Detailed information for compound 912648

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 479.982 | Formula: C24H22ClN5O2S
  • H donors: 3 H acceptors: 4 LogP: 5.87 Rotable bonds: 7
    Rule of 5 violations (Lipinski): 1
  • SMILES: Cc1nc(Nc2ccc(cc2)NS(=O)(=O)c2cccc(c2)Cl)nc(c1)Nc1ccc(cc1)C
  • InChi: 1S/C24H22ClN5O2S/c1-16-6-8-19(9-7-16)27-23-14-17(2)26-24(29-23)28-20-10-12-21(13-11-20)30-33(31,32)22-5-3-4-18(25)15-22/h3-15,30H,1-2H3,(H2,26,27,28,29)
  • InChiKey: RKOVPJOKGRIWRR-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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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
Trypanosoma brucei DNA damage repair protein, putative 0.0006 0.0007 0.0008
Loa Loa (eye worm) ImpB/MucB/SamB family protein 0.0019 0.0397 0.0441
Toxoplasma gondii flap structure-specific endonuclease 1, putative 0.0025 0.0594 0.1221
Trypanosoma cruzi mitochondrial DNA polymerase beta-PAK, putative 0.014 0.4019 0.4626
Brugia malayi Nuclear hormone receptor family member nhr-14 0.001 0.0125 0.0175
Schistosoma mansoni flap endonuclease-1 0.0023 0.0521 0.0515
Echinococcus multilocularis COUP TF:Svp nuclear hormone receptor 0.001 0.0125 0.0004
Trypanosoma cruzi polo-like protein kinase, putative 0.0092 0.2599 0.2989
Trypanosoma cruzi mitochondrial DNA polymerase beta, putative 0.0296 0.868 1
Trichomonas vaginalis phosphoglycerate kinase, putative 0.0167 0.4818 1
Schistosoma mansoni acetyl-CoA C-acetyltransferase 0.0022 0.0492 0.0485
Trypanosoma brucei DNA polymerase kappa, putative 0.0019 0.0397 0.0457
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.001 0.0125 0.0004
Trypanosoma cruzi PAS-domain containing phosphoglycerate kinase, putative 0.0061 0.1662 0.1908
Plasmodium falciparum flap endonuclease 1 0.0025 0.0594 0.1221
Schistosoma mansoni zinc finger protein 0.0015 0.0279 0.0273
Schistosoma mansoni kinase 0.0047 0.1238 0.1232
Toxoplasma gondii phosphoglycerate kinase PGKII 0.0167 0.4818 1
Brugia malayi GTP-binding nuclear protein RAN/TC4 0.0021 0.0453 0.0661
Toxoplasma gondii HEAT repeat-containing protein 0.0028 0.0676 0.1391
Trichomonas vaginalis CAMK family protein kinase 0.0092 0.2599 0.5187
Brugia malayi ImpB/MucB/SamB family protein 0.0019 0.0397 0.0577
Trypanosoma cruzi DNA polymerase beta thumb, putative 0.0042 0.1075 0.1232
Loa Loa (eye worm) hypothetical protein 0.0148 0.4258 0.4808
Schistosoma mansoni retinoid-x-receptor (RXR) 0.001 0.0125 0.0118
Trichomonas vaginalis DNA polymerase eta, putative 0.0019 0.0397 0.0411
Echinococcus granulosus fetal alzheimer antigen falz 0.0022 0.0492 0.0424
Brugia malayi Nuclear hormone receptor family member nhr-40 0.001 0.0125 0.0175
Schistosoma mansoni phosphoglycerate kinase 0.0167 0.4818 0.4814
Trypanosoma brucei polo-like protein kinase 0.0092 0.2599 0.2994
Trypanosoma brucei unspecified product 0.0019 0.0397 0.0457
Trypanosoma brucei GTP-binding nuclear protein rtb2, putative 0.0021 0.0453 0.0522
Brugia malayi hypothetical protein 0.0231 0.6759 1
Brugia malayi Tyrosyl-DNA phosphodiesterase family protein 0.0065 0.1765 0.2604
Loa Loa (eye worm) tyrosyl-DNA phosphodiesterase 0.0065 0.1765 0.1989
Trypanosoma brucei DNA polymerase kappa, putative 0.0013 0.0221 0.0255
Trypanosoma brucei DNA polymerase kappa, putative 0.0006 0.0007 0.0008
Trichomonas vaginalis importin beta-1, putative 0.0023 0.0516 0.0671
Schistosoma mansoni hypothetical protein 0.0301 0.885 0.8849
Leishmania major DNA polymerase kappa, putative,DNA polymerase IV, putative 0.0019 0.0397 0.045
Schistosoma mansoni Tr4/Tr2 (homologue) 0.001 0.0125 0.0118
Brugia malayi Phosphoglycerate kinase 0.0061 0.1662 0.2451
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0017 0.0331 0.0324
Schistosoma mansoni bromodomain containing protein 0.0062 0.1685 0.168
Schistosoma mansoni steroid hormone receptor ad4bp 0.001 0.0125 0.0118
Loa Loa (eye worm) nuclear hormone receptor family member nhr-40 0.001 0.0125 0.0134
Trypanosoma cruzi mitochondrial DNA polymerase beta-PAK, putative 0.0051 0.1348 0.1546
Leishmania major protein kinase, putative,polo-like protein kinase, putative 0.0092 0.2599 0.2989
Mycobacterium tuberculosis Conserved hypothetical protein 0.0156 0.4492 0.9264
Loa Loa (eye worm) hypothetical protein 0.001 0.0125 0.0134
Loa Loa (eye worm) nuclear hormone receptor family member nhr-41 0.001 0.0125 0.0134
Loa Loa (eye worm) hypothetical protein 0.0167 0.4818 0.544
Echinococcus multilocularis bromodomain adjacent to zinc finger domain 0.0035 0.0884 0.0873
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.001 0.0125 0.0004
Trypanosoma brucei mitochondrial DNA polymerase beta-PAK 0.014 0.4019 0.463
Loa Loa (eye worm) steroid hormone receptor 0.001 0.0125 0.0134
Echinococcus multilocularis ecdysone induced protein 78C 0.001 0.0125 0.0004
Brugia malayi Bloom's syndrome protein homolog 0.0023 0.0535 0.0782
Loa Loa (eye worm) ATP-dependent DNA helicase 0.001 0.0122 0.013
Onchocerca volvulus Serine\/threonine kinase homolog 0.0092 0.2599 0.5985
Loa Loa (eye worm) hypothetical protein 0.001 0.0125 0.0134
Trichomonas vaginalis ran, putative 0.0021 0.0453 0.0534
Giardia lamblia GTP-binding nuclear protein RAN/TC4 0.0021 0.0453 0.0928
Trypanosoma cruzi flap endonuclease-1 (FEN-1), putative 0.0025 0.0594 0.0677
Echinococcus granulosus tyrosyl DNA phosphodiesterase 1 0.0065 0.1765 0.1883
Brugia malayi PHD-finger family protein 0.0024 0.0561 0.0821
Trypanosoma cruzi 3-phosphoglycerate kinase, glycosomal 0.0061 0.1662 0.1908
Brugia malayi Iron-sulfur cluster assembly accessory protein 0.0047 0.1244 0.1833
Trypanosoma brucei DNA damage repair protein, putative 0.0006 0.0007 0.0008
Schistosoma mansoni nuclear hormone receptor 0.001 0.0125 0.0118
Trypanosoma brucei DNA polymerase kappa, putative 0.0019 0.0397 0.0457
Echinococcus granulosus geminin 0.0166 0.4796 0.5355
Trypanosoma cruzi ATP-dependent DEAD/H DNA helicase recQ, putative 0.0013 0.0207 0.0231
Entamoeba histolytica Flap nuclease, putative 0.0025 0.0594 0.084
Echinococcus multilocularis bromodomain adjacent to zinc finger domain 0.0058 0.158 0.1671
Schistosoma mansoni retinoic acid receptor RXR 0.001 0.0125 0.0118
Schistosoma mansoni zinc finger protein 0.0019 0.0405 0.0398
Trypanosoma cruzi phosphoglycerate kinase, putative 0.0167 0.4818 0.5547
Toxoplasma gondii phosphoglycerate kinase PGKI 0.0167 0.4818 1
Loa Loa (eye worm) nuclear hormone receptor family member nhr-49 0.001 0.0125 0.0134
Brugia malayi Nuclear hormone receptor family member nhr-31 0.001 0.0125 0.0175
Giardia lamblia DINP protein human, muc B family 0.0019 0.0397 0.0811
Loa Loa (eye worm) flap endonuclease-1 0.0025 0.0594 0.0664
Trypanosoma brucei DNA polymerase kappa, putative 0.0019 0.0397 0.0457
Schistosoma mansoni rab geranylgeranyl transferase alpha subunit 0.0019 0.0397 0.039
Loa Loa (eye worm) hypothetical protein 0.0069 0.1903 0.2145
Leishmania major mitochondrial DNA polymerase beta 0.0296 0.868 1
Trypanosoma brucei DNA polymerase IV, putative 0.0019 0.0397 0.0457
Loa Loa (eye worm) hypothetical protein 0.0118 0.3371 0.3805
Echinococcus multilocularis bloom syndrome protein 0.0023 0.0535 0.0473
Giardia lamblia Phosphoglycerate kinase 0.0167 0.4818 1
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0017 0.0331 0.0324
Trypanosoma brucei tyrosyl-DNA Phosphodiesterase (Tdp1), putative 0.0065 0.1765 0.2034
Trypanosoma brucei DNA polymerase kappa, putative 0.0019 0.0397 0.0457
Leishmania major importin beta-1 subunit, putative 0.0023 0.0516 0.0587
Echinococcus granulosus survival motor neuron protein 1 0.0231 0.6759 0.7605
Brugia malayi Phosphoglycerate kinase 0.0167 0.4818 0.7124
Loa Loa (eye worm) hypothetical protein 0.001 0.0125 0.0134
Trichomonas vaginalis flap endonuclease-1, putative 0.0025 0.0594 0.084
Trichomonas vaginalis DNA helicase recq, putative 0.0023 0.0535 0.071
Loa Loa (eye worm) hypothetical protein 0.0044 0.1143 0.1285
Trypanosoma cruzi phosphoglycerate kinase, putative 0.0061 0.1662 0.1908
Toxoplasma gondii hypothetical protein 0.0048 0.1258 0.2602
Schistosoma mansoni nuclear hormone receptor nor-1/nor-2 0.001 0.0125 0.0118
Brugia malayi Nuclear hormone receptor family member nhr-49 0.001 0.0125 0.0175
Toxoplasma gondii ATP-dependent DNA helicase, RecQ family protein 0.001 0.0122 0.0239
Toxoplasma gondii ImpB/MucB/SamB family protein 0.0031 0.0753 0.1551
Trypanosoma cruzi tyrosyl-DNA Phosphodiesterase (Tdp1), putative 0.0065 0.1765 0.2028
Echinococcus multilocularis FTZ F1 alpha 0.001 0.0125 0.0004
Trichomonas vaginalis CAMK family protein kinase 0.0092 0.2599 0.5187
Leishmania major tyrosyl-DNA phosphodiesterase 1 0.0065 0.1765 0.2028
Wolbachia endosymbiont of Brugia malayi phosphoglycerate kinase 0.0167 0.4818 0.5
Echinococcus granulosus retinoic acid receptor rxr beta a 0.001 0.0125 0.0004
Echinococcus granulosus transcription factor Dp 1 0.0037 0.0951 0.095
Loa Loa (eye worm) hypothetical protein 0.0028 0.0676 0.0757
Leishmania major DNA polymerase eta, putative 0.0031 0.0753 0.0861
Echinococcus multilocularis phosphoglycerate kinase 1 0.0167 0.4818 0.538
Plasmodium falciparum phosphoglycerate kinase 0.0167 0.4818 1
Toxoplasma gondii ATP-dependent DNA helicase, RecQ family protein 0.0016 0.0301 0.0612
Schistosoma mansoni terminal deoxycytidyl transferase 0.0019 0.0397 0.039
Echinococcus multilocularis dna polymerase eta 0.0044 0.1143 0.117
Entamoeba histolytica tyrosyl-DNA phosphodiesterase, putative 0.0065 0.1765 0.338
Trypanosoma brucei hypothetical protein, conserved 0.0006 0.0007 0.0008
Echinococcus granulosus FTZ F1 alpha 0.001 0.0125 0.0004
Echinococcus granulosus bromodomain adjacent to zinc finger domain 0.0058 0.158 0.1671
Plasmodium falciparum GTP-binding nuclear protein RAN/TC4 0.0021 0.0453 0.0928
Trichomonas vaginalis CAMK family protein kinase 0.0092 0.2599 0.5187
Plasmodium falciparum ADP-dependent DNA helicase RecQ 0.0021 0.0449 0.092
Echinococcus granulosus snurportin 1 0.0301 0.885 1
Brugia malayi Importin beta-1 subunit 0.0028 0.0676 0.0991
Trypanosoma cruzi GTP-binding nuclear protein rtb2, putative 0.0021 0.0453 0.0515
Brugia malayi Nuclear hormone receptor family member nhr-25 0.001 0.0125 0.0175
Entamoeba histolytica deoxycytidyl transferase, putative 0.0019 0.0397 0.0411
Schistosoma mansoni coup transcription factor 0.001 0.0125 0.0118
Entamoeba histolytica Ran family GTPase 0.0021 0.0453 0.0534
Loa Loa (eye worm) RecQ helicase 0.0023 0.0535 0.0597
Toxoplasma gondii GTP-binding nuclear protein ran/tc4 0.0021 0.0453 0.0928
Loa Loa (eye worm) hypothetical protein 0.0042 0.1081 0.1215
Echinococcus multilocularis GTP binding nuclear protein Ran 0.0021 0.0453 0.038
Mycobacterium tuberculosis Probable phosphoglycerate kinase Pgk 0.0167 0.4818 1
Brugia malayi Nuclear hormone receptor family member nhr-25 0.001 0.0125 0.0175
Brugia malayi Nuclear hormone receptor family member nhr-19 0.001 0.0125 0.0175
Schistosoma mansoni blooms syndrome DNA helicase 0.0019 0.0387 0.038
Loa Loa (eye worm) GTP-binding nuclear protein RAN/TC4 0.0021 0.0453 0.0505
Schistosoma mansoni phosphoglycerate kinase 0.0167 0.4818 0.4814
Loa Loa (eye worm) hypothetical protein 0.001 0.0125 0.0134
Schistosoma mansoni ran 0.0021 0.0453 0.0447
Echinococcus granulosus importin subunit beta 1 0.0028 0.0676 0.0635
Trichomonas vaginalis CAMK family protein kinase 0.0092 0.2599 0.5187
Brugia malayi photoreceptor-specific nuclear receptor 0.001 0.0125 0.0175
Brugia malayi Bromodomain containing protein 0.0073 0.2029 0.2994
Echinococcus granulosus dna polymerase eta 0.0044 0.1143 0.117
Brugia malayi ATP-dependent DNA helicase, RecQ family protein 0.001 0.0122 0.017
Brugia malayi Nuclear hormone receptor family member nhr-41 0.001 0.0125 0.0175
Trypanosoma cruzi GTP-binding nuclear protein rtb2, putative 0.0021 0.0453 0.0515
Echinococcus multilocularis zinc finger protein 0.0019 0.0405 0.0324
Trypanosoma cruzi ISWI complex protein 0.0015 0.0279 0.0314
Toxoplasma gondii ATP-dependent DNA helicase, RecQ family protein 0.001 0.0122 0.0239
Leishmania major DNA polymerase eta, putative 0.0044 0.1143 0.131
Loa Loa (eye worm) hypothetical protein 0.0038 0.0955 0.1073
Plasmodium vivax importin-beta 2, putative 0.0028 0.0676 0.1391
Trypanosoma brucei phosphoglycerate kinase 0.0167 0.4818 0.555
Brugia malayi nuclear hormone receptor 0.001 0.0125 0.0175
Trypanosoma brucei DNA polymerase kappa, putative 0.0019 0.0397 0.0457
Plasmodium vivax phosphoglycerate kinase, putative 0.0167 0.4818 1
Trypanosoma cruzi mitochondrial DNA polymerase beta-PAK, putative 0.0042 0.1075 0.1232
Loa Loa (eye worm) nucleolar RNA-associated protein alpha 0.0301 0.885 1
Trypanosoma brucei DNA polymerase kappa, putative 0.0019 0.0397 0.0457
Leishmania major ATP-dependent DEAD/H DNA helicase recQ, putative 0.0013 0.0207 0.0231
Trypanosoma brucei ISWI complex protein 0.0015 0.0279 0.0322
Loa Loa (eye worm) hypothetical protein 0.001 0.0125 0.0134
Leishmania major phosphoglycerate kinase B, cytosolic 0.0167 0.4818 0.5547
Loa Loa (eye worm) nuclear hormone receptor family member nhr-14 0.001 0.0125 0.0134
Trypanosoma brucei unspecified product 0.0013 0.0221 0.0255
Schistosoma mansoni hypothetical protein 0.002 0.0436 0.0429
Schistosoma mansoni DNA polymerase eta 0.0044 0.1143 0.1137
Brugia malayi Nuclear hormone receptor family member nhr-19 0.001 0.0125 0.0175
Plasmodium falciparum importin beta, putative 0.0028 0.0676 0.1391
Schistosoma mansoni DNA helicase recq5 0.001 0.0122 0.0115
Echinococcus granulosus flap endonuclease 1 0.0025 0.0594 0.0542
Trypanosoma brucei ATP-dependent DEAD/H DNA helicase recQ, putative 0.0013 0.0207 0.0238
Schistosoma mansoni nuclear receptor 2DBD-gamma 0.001 0.0125 0.0118
Entamoeba histolytica serine/threonine protein kinase, putative 0.0092 0.2599 0.5187
Trypanosoma brucei DNA polymerase IV, putative 0.0019 0.0397 0.0457
Echinococcus multilocularis snurportin 1 0.0301 0.885 1
Trypanosoma cruzi phosphoglycerate kinase, putative 0.0061 0.1662 0.1908
Trypanosoma cruzi DNA polymerase kappa, putative 0.0019 0.0397 0.045
Leishmania major hypothetical protein, conserved 0.0015 0.0279 0.0314
Leishmania major phosphoglycerate kinase C, glycosomal 0.0167 0.4818 0.5547
Giardia lamblia Sgs1 DNA helicase, putative 0.001 0.0122 0.0239
Schistosoma mansoni tyrosyl-DNA phosphodiesterase 0.0065 0.1765 0.176
Trichomonas vaginalis CAMK family protein kinase 0.0092 0.2599 0.5187
Onchocerca volvulus 0.0148 0.4258 1
Trypanosoma brucei DNA polymerase kappa, putative 0.0019 0.0397 0.0457
Trypanosoma brucei flap endonuclease-1 (FEN-1), putative 0.0025 0.0594 0.0685
Loa Loa (eye worm) PHD-finger family protein 0.002 0.0436 0.0485
Loa Loa (eye worm) bromodomain containing protein 0.0017 0.0349 0.0387
Trypanosoma brucei hypothetical protein, conserved 0.0006 0.0007 0.0008
Brugia malayi Steroid receptor seven-up type 2 0.001 0.0125 0.0175
Echinococcus granulosus bloom syndrome protein 0.0023 0.0535 0.0473
Loa Loa (eye worm) nuclear Hormone Receptor family member 0.001 0.0125 0.0134
Trypanosoma brucei DNA polymerase kappa, putative 0.0019 0.0397 0.0457
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.001 0.0125 0.0175
Loa Loa (eye worm) hypothetical protein 0.0017 0.0331 0.0367
Entamoeba histolytica phosphoglycerate kinase, putative 0.0167 0.4818 1
Mycobacterium leprae Probable phosphoglycerate kinase Pgk 0.0167 0.4818 0.5
Loa Loa (eye worm) hypothetical protein 0.001 0.0125 0.0134
Loa Loa (eye worm) PLK/PLK1 protein kinase 0.0092 0.2599 0.2931
Echinococcus granulosus hepatocyte nuclear factor 4 alpha 0.001 0.0125 0.0004
Brugia malayi ecdysteroid receptor 0.001 0.0125 0.0175
Echinococcus multilocularis transcription factor Dp 1 0.0037 0.0951 0.095
Schistosoma mansoni DNA helicase recq1 0.001 0.0122 0.0115
Trichomonas vaginalis phosphoglycerate kinase, putative 0.0167 0.4818 1
Trypanosoma cruzi DNA polymerase eta, putative 0.0044 0.1143 0.131
Trypanosoma brucei importin beta-1 subunit, putative 0.0028 0.0676 0.0779
Echinococcus granulosus phosphoglycerate kinase 1 0.0167 0.4818 0.538
Echinococcus multilocularis dna polymerase kappa 0.0019 0.0397 0.0315
Echinococcus multilocularis thyroid hormone receptor alpha 0.001 0.0125 0.0004
Brugia malayi Nuclear hormone receptor-like 1 0.001 0.0125 0.0175
Brugia malayi hypothetical protein 0.0148 0.4258 0.6296
Loa Loa (eye worm) hypothetical protein 0.0231 0.6759 0.7636
Trypanosoma cruzi tyrosyl-DNA Phosphodiesterase (Tdp1), putative 0.0065 0.1765 0.2028
Schistosoma mansoni survival motor neuron protein 0.0047 0.1244 0.1238
Mycobacterium ulcerans hypothetical protein 0.0156 0.4492 0.9323
Trichomonas vaginalis CAMK family protein kinase 0.0092 0.2599 0.5187
Echinococcus granulosus terminal deoxycytidyl transferase rev1 0.0019 0.0397 0.0315
Trypanosoma brucei unspecified product 0.0013 0.0221 0.0255
Echinococcus multilocularis methyl CpG binding domain protein 2 0.0017 0.0331 0.024
Schistosoma mansoni ran 0.0021 0.0453 0.0447
Brugia malayi Nuclear hormone receptor family member nhr-3 0.001 0.0125 0.0175
Schistosoma mansoni thyroid hormone receptor 0.001 0.0125 0.0118
Brugia malayi ATP-dependent DNA helicase, RecQ family protein 0.001 0.0122 0.017
Trypanosoma cruzi DNA polymerase kappa, putative 0.0019 0.0397 0.045
Giardia lamblia Flap structure-specific endonuclease 0.0025 0.0594 0.1221
Trypanosoma cruzi mitochondrial DNA polymerase beta, putative 0.0296 0.868 1
Trypanosoma cruzi PAS-domain containing phosphoglycerate kinase, putative 0.0061 0.1662 0.1908
Loa Loa (eye worm) nuclear hormone receptor family member nhr-1 0.001 0.0125 0.0134
Trichomonas vaginalis Importin beta-1 subunit, putative 0.0023 0.0516 0.0671
Entamoeba histolytica hypothetical protein 0.0023 0.0516 0.0671
Trypanosoma brucei DNA polymerase kappa, putative 0.0019 0.0397 0.0457
Loa Loa (eye worm) nuclear hormone receptor family member nhr-31 0.001 0.0125 0.0134
Trypanosoma brucei DNA polymerase beta thumb, putative 0.0042 0.1075 0.1239
Trypanosoma brucei DNA polymerase kappa, putative 0.0013 0.0221 0.0255
Brugia malayi steroid hormone receptor 0.001 0.0125 0.0175
Leishmania major PAS-domain containing phosphoglycerate kinase, putative 0.0061 0.1662 0.1908
Brugia malayi Bromodomain containing protein 0.0037 0.0953 0.1402
Trichomonas vaginalis CAMK family protein kinase 0.0046 0.1201 0.2156
Trypanosoma brucei DNA polymerase kappa, putative 0.0019 0.0397 0.0457
Leishmania major flap endonuclease-1 (FEN-1), putative 0.0025 0.0594 0.0677
Onchocerca volvulus 0.0047 0.1244 0.2708
Trypanosoma brucei DNA polymerase IV, putative 0.0019 0.0397 0.0457
Schistosoma mansoni RAR-like nuclear receptor 0.001 0.0125 0.0118
Giardia lamblia Kinase, PLK 0.0092 0.2599 0.5388
Echinococcus granulosus GTP binding nuclear protein Ran 0.0021 0.0453 0.038
Trichomonas vaginalis CAMK family protein kinase 0.0092 0.2599 0.5187
Trypanosoma cruzi DNA polymerase eta, putative 0.0031 0.0753 0.0861
Echinococcus multilocularis tyrosyl DNA phosphodiesterase 1 0.0065 0.1765 0.1883
Echinococcus granulosus nuclear receptor 2DBD gamma 0.001 0.0125 0.0004
Plasmodium vivax flap endonuclease 1, putative 0.0025 0.0594 0.1221
Echinococcus granulosus ecdysone induced protein 78C 0.001 0.0125 0.0004
Trypanosoma brucei DNA polymerase kappa, putative 0.0013 0.0221 0.0255
Trypanosoma brucei phosphoglycerate kinase, putative 0.0061 0.1662 0.1914
Brugia malayi serine/threonine-protein kinase plk-2 0.0092 0.2599 0.3839
Echinococcus granulosus zinc finger protein 0.0019 0.0405 0.0324
Mycobacterium ulcerans DNA polymerase IV 0.0019 0.0397 0.0811
Treponema pallidum phosphoglycerate kinase 0.0167 0.4818 0.5
Loa Loa (eye worm) hypothetical protein 0.001 0.0125 0.0134
Brugia malayi ImpB/MucB/SamB family protein 0.0044 0.1143 0.1683
Plasmodium vivax ADP-dependent DNA helicase RecQ, putative 0.0016 0.0307 0.0624
Trichomonas vaginalis DNA polymerase IV / kappa, putative 0.0019 0.0397 0.0411
Trypanosoma cruzi DNA polymerase kappa, putative 0.0019 0.0397 0.045
Mycobacterium ulcerans phosphoglycerate kinase 0.0167 0.4818 1
Schistosoma mansoni FTZ-F1 nuclear receptor-like protein 0.001 0.0125 0.0118
Echinococcus multilocularis fetal alzheimer antigen, falz 0.0022 0.0492 0.0424
Echinococcus multilocularis FTZ F1 nuclear receptor protein 0.001 0.0125 0.0004
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.001 0.0125 0.0175
Echinococcus multilocularis hepatocyte nuclear factor 4 alpha 0.001 0.0125 0.0004
Echinococcus granulosus serine:threonine protein kinase PLK1 0.0092 0.2599 0.2838
Echinococcus multilocularis flap endonuclease 1 0.0025 0.0594 0.0542
Trypanosoma brucei importin beta-1 subunit, putative 0.0028 0.0676 0.0779
Trichomonas vaginalis DNA helicase recq1, putative 0.0023 0.0535 0.071
Schistosoma mansoni hypothetical protein 0.0166 0.4796 0.4792
Echinococcus multilocularis terminal deoxycytidyl transferase rev1 0.0019 0.0397 0.0315
Echinococcus multilocularis survival motor neuron protein 1 0.0231 0.6759 0.7605
Trypanosoma cruzi phosphoglycerate kinase, putative 0.0167 0.4818 0.5547
Trypanosoma brucei mitochondrial DNA polymerase beta 0.0296 0.868 1
Trypanosoma cruzi DNA polymerase kappa, putative 0.0019 0.0397 0.045
Echinococcus granulosus Nuclear hormone receptor family member nhr 41 0.001 0.0125 0.0004
Echinococcus granulosus dna polymerase kappa 0.0019 0.0397 0.0315
Echinococcus multilocularis serine:threonine protein kinase PLK1 0.0092 0.2599 0.2838
Trichomonas vaginalis CAMK family protein kinase 0.0046 0.1201 0.2156
Echinococcus granulosus COUP TF:Svp nuclear hormone receptor 0.001 0.0125 0.0004
Trypanosoma cruzi ISWI complex protein 0.0015 0.0279 0.0314
Trypanosoma cruzi importin beta-1 subunit, putative 0.0023 0.0516 0.0587
Trypanosoma cruzi polo-like protein kinase, putative 0.0092 0.2599 0.2989
Echinococcus multilocularis geminin 0.0166 0.4796 0.5355
Echinococcus multilocularis Nuclear hormone receptor family member nhr 41 0.001 0.0125 0.0004
Brugia malayi Nuclear hormone receptor family member nhr-1 0.001 0.0125 0.0175
Leishmania major GTP-binding protein, putative 0.0021 0.0453 0.0515
Chlamydia trachomatis phosphoglycerate kinase 0.0167 0.4818 0.5
Echinococcus granulosus nuclear receptor 2DBD gamma 0.001 0.0125 0.0004
Trypanosoma brucei DNA polymerase kappa, putative 0.0006 0.0007 0.0008
Trypanosoma brucei phosphoglycerate kinase 0.0061 0.1662 0.1914
Brugia malayi RNA, U transporter 1 0.008 0.2234 0.3298
Brugia malayi nuclear receptor NHR-88 0.001 0.0125 0.0175
Echinococcus granulosus histone lysine methyltransferase setb 0.0017 0.0331 0.024
Schistosoma mansoni hypothetical protein 0.0047 0.1244 0.1238
Schistosoma mansoni photoreceptor-specific nuclear receptor related 0.001 0.0125 0.0118
Schistosoma mansoni hypothetical protein 0.0015 0.0279 0.0273
Schistosoma mansoni importin beta-1 0.0028 0.0676 0.067
Echinococcus multilocularis importin subunit beta 1 0.0028 0.0676 0.0635
Leishmania major DNA polymerase kappa, putative 0.0019 0.0397 0.045
Schistosoma mansoni serine/threonine protein kinase 0.0092 0.2599 0.2594
Loa Loa (eye worm) hypothetical protein 0.001 0.0122 0.013
Echinococcus multilocularis histone lysine methyltransferase setb histone lysine methyltransferase eggless 0.0017 0.0331 0.024
Mycobacterium ulcerans DNA polymerase IV 0.0019 0.0397 0.0811
Brugia malayi Flap endonuclease-1 0.0025 0.0594 0.087
Trypanosoma cruzi DNA polymerase beta thumb, putative 0.0042 0.1075 0.1232
Loa Loa (eye worm) hypothetical protein 0.001 0.0125 0.0134
Plasmodium falciparum ATP-dependent DNA helicase Q1 0.001 0.0122 0.0239
Schistosoma mansoni thyroid hormone receptor 0.001 0.0125 0.0118
Schistosoma mansoni methyl-cpg binding protein mbd 0.0017 0.0331 0.0324
Plasmodium vivax GTP-binding nuclear protein RAN/TC4, putative 0.0021 0.0453 0.0928
Schistosoma mansoni hypothetical protein 0.0166 0.4796 0.4792
Trichomonas vaginalis Importin beta-1 subunit, putative 0.0023 0.0516 0.0671
Echinococcus granulosus bromodomain adjacent to zinc finger domain 0.0035 0.0884 0.0873
Echinococcus granulosus FTZ F1 nuclear receptor protein 0.001 0.0125 0.0004
Schistosoma mansoni methyl-cpg binding protein mbd 0.0017 0.0331 0.0324
Trypanosoma brucei phosphoglycerate kinase 0.0167 0.4818 0.555
Echinococcus granulosus methyl CpG binding domain protein 2 0.0017 0.0331 0.024
Leishmania major mitochondrial DNA polymerase beta-PAK, putative 0.014 0.4019 0.4626
Loa Loa (eye worm) hypothetical protein 0.004 0.1025 0.1151
Trypanosoma brucei chrX additional, unordered contigs 0.0006 0.0007 0.0008
Trypanosoma brucei DNA polymerase eta, putative 0.0044 0.1143 0.1317

Activities

Activity type Activity value Assay description Source Reference
EC50 (functional) 1.4587 uM ST_JUDE: Plasmodium falciparum 3D7 EC50 (uM) as measured by SYBR green dye ChEMBL. 20485428
EC50 (functional) = 1.46 uM Plasmodium falciparum 3D7 EC50 (uM) as measured by SYBR green dye Saint Jude. 20485428
EC50 (functional) = 15 uM Plasmodium falciparum K1 EC50 (uM) as measured by SYBR green dye Saint Jude. 20485428
EC50 (functional) > 15 uM ST_JUDE: Plasmodium falciparum K1 EC50 (uM) as measured by SYBR green dye ChEMBL. 20485428
Percent growth inhibition (functional) = 88 % Plasmodium falciparum 3D7 % growth inhibition at 7uM as measured by YOYO-3 red dye Saint Jude. 20485428
Percent growth inhibition (functional) = 101.1 % Plasmodium falciparum 3D7 % growth inhibition at 7uM as measured by SYBR green dye Saint Jude. 20485428

Phenotypes

Whole-cell/tissue/organism interactions

Species name Source Reference Is orphan
Plasmodium falciparum ChEMBL23 20485428

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

No literature references available for this target.

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