
Loa Loa (eye worm) hypothetical protein 0.0044 0.0633 0.1206
Schistosoma mansoni glutamate receptor kainate 0.0086 0.1585 0.5844
Trypanosoma brucei lysyl-tRNA synthetase, putative 0.0024 0.0176 0.1826
Trypanosoma brucei glucose transporter, putative 0.0033 0.0389 0.4026
Plasmodium falciparum proline--tRNA ligase 0.0038 0.0485 0.0485
Echinococcus multilocularis Glutamate receptor, ionotropic kainate 2 0.013 0.2587 0.3756
Schistosoma mansoni tyrosine kinase 0.0044 0.0633 0.1893
Mycobacterium tuberculosis Probable glutamine-binding lipoprotein GlnH (GLNBP) 0.022 0.4639 1
Trypanosoma cruzi metallo- peptidase, Clan MG, Family M24 0.0044 0.0638 0.6612
Echinococcus multilocularis Glutamate receptor, ionotropic kainate 3 0.0306 0.6593 1
Trichomonas vaginalis prolyl-tRNA synthetase, putative 0.0032 0.0364 0.0662
Plasmodium falciparum protein kinase 7 0.0304 0.6534 0.6534
Schistosoma mansoni glutamyl-tRNA synthetase cytoplasmic (glutamate--tRNA ligase) (glurs) 0.0032 0.0364 0.0778
Schistosoma mansoni glutamate receptor NMDA 0.013 0.2587 1
Trypanosoma brucei bifunctional aminoacyl-tRNA synthetase, putative 0.0038 0.0485 0.5028
Echinococcus granulosus methionyl aminopeptidase 1 M24 family 0.0044 0.0638 0.072
Echinococcus multilocularis solute carrier family 2 facilitated glucose 0.0108 0.2074 0.2957
Trypanosoma brucei THT1 - hexose transporter, putative 0.0033 0.0389 0.4026
Echinococcus granulosus receptor type guanylyl cyclase 0.0044 0.0633 0.0711
Echinococcus multilocularis glutamate receptor subunit protein glur 0.0086 0.1585 0.2195
Brugia malayi Guanylyl cyclase protein 23 0.0044 0.0633 0.1206
Echinococcus granulosus solute carrier family 2 facilitated glucose 0.0108 0.2074 0.2957
Echinococcus multilocularis calcium:calmodulin dependent protein kinase type 0.0033 0.0379 0.0316
Leishmania major methionine aminopeptidase, putative,metallo-peptidase, Clan MG, Family M24 0.0044 0.0638 0.6612
Echinococcus granulosus calcium:calmodulin dependent protein kinase type 0.0033 0.0379 0.0316
Echinococcus granulosus metabotropic glutamate receptor 5 0.0044 0.0633 0.0711
Mycobacterium tuberculosis Phosphotyrosine protein phosphatase PtpA (protein-tyrosine-phosphatase) (PTPase) (LMW phosphatase) 0.0132 0.2626 0.557
Plasmodium falciparum calcium-dependent protein kinase 5 0.0033 0.038 0.038
Loa Loa (eye worm) CAMK/CAMK2 protein kinase 0.0033 0.0379 0.0536
Leishmania major prolyl-tRNA synthetase, putative,bifunctional aminoacyl-tRNA synthetase, putative 0.0038 0.0485 0.5028
Loa Loa (eye worm) hypothetical protein 0.0033 0.0379 0.0536
Brugia malayi Cam kinase protein 1 0.0033 0.0379 0.0536
Echinococcus granulosus calcium dependent protein kinase 0.0031 0.0333 0.0244
Echinococcus granulosus Glutamate receptor ionotropic kainate 2 0.013 0.2587 0.3756
Trypanosoma cruzi hexose transporter, putative 0.0033 0.0389 0.4026
Trypanosoma cruzi hexose transporter, putative 0.0018 0.0045 0.0468
Echinococcus multilocularis metabotropic glutamate receptor 5 0.0044 0.0633 0.0711
Toxoplasma gondii protein kinase, putative 0.0304 0.6534 1
Brugia malayi Glutamate receptor 1 precursor 0.0086 0.1585 0.3723
Plasmodium vivax calcium-dependent protein kinase, putative 0.0033 0.038 0.038
Schistosoma mansoni methionyl aminopeptidase 1 (M24 family) 0.0028 0.0269 0.0386
Entamoeba histolytica protein kinase, putative 0.0033 0.0379 0.0536
Entamoeba histolytica protein tyrosine phosphatase, putative 0.019 0.396 1
Brugia malayi Metabotropic glutamate receptor precursor. 0.0044 0.0633 0.1206
Plasmodium falciparum calcium-dependent protein kinase 4 0.0033 0.038 0.038
Echinococcus multilocularis calcium:calmodulin dependent protein kinase type 0.0033 0.0379 0.0316
Trypanosoma brucei glucose transporter, putative 0.0033 0.0389 0.4026
Echinococcus multilocularis calcium dependent protein kinase 0.0031 0.0333 0.0244
Mycobacterium ulcerans methionine aminopeptidase MapB 0.0028 0.0269 0.0209
Trypanosoma brucei methionine aminopeptidase, putative 0.0044 0.0638 0.6612
Loa Loa (eye worm) hypothetical protein 0.0044 0.0633 0.1206
Trypanosoma brucei calcium/calmodulin-dependent protein kinase, putative 0.0033 0.0379 0.3926
Schistosoma mansoni glutamate receptor kainate 0.0086 0.1585 0.5844
Chlamydia trachomatis methionine aminopeptidase 0.0028 0.0269 0.0209
Plasmodium vivax calcium-dependent protein kinase 4, putative 0.0033 0.038 0.038
Mycobacterium tuberculosis Methionine aminopeptidase MapA (map) (peptidase M) (MetAP) 0.0028 0.0269 0.0386
Loa Loa (eye worm) calcium/calmodulin-dependent protein kinase ID 0.0033 0.0379 0.0536
Trypanosoma brucei glucose transporter, putative 0.0033 0.0389 0.4026
Loa Loa (eye worm) glutamate receptor 0.0044 0.0633 0.1206
Loa Loa (eye worm) hypothetical protein 0.0044 0.0633 0.1206
Plasmodium falciparum hexose transporter 0.0108 0.2074 0.2074
Chlamydia trachomatis glutamine binding protein 0.022 0.4639 1
Echinococcus granulosus Glutamate receptor ionotropic kainate 2 0.013 0.2587 0.3756
Echinococcus granulosus glutamate receptor ionotropic kainate 3 0.0086 0.1585 0.2195
Echinococcus granulosus glutamate receptor ionotropic kainate 0.0086 0.1585 0.2195
Echinococcus multilocularis receptor type guanylyl cyclase 0.0044 0.0633 0.0711
Giardia lamblia Prolyl-tRNA synthetase 0.0032 0.0364 0.0496
Echinococcus granulosus glutamate receptor 2 0.0044 0.0633 0.0711
Echinococcus multilocularis glutamate receptor ionotropic kainate 0.0086 0.1585 0.2195
Echinococcus multilocularis Glutamate receptor, ionotropic kainate 2 0.013 0.2587 0.3756
Trichomonas vaginalis low molecular weight protein-tyrosine-phosphatase, putative 0.019 0.396 1
Trypanosoma cruzi metallo- peptidase, Clan MG, Family M24 0.0044 0.0638 0.6612
Loa Loa (eye worm) glutamate receptor 2 0.0086 0.1585 0.3723
Mycobacterium leprae PROBABLE METHIONINE AMINOPEPTIDASE MAPA (MAP) (PEPTIDASE M) (MetAP) 0.0028 0.0269 0.6496
Echinococcus granulosus solute carrier family 2 facilitated glucose 0.0108 0.2074 0.2957
Schistosoma mansoni glutamate receptor AMPA 0.0086 0.1585 0.5844
Trypanosoma cruzi hypothetical protein, conserved 0.0059 0.0965 1
Schistosoma mansoni protein kinase 0.0033 0.0379 0.0841
Echinococcus multilocularis glutamate receptor 2 0.0044 0.0633 0.0711
Loa Loa (eye worm) sugar transporter 0.0108 0.2074 0.5016
Trichomonas vaginalis lysyl-tRNA synthetase, putative 0.0024 0.0176 0.0175
Echinococcus granulosus tyrosine kinase 0.0044 0.0633 0.0711
Trypanosoma cruzi hexose transporter, putative 0.0033 0.0389 0.4026
Plasmodium vivax proline--tRNA ligase, putative 0.0038 0.0485 0.0485
Trichomonas vaginalis low molecular weight protein tyrosine phosphatase, putative 0.0059 0.0965 0.2224
Schistosoma mansoni methionyl aminopeptidase 1 (M24 family) 0.0028 0.0269 0.0386
Trichomonas vaginalis low molecular weight protein tyrosine phosphatase, putative 0.0059 0.0965 0.2224
Giardia lamblia Low molecular weight protein-tyrosine-phosphatase 0.019 0.396 1
Treponema pallidum amino acid ABC transporter, periplasmic binding protein 0.022 0.4639 1
Echinococcus multilocularis tyrosine kinase 0.0044 0.0633 0.0711
Leishmania major protein kinase, putative 0.0033 0.0379 0.3926
Echinococcus multilocularis nmda type glutamate receptor 0.0044 0.0633 0.0711
Trypanosoma brucei glucose transporter, putative 0.0033 0.0389 0.4026
Echinococcus multilocularis calcium:calmodulin dependent protein kinase type 0.0033 0.0379 0.0316
Brugia malayi Glutamate receptor 2 precursor 0.0086 0.1585 0.3723
Trichomonas vaginalis sugar transporter, putative 0.0033 0.0389 0.0726
Plasmodium vivax methionine aminopeptidase 1a, putative 0.0028 0.0269 0.0269
Trichomonas vaginalis sugar transporter, putative 0.0033 0.0389 0.0726
Echinococcus multilocularis glutamate receptor 2 0.013 0.2587 0.3756
Schistosoma mansoni serine/threonine protein kinase 0.0033 0.0379 0.0841
Entamoeba histolytica hypothetical protein 0.0044 0.0633 0.1206
Trypanosoma brucei glucose transporter, putative 0.0033 0.0389 0.4026
Leishmania major extracellular receptor, putative 0.0044 0.0633 0.6553
Echinococcus granulosus glutamate receptor ionotrophic AMPA 3 0.013 0.2587 0.3756
Loa Loa (eye worm) RGC/RGC protein kinase 0.0044 0.0633 0.1206
Trichomonas vaginalis low molecular weight protein-tyrosine-phosphatase, putative 0.019 0.396 1
Trypanosoma cruzi hexose transporter, putative 0.0033 0.0389 0.4026
Wolbachia endosymbiont of Brugia malayi methionine aminopeptidase 0.0028 0.0269 0.5
Brugia malayi Calcium/calmodulin-dependent protein kinase type II alpha chain 0.0033 0.0379 0.0536
Mycobacterium tuberculosis Methionine aminopeptidase MapB (map) (peptidase M) 0.0028 0.0269 0.0386
Trypanosoma brucei THT1 - hexose transporter, putative 0.0033 0.0389 0.4026
Loa Loa (eye worm) hypothetical protein 0.0044 0.0633 0.1206
Schistosoma mansoni hypothetical protein 0.0086 0.1585 0.5844
Mycobacterium ulcerans methionine aminopeptidase 0.0028 0.0269 0.0209
Brugia malayi Receptor family ligand binding region containing protein 0.0044 0.0633 0.1206
Brugia malayi Sugar transporter family protein 0.0108 0.2074 0.5016
Schistosoma mansoni glutamate receptor NMDA 0.0086 0.1585 0.5844
Trichomonas vaginalis glucose transporter, putative 0.0033 0.0389 0.0726
Loa Loa (eye worm) hypothetical protein 0.0026 0.0227 0.0133
Plasmodium vivax calcium-dependent protein kinase 3, putative 0.0033 0.038 0.038
Trichomonas vaginalis low molecular weight protein tyrosine phosphatase, putative 0.019 0.396 1
Schistosoma mansoni glutamate receptor AMPA 0.0086 0.1585 0.5844
Leishmania major glucose transporter, lmgt2 0.0033 0.0389 0.4026
Toxoplasma gondii prolyl-tRNA synthetase (ProRS) 0.0038 0.0485 0.0743
Echinococcus granulosus atrial natriuretic peptide receptor 0.0044 0.0633 0.0711
Mycobacterium leprae PROBABLE METHIONINE AMINOPEPTIDASE MAPB (MAP) (PEPTIDASE M) 0.0028 0.0269 0.6496
Toxoplasma gondii methionine aminopeptidase 0.0028 0.0269 0.0412
Trichomonas vaginalis glucose transporter, putative 0.0033 0.0389 0.0726
Trichomonas vaginalis conserved hypothetical protein 0.0033 0.0389 0.0726
Trypanosoma cruzi extracellular receptor, putative 0.0044 0.0633 0.6553
Loa Loa (eye worm) hypothetical protein 0.0044 0.0633 0.1206
Entamoeba histolytica protein kinase, putative 0.0033 0.0379 0.0536
Toxoplasma gondii calcium-dependent protein kinase CDPK2B 0.0033 0.038 0.0581
Toxoplasma gondii methionine aminopeptidase, type i, putative 0.0028 0.0269 0.0412
Trypanosoma brucei low molecular weight protein tyrosine phosphatase, putative 0.0059 0.0965 1
Loa Loa (eye worm) hypothetical protein 0.0032 0.0364 0.0496
Mycobacterium ulcerans glutamine-binding lipoprotein GlnH 0.022 0.4639 1
Echinococcus granulosus solute carrier family 2 facilitated glucose 0.0108 0.2074 0.2957
Trypanosoma brucei metallo- peptidase, Clan MG, Family M24 0.0044 0.0638 0.6612
Plasmodium falciparum mitogen-activated protein kinase 2 0.0174 0.3579 0.3579
Schistosoma mansoni tyrosine kinase 0.0044 0.0633 0.1893
Plasmodium vivax calcium-dependent protein kinase 1, putative 0.0033 0.038 0.038
Schistosoma mansoni protein kinase 0.0033 0.0379 0.0841
Loa Loa (eye worm) hypothetical protein 0.0044 0.0633 0.1206
Echinococcus multilocularis glutamate (NMDA) receptor subunit 0.0086 0.1585 0.2195
Plasmodium vivax CDK-related protein kinase 6, putative 0.0456 1 1
Plasmodium falciparum calcium-dependent protein kinase 3 0.0033 0.038 0.038
Trichomonas vaginalis conserved hypothetical protein 0.0033 0.0389 0.0726
Schistosoma mansoni glucose transport protein 0.0108 0.2074 0.7874
Plasmodium falciparum calcium-dependent protein kinase 2 0.0033 0.038 0.038
Trichomonas vaginalis conserved hypothetical protein 0.0108 0.2074 0.5103
Plasmodium vivax methionine aminopeptidase 1b, putative 0.0044 0.0638 0.0638
Entamoeba histolytica protein tyrosine phosphatase, putative 0.019 0.396 1
Loa Loa (eye worm) hypothetical protein 0.0044 0.0633 0.1206
Mycobacterium leprae Possible lysyl-tRNA synthetase 2 LysX 0.0024 0.0176 0.3046
Loa Loa (eye worm) hypothetical protein 0.0044 0.0633 0.1206
Trypanosoma brucei glucose transporter, putative 0.0033 0.0389 0.4026
Loa Loa (eye worm) hypothetical protein 0.0032 0.0364 0.0496
Leishmania major lysyl-tRNA synthetase, putative 0.0024 0.0176 0.1826
Schistosoma mansoni metabotropic glutamate receptor 0.0044 0.0633 0.1893
Brugia malayi metabotropic glutamate receptor type 2 0.0044 0.0633 0.1206
Plasmodium falciparum methionine aminopeptidase 1a, putative 0.0028 0.0269 0.0269
Loa Loa (eye worm) methionine aminopeptidase type I 0.0044 0.0638 0.1221
Echinococcus multilocularis atrial natriuretic peptide receptor 0.0044 0.0633 0.0711
Trypanosoma cruzi hypothetical protein, conserved 0.0059 0.0965 1
Trypanosoma cruzi prolyl-tRNA synthetase, putative 0.0038 0.0485 0.5028
Schistosoma mansoni protein kinase 0.0044 0.0633 0.1893
Echinococcus multilocularis Ribosomal protein S1, RNA binding domain 0.0086 0.1585 0.2195
Trichomonas vaginalis CAMK family protein kinase 0.0033 0.0379 0.0701
Echinococcus granulosus solute carrier family 2 facilitated glucose 0.0108 0.2074 0.2957
Treponema pallidum amino acid ABC transporter, periplasmic binding protein (hisJ) 0.022 0.4639 1
Echinococcus granulosus Glutamate receptor ionotropic kainate 2 0.013 0.2587 0.3756
Echinococcus granulosus nmda type glutamate receptor 0.0044 0.0633 0.0711
Trypanosoma brucei THT1 - hexose transporter, putative 0.0033 0.0389 0.4026
Echinococcus granulosus glutamate receptor subunit protein glur 0.0086 0.1585 0.2195
Echinococcus multilocularis methionyl aminopeptidase 1 (M24 family) 0.0044 0.0638 0.072
Trypanosoma brucei glucose transporter 1E 0.0033 0.0389 0.4026
Echinococcus granulosus glutamyl tRNA synthetase cytoplasmic 0.0032 0.0364 0.0292
Trypanosoma brucei methionine aminopeptidase, type I, putative 0.0044 0.0638 0.6612
Mycobacterium leprae Probable prolyl tRNA synthetase ProS 0.0032 0.0364 1
Echinococcus multilocularis Glutamate receptor, ionotropic kainate 2 0.013 0.2587 0.3756
Toxoplasma gondii facilitative glucose transporter GT1 0.0108 0.2074 0.3175
Schistosoma mansoni glutamyl-tRNA synthetase cytoplasmic (glutamate--tRNA ligase) (glurs) 0.0032 0.0364 0.0778
Echinococcus granulosus calcium:calmodulin dependent protein kinase type 1 0.0033 0.0379 0.0316
Echinococcus multilocularis nmda type glutamate receptor 0.0306 0.6593 1
Echinococcus granulosus glutamate receptor 2 0.013 0.2587 0.3756
Echinococcus multilocularis General substrate transporter 0.0092 0.1731 0.2422
Trichomonas vaginalis low molecular weight protein tyrosine phosphatase, putative 0.019 0.396 1
Loa Loa (eye worm) hypothetical protein 0.0044 0.0633 0.1206
Echinococcus multilocularis metabotropic glutamate receptor 2 0.0044 0.0633 0.0711
Echinococcus multilocularis solute carrier family 2 facilitated glucose 0.0108 0.2074 0.2957
Echinococcus multilocularis solute carrier family 2, facilitated glucose 0.0108 0.2074 0.2957
Trypanosoma brucei glucose transporter, putative 0.0033 0.0389 0.4026
Plasmodium falciparum methionine aminopeptidase 1b, putative 0.0044 0.0638 0.0638
Mycobacterium ulcerans phosphotyrosine protein phosphatase PtpA 0.019 0.396 0.8478
Plasmodium vivax lysine--tRNA ligase, putative 0.0024 0.0176 0.0176
Schistosoma mansoni glucose transport protein 0.0108 0.2074 0.7874
Loa Loa (eye worm) RGC/RGC protein kinase 0.0044 0.0633 0.1206
Loa Loa (eye worm) RGC/RGC protein kinase 0.0044 0.0633 0.1206
Schistosoma mansoni metabotropic glutamate receptor 0.0044 0.0633 0.1893
Loa Loa (eye worm) metabotropic GABA-B receptor subtype 2 0.0044 0.0633 0.1206
Echinococcus granulosus glutamate NMDA receptor subunit 0.0086 0.1585 0.2195
Echinococcus multilocularis calcium:calmodulin dependent protein kinase type 0.0033 0.0379 0.0316
Toxoplasma gondii lysine-tRNA ligase 0.0024 0.0176 0.027
Echinococcus granulosus Ribosomal protein S1 RNA binding domain 0.0086 0.1585 0.2195
Echinococcus granulosus calcium:calmodulin dependent protein kinase type 0.0033 0.0379 0.0316
Trypanosoma brucei glucose transporter, putative 0.0033 0.0389 0.4026
Schistosoma mansoni ATP-binding cassette transporter 0.0086 0.1585 0.5844
Echinococcus granulosus nmda type glutamate receptor 0.0306 0.6593 1
Schistosoma mansoni glucose transport protein 0.0108 0.2074 0.7874
Chlamydia trachomatis arginine ABC transporter substrate-binding protein ArtJ 0.022 0.4639 1
Entamoeba histolytica prolyl-tRNA synthetase, putative 0.0032 0.0364 0.0496
Echinococcus granulosus metabotropic glutamate receptor 2 0.0044 0.0633 0.0711
Brugia malayi Bifunctional aminoacyl-tRNA synthetase 0.0032 0.0364 0.0496
Loa Loa (eye worm) phosphotyrosine protein phosphatase 0.019 0.396 1
Trypanosoma cruzi hexose transporter 0.0033 0.0389 0.4026
Brugia malayi bifunctional aminoacyl-tRNA synthetase 0.0032 0.0364 0.0496
Leishmania major glucose transporter/membrane transporter D2, putative 0.0033 0.0389 0.4026

Activities

Activity type Activity value Assay description Source Reference
CC50 (functional) = 18 uM Cytotoxic concentration required to reduce the viability of mock-infected MT-4 cells by 50%. ChEMBL. 1995896
CC50 (functional) = 18 uM Cytotoxic concentration required to reduce the viability of mock-infected MT-4 cells by 50%. ChEMBL. 1995896
CC50 (functional) = 707 uM Cytotoxic concentration required to reduce the viability of mock-infected MT-4 cells by 50%. ChEMBL. 1995896
IC50 (functional) 0 uM Effective concentration required to achieve 50% protection of MT-4 cells against the cytopathic effect of HIV-1; I = Inactive ChEMBL. 1995896

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.
 
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External resources for this compound

Bibliographic References

1 literature reference was collected for this gene.

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