Detailed information for compound 1617542

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 461.559 | Formula: C25H31N7O2
  • H donors: 4 H acceptors: 5 LogP: 4.93 Rotable bonds: 7
    Rule of 5 violations (Lipinski): 1
  • SMILES: CNc1nc(NC2CCN(CC2)C(=O)c2ccc(cc2)O)nc(n1)Nc1c(C)cc(cc1C)C
  • InChi: 1S/C25H31N7O2/c1-15-13-16(2)21(17(3)14-15)28-25-30-23(26-4)29-24(31-25)27-19-9-11-32(12-10-19)22(34)18-5-7-20(33)8-6-18/h5-8,13-14,19,33H,9-12H2,1-4H3,(H3,26,27,28,29,30,31)
  • InChiKey: XEJLEXKPUZJZRF-UHFFFAOYSA-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
Trichomonas vaginalis phosphatidylinositol kinase, putative 0.0045 0.0435 0.0431
Leishmania major phosphatidylinositol 3-related kinase, putative 0.0235 0.3113 0.3202
Echinococcus multilocularis protein patched 0.0038 0.0328 0.0311
Trypanosoma cruzi phosphatidylinositol 4-kinase alpha, putative 0.0045 0.0435 0.0431
Trypanosoma brucei phosphatidylinositol 3-kinase tor, putative 0.0331 0.4474 0.4609
Plasmodium vivax acyl-CoA synthetase, putative 0.0031 0.0228 0.5036
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.07 0.9687 1
Entamoeba histolytica hypothetical protein 0.0032 0.0249 0.024
Loa Loa (eye worm) phosphatidylinositol 3 0.0045 0.0435 0.0449
Echinococcus granulosus phosphatidylinositol 4 kinase beta 0.0045 0.0435 0.0431
Entamoeba histolytica phosphatidylinositol3-kinaseTor2, putative 0.07 0.9687 1
Echinococcus multilocularis phosphatidylinositol 3 and 4 kinase 0.0235 0.3113 0.3101
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0017 0.0043 0.0025
Leishmania major 4-coumarate:coa ligase-like protein 0.0041 0.0374 0.0368
Giardia lamblia Hypothetical protein 0.0045 0.0435 0.0431
Echinococcus granulosus PIK kinase FAT and Armadillo domain containing protein 0.0102 0.1243 0.1267
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0017 0.0043 0.0044
Loa Loa (eye worm) hypothetical protein 0.0041 0.0374 0.0386
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.0045 0.0435 0.0449
Loa Loa (eye worm) hypothetical protein 0.0017 0.0043 0.0044
Brugia malayi steroid hormone receptor 0.0017 0.0043 0.0044
Echinococcus granulosus Nuclear hormone receptor family member nhr 41 0.0017 0.0043 0.0026
Echinococcus granulosus FTZ F1 alpha 0.0017 0.0043 0.0026
Plasmodium falciparum phosphatidylinositol 3- and 4-kinase, putative 0.0045 0.0435 1
Brugia malayi Steroid receptor seven-up type 2 0.0017 0.0043 0.0044
Echinococcus granulosus phosphatidylinositol 3 kinase catalytic subunit 0.0045 0.0435 0.0431
Loa Loa (eye worm) hypothetical protein 0.0088 0.1036 0.1069
Plasmodium vivax hypothetical protein, conserved 0.0045 0.0435 1
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD5 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0029 0.0204 0.1098
Schistosoma mansoni retinoic acid receptor RXR 0.0017 0.0043 0.0026
Echinococcus granulosus phosphatidylinositol 4 kinase alpha 0.0045 0.0435 0.0431
Brugia malayi Nuclear hormone receptor family member nhr-3 0.0017 0.0043 0.0044
Loa Loa (eye worm) hypothetical protein 0.0031 0.0228 0.0235
Trichomonas vaginalis PIKK family atypical protein kinase 0.0045 0.0435 0.0431
Toxoplasma gondii phosphatidylinositol 3- and 4-kinase 0.0045 0.0435 0.0585
Toxoplasma gondii phosphatidylinositol 3- and 4-kinase 0.0045 0.0435 0.0585
Trichomonas vaginalis PIKK family atypical protein kinase 0.0132 0.1667 0.1706
Trypanosoma brucei phosphatidylinositol 3-related kinase, putative 0.0235 0.3113 0.3202
Echinococcus multilocularis thyroid hormone receptor alpha 0.0017 0.0043 0.0025
Leishmania major hypothetical protein, conserved 0.0045 0.0435 0.0431
Plasmodium falciparum acyl-CoA synthetase 0.0031 0.0228 0.5036
Echinococcus multilocularis PIK kinase, FAT and Armadillo domain containing protein 0.0102 0.1243 0.1227
Loa Loa (eye worm) exodeoxyribonuclease III family protein 0.0016 0.0018 0.0018
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0017 0.0043 0.0044
Trichomonas vaginalis PIKK family atypical protein kinase 0.07 0.9687 1
Trichomonas vaginalis phosphatidylinositol 3-kinase catalytic subunit alpha, beta, delta, putative 0.0045 0.0435 0.0431
Loa Loa (eye worm) hypothetical protein 0.0031 0.0228 0.0235
Echinococcus multilocularis FTZ F1 alpha 0.0017 0.0043 0.0025
Trypanosoma cruzi Phosphatidylinositol 3-kinase tor1 0.07 0.9687 1
Treponema pallidum exodeoxyribonuclease (exoA) 0.0016 0.0018 0.5
Schistosoma mansoni RAR-like nuclear receptor 0.0017 0.0043 0.0026
Trichomonas vaginalis phosphatidylinositol kinase, putative 0.0045 0.0435 0.0431
Brugia malayi Nuclear hormone receptor family member nhr-40 0.0017 0.0043 0.0044
Trichomonas vaginalis PIKK family atypical protein kinase 0.07 0.9687 1
Mycobacterium tuberculosis Fatty-acid-AMP ligase FadD30 (fatty-acid-AMP synthetase) (fatty-acid-AMP synthase) 0.0031 0.0228 0.1236
Echinococcus granulosus Protein patched homolog 1 0.0038 0.0328 0.0321
Trypanosoma cruzi phosphatidylinositol 3-kinase 2, putative 0.0045 0.0435 0.0431
Giardia lamblia Phosphatidylinositol 4-kinase 0.0045 0.0435 0.0431
Schistosoma mansoni FTZ-F1 nuclear receptor-like protein 0.0017 0.0043 0.0026
Loa Loa (eye worm) hypothetical protein 0.0045 0.0435 0.0449
Entamoeba histolytica phosphatidylinositol 3-kinase, putative 0.0045 0.0435 0.0431
Brugia malayi ecdysteroid receptor 0.0017 0.0043 0.0044
Trypanosoma cruzi phosphatidylinositol 4-kinase, putative 0.0045 0.0435 0.0431
Trichomonas vaginalis PIKK family atypical protein kinase 0.0521 0.7152 0.7379
Entamoeba histolytica Phosphatidylinositol 3- and 4-kinase family 0.0132 0.1667 0.1706
Loa Loa (eye worm) hypothetical protein 0.0038 0.0328 0.0339
Trichomonas vaginalis conserved hypothetical protein 0.0038 0.0328 0.0321
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0017 0.0043 0.0044
Trichomonas vaginalis PIKK family atypical protein kinase 0.0598 0.824 0.8504
Echinococcus multilocularis protein dispatched 1 0.0043 0.0403 0.0386
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.0045 0.0435 0.0449
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0017 0.0043 0.0044
Loa Loa (eye worm) phosphatidylinositol 3 0.0045 0.0435 0.0449
Trichomonas vaginalis PIKK family atypical protein kinase 0.0454 0.6217 0.6412
Trichomonas vaginalis PIKK family atypical protein kinase 0.0377 0.5129 0.5286
Echinococcus multilocularis hepatocyte nuclear factor 4 alpha 0.0017 0.0043 0.0025
Schistosoma mansoni hypothetical protein 0.0045 0.0435 0.0431
Echinococcus multilocularis 0.0045 0.0435 0.0418
Giardia lamblia GTOR 0.07 0.9687 1
Entamoeba histolytica phosphatidylinositol 3-kinase 3, putative 0.0045 0.0435 0.0431
Trypanosoma brucei FAT domain/Rapamycin binding domain/Phosphatidylinositol 3- and 4-kinase, putative 0.0291 0.3904 0.402
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.0132 0.1667 0.1721
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0017 0.0043 0.0025
Echinococcus granulosus serine:threonine protein kinase SMG1 0.0132 0.1667 0.1706
Schistosoma mansoni hypothetical protein 0.0102 0.1243 0.1267
Schistosoma mansoni retinoid-x-receptor (RXR) 0.0017 0.0043 0.0026
Trypanosoma cruzi phosphatidylinositol kinase, putative 0.0045 0.0435 0.0431
Loa Loa (eye worm) hypothetical protein 0.0017 0.0043 0.0044
Leishmania major target of rapamycin kinase (TOR) kinase 3 0.0557 0.7671 0.7916
Mycobacterium ulcerans long-chain fatty-acid CoA ligase 0.0041 0.0374 0.2094
Toxoplasma gondii phosphatidylinositol 3- and 4-kinase 0.0045 0.0435 0.0585
Schistosoma mansoni coup transcription factor 0.0017 0.0043 0.0026
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0017 0.0043 0.0044
Schistosoma mansoni Tr4/Tr2 (homologue) 0.0017 0.0043 0.0026
Schistosoma mansoni hypothetical protein 0.0036 0.0309 0.0301
Trichomonas vaginalis conserved hypothetical protein 0.0148 0.1881 0.1927
Entamoeba histolytica hypothetical protein 0.0032 0.0249 0.024
Brugia malayi AMP-binding enzyme family protein 0.0041 0.0374 0.0386
Loa Loa (eye worm) hypothetical protein 0.0041 0.0374 0.0386
Echinococcus multilocularis phosphatidylinositol 4 phosphate 3 kinase C2 0.0045 0.0435 0.0418
Leishmania major phosphatidylinositol kinase, putative 0.0045 0.0435 0.0431
Entamoeba histolytica phosphatidylinositol 3-kinase, putative 0.0045 0.0435 0.0431
Entamoeba histolytica hypothetical protein 0.0132 0.1667 0.1706
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0041 0.0372 0.0367
Echinococcus granulosus phosphatidylinositol 3 and 4 kinase 0.0235 0.3113 0.3202
Mycobacterium ulcerans acyl-CoA synthetase 0.0041 0.0374 0.2094
Trypanosoma brucei phosphatidylinositol 3-kinase, putative 0.0235 0.3113 0.3202
Trichomonas vaginalis PIKK family atypical protein kinase 0.0235 0.3113 0.3202
Trypanosoma cruzi phosphatidylinositol 4-kinase alpha, putative 0.0045 0.0435 0.0431
Echinococcus multilocularis serine protein kinase ATM 0.0132 0.1667 0.1652
Loa Loa (eye worm) nuclear Hormone Receptor family member 0.0017 0.0043 0.0044
Schistosoma mansoni ataxia telangiectasia mutated (atm)-related 0.07 0.9687 1
Trichomonas vaginalis PIKK family atypical protein kinase 0.0132 0.1667 0.1706
Mycobacterium ulcerans hypothetical protein 0.0041 0.0374 0.2094
Brugia malayi FAT domain containing protein 0.0102 0.1243 0.1283
Schistosoma mansoni nuclear receptor 2DBD-gamma 0.0017 0.0043 0.0026
Schistosoma mansoni phosphatidylinositol 4-kinase 0.0045 0.0435 0.0431
Loa Loa (eye worm) hypothetical protein 0.0031 0.0228 0.0235
Trypanosoma cruzi phosphatidylinositol kinase related protein, putative 0.0087 0.1029 0.1046
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0041 0.0372 0.0367
Entamoeba histolytica hypothetical protein 0.0045 0.0435 0.0431
Mycobacterium ulcerans acyl-CoA synthetase 0.0041 0.0374 0.2094
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.0045 0.0435 0.0449
Brugia malayi CHE-14 protein 0.0038 0.0328 0.0339
Trypanosoma cruzi phosphatidylinositol 3-kinase vps34-like 0.0045 0.0435 0.0431
Brugia malayi Nuclear hormone receptor family member nhr-14 0.0017 0.0043 0.0044
Entamoeba histolytica FKBP-rapamycin associated protein (FRAP), putative 0.07 0.9687 1
Echinococcus granulosus phosphatidylinositol 4 phosphate 3 kinase C2 0.0045 0.0435 0.0431
Echinococcus granulosus ecdysone induced protein 78C 0.0017 0.0043 0.0026
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0041 0.0372 0.0355
Trichomonas vaginalis PIKK family atypical protein kinase 0.0521 0.7152 0.7379
Schistosoma mansoni fkbp-rapamycin associated protein 0.0132 0.1667 0.1706
Trichomonas vaginalis PIKK family atypical protein kinase 0.0378 0.5137 0.5295
Brugia malayi Niemann-Pick C1 protein precursor 0.0088 0.1036 0.1069
Leishmania major hypothetical protein, unknown function 0.0045 0.0435 0.0431
Trichomonas vaginalis PIKK family atypical protein kinase 0.0378 0.5137 0.5295
Leishmania major 4-coumarate:coa ligase-like protein 0.0041 0.0374 0.0368
Echinococcus granulosus phosphatidylinositol 45 bisphosphate 3 kinase 0.0045 0.0435 0.0431
Echinococcus multilocularis Niemann Pick C1 protein 0.0088 0.1036 0.102
Entamoeba histolytica phosphatidylinositol 3-kinase, putative 0.0045 0.0435 0.0431
Trypanosoma cruzi phosphatidylinositol 3-kinase, putative 0.0045 0.0435 0.0431
Mycobacterium tuberculosis Probable chain -fatty-acid-CoA ligase FadD13 (fatty-acyl-CoA synthetase) 0.0041 0.0374 0.2094
Trichomonas vaginalis PIKK family atypical protein kinase 0.0414 0.5648 0.5823
Schistosoma mansoni thyroid hormone receptor 0.0017 0.0043 0.0026
Brugia malayi Nuclear hormone receptor family member nhr-41 0.0017 0.0043 0.0044
Trichomonas vaginalis conserved hypothetical protein 0.0087 0.1029 0.1046
Trichomonas vaginalis PIKK family atypical protein kinase 0.0418 0.5706 0.5883
Echinococcus multilocularis Niemann Pick C1 protein 0.0125 0.1567 0.1552
Loa Loa (eye worm) hypothetical protein 0.0102 0.1243 0.1283
Echinococcus multilocularis phosphatidylinositol 4 kinase alpha 0.0045 0.0435 0.0418
Echinococcus granulosus FKBP12 rapamycin complex associated protein 0.07 0.9687 1
Echinococcus multilocularis Phosphatidylinositol 4 kinase type 2 beta 0.0045 0.0435 0.0418
Loa Loa (eye worm) hypothetical protein 0.0045 0.0435 0.0449
Loa Loa (eye worm) nuclear hormone receptor family member nhr-14 0.0017 0.0043 0.0044
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.0045 0.0435 0.0449
Onchocerca volvulus 0.0041 0.0374 0.8439
Loa Loa (eye worm) phosphatidylinositol 3 0.0045 0.0435 0.0449
Trypanosoma cruzi Phosphatidylinositol 3-kinase tor2 0.07 0.9687 1
Trichomonas vaginalis phopsphatidylinositol 3-kinase, drosophila, putative 0.0045 0.0435 0.0431
Trypanosoma cruzi phosphatidylinositol 3-related kinase, putative 0.0235 0.3113 0.3202
Echinococcus multilocularis expressed conserved protein 0.0082 0.096 0.0944
Brugia malayi photoreceptor-specific nuclear receptor 0.0017 0.0043 0.0044
Loa Loa (eye worm) phosphatidylinositol 4-kinase type 3 alpha isoform 1 0.0045 0.0435 0.0449
Trichomonas vaginalis phosphatidylinositol kinase, putative 0.0045 0.0435 0.0431
Trichomonas vaginalis PIKK family atypical protein kinase 0.0414 0.5648 0.5823
Schistosoma mansoni niemann-pick C1 (NPC1) 0.0089 0.1055 0.1073
Toxoplasma gondii target of rapamycin (TOR), putative 0.0521 0.7152 1
Echinococcus multilocularis ecdysone induced protein 78C 0.0017 0.0043 0.0025
Mycobacterium ulcerans epoxide hydrolase EphA 0.0136 0.1717 1
Schistosoma mansoni nuclear hormone receptor nor-1/nor-2 0.0017 0.0043 0.0026
Echinococcus granulosus Phosphatidylinositol 4 kinase type 2 beta 0.0045 0.0435 0.0431
Entamoeba histolytica protein kinase rad3, putative 0.0132 0.1667 0.1706
Onchocerca volvulus 0.0045 0.0435 1
Trichomonas vaginalis PIKK family atypical protein kinase 0.0557 0.7663 0.7907
Loa Loa (eye worm) hypothetical protein 0.0017 0.0043 0.0044
Brugia malayi nuclear receptor NHR-88 0.0017 0.0043 0.0044
Schistosoma mansoni phosphatidylinositol-45-bisphosphate 3-kinase catalytic subunit alpha PI3K 0.0045 0.0435 0.0431
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0032 0.0249 0.0232
Trypanosoma cruzi phosphatidylinositol 3-related kinase, putative 0.0235 0.3113 0.3202
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD7 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0029 0.0204 0.1098
Trichomonas vaginalis PIKK family atypical protein kinase 0.0418 0.5706 0.5883
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD35 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0029 0.0204 0.1098
Trypanosoma brucei phosphatidylinositol 3-kinase, putative 0.0045 0.0435 0.0431
Entamoeba histolytica hypothetical protein 0.0045 0.0435 0.0431
Entamoeba histolytica Niemann-Pick C1 protein, putative 0.0088 0.1036 0.1053
Toxoplasma gondii non-specific serine/threonine protein kinase 0.0148 0.1881 0.2612
Entamoeba histolytica acyl-CoA synthetase, putative 0.0041 0.0374 0.0368
Trichomonas vaginalis conserved hypothetical protein 0.0102 0.1243 0.1267
Toxoplasma gondii FATC domain-containing protein 0.0132 0.1667 0.2312
Chlamydia trachomatis acylglycerophosphoethanolamine acyltransferase 0.0031 0.0228 0.5
Loa Loa (eye worm) hypothetical protein 0.0031 0.0228 0.0235
Loa Loa (eye worm) hypothetical protein 0.0017 0.0043 0.0044
Loa Loa (eye worm) nuclear hormone receptor family member nhr-31 0.0017 0.0043 0.0044
Mycobacterium tuberculosis Conserved hypothetical protein 0.0045 0.0435 0.2455
Loa Loa (eye worm) hypothetical protein 0.0017 0.0043 0.0044
Echinococcus granulosus Niemann Pick C1 protein 0.0125 0.1567 0.1603
Loa Loa (eye worm) hypothetical protein 0.0143 0.1812 0.1871
Brugia malayi Nuclear hormone receptor-like 1 0.0017 0.0043 0.0044
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD2 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0041 0.0374 0.2094
Echinococcus granulosus DNA dependent protein kinase catalytic subunit 0.0045 0.0435 0.0431
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0041 0.0372 0.0367
Echinococcus multilocularis DNA dependent protein kinase catalytic subunit 0.0045 0.0435 0.0418
Schistosoma mansoni photoreceptor-specific nuclear receptor related 0.0017 0.0043 0.0026
Entamoeba histolytica acyl-CoA synthetase, putative 0.0041 0.0374 0.0368
Echinococcus multilocularis phosphatidylinositol 4,5 bisphosphate 3 kinase 0.0045 0.0435 0.0418
Brugia malayi Nuclear hormone receptor family member nhr-49 0.0017 0.0043 0.0044
Brugia malayi hypothetical protein 0.0032 0.0249 0.0258
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0041 0.0372 0.0367
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD3 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0029 0.0204 0.1098
Plasmodium falciparum phosphatidylinositol 4-kinase 0.0045 0.0435 1
Giardia lamblia Phosphoinositide-3-kinase, class 3 0.0045 0.0435 0.0431
Leishmania major 4-coumarate:coa ligase-like protein 0.0041 0.0374 0.0368
Entamoeba histolytica hypothetical protein 0.0045 0.0435 0.0431
Loa Loa (eye worm) hypothetical protein 0.0132 0.1667 0.1721
Echinococcus granulosus Niemann Pick C1 protein 0.0088 0.1036 0.1053
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0017 0.0043 0.0044
Loa Loa (eye worm) nuclear hormone receptor family member nhr-41 0.0017 0.0043 0.0044
Onchocerca volvulus 0.0045 0.0435 1
Echinococcus multilocularis serine:threonine protein kinase SMG1 0.0132 0.1667 0.1652
Trichomonas vaginalis PIKK family atypical protein kinase 0.0521 0.7152 0.7379
Trichomonas vaginalis PIKK family atypical protein kinase 0.0235 0.3113 0.3202
Echinococcus multilocularis Nuclear hormone receptor family member nhr 41 0.0017 0.0043 0.0025
Schistosoma mansoni ataxia telangiectasia mutated (atm) 0.0132 0.1667 0.1706
Brugia malayi nuclear hormone receptor 0.0017 0.0043 0.0044
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.0045 0.0435 0.0449
Schistosoma mansoni phosphatidylinositol 4-kinase type-II 0.0045 0.0435 0.0431
Trypanosoma cruzi target of rapamycin kinase 3 0.0557 0.7671 0.7916
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0017 0.0043 0.0026
Trichomonas vaginalis PIKK family atypical protein kinase 0.0378 0.5137 0.5295
Plasmodium falciparum phosphatidylinositol 3-kinase 0.0045 0.0435 1
Trichomonas vaginalis PIKK family atypical protein kinase 0.0377 0.5129 0.5286
Trypanosoma cruzi phosphatidylinositol 3-kinase 2, putative 0.0045 0.0435 0.0431
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0017 0.0043 0.0026
Schistosoma mansoni phosphatidylinositol 3-kinase class 0.0045 0.0435 0.0431
Trichomonas vaginalis PIKK family atypical protein kinase 0.0087 0.1029 0.1046
Schistosoma mansoni phosphatidylinositol-45-bisphosphate 3-kinase catalytic subunit alpha PI3K 0.0045 0.0435 0.0431
Mycobacterium tuberculosis Probable epoxide hydrolase EphA (epoxide hydratase) (arene-oxide hydratase) 0.0136 0.1717 1
Mycobacterium ulcerans fatty-acid-CoA ligase 0.0031 0.0228 0.1236
Loa Loa (eye worm) hypothetical protein 0.0148 0.1881 0.1942
Echinococcus granulosus hepatocyte nuclear factor 4 alpha 0.0017 0.0043 0.0026
Trypanosoma cruzi phosphatidylinositol kinase related protein, putative 0.0132 0.1667 0.1706
Brugia malayi phosphatidylinositol 4-kinase, catalytic, alpha polypeptide 0.0045 0.0435 0.0449
Trypanosoma brucei phosphatidylinositol 4-kinase, putative 0.07 0.9687 1
Wolbachia endosymbiont of Brugia malayi exonuclease III 0.0016 0.0018 0.5
Schistosoma mansoni steroid hormone receptor ad4bp 0.0017 0.0043 0.0026
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0041 0.0372 0.0355
Loa Loa (eye worm) nuclear hormone receptor family member nhr-49 0.0017 0.0043 0.0044
Plasmodium vivax phosphatidylinositol 3-kinase, putative 0.0045 0.0435 1
Trichomonas vaginalis PIKK family atypical protein kinase 0.0521 0.7152 0.7379
Trichomonas vaginalis PIKK family atypical protein kinase 0.0521 0.7152 0.7379
Schistosoma mansoni phosphatidylinositol-45-bisphosphate 3-kinase catalytic subunit alpha PI3K 0.0045 0.0435 0.0431
Loa Loa (eye worm) steroid hormone receptor 0.0017 0.0043 0.0044
Leishmania major phosphatidylinositol 3-kinase, putative 0.0045 0.0435 0.0431
Echinococcus granulosus serine protein kinase ATM 0.0132 0.1667 0.1706
Schistosoma mansoni phosphatidylinositol 4-kinase 0.0045 0.0435 0.0431
Trichomonas vaginalis PIKK family atypical protein kinase 0.0521 0.7152 0.7379
Trichomonas vaginalis PIKK family atypical protein kinase 0.0521 0.7152 0.7379
Echinococcus granulosus sterol regulatory element binding protein 0.0038 0.0328 0.0321
Plasmodium vivax phosphatidylinositol 3- and 4-kinase, putative 0.0045 0.0435 1
Trichomonas vaginalis phosphatidylinositol 3-kinase class, putative 0.0045 0.0435 0.0431
Trypanosoma brucei target of rapamycin kinase 3, putative 0.0557 0.7671 0.7916
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.0045 0.0435 0.0449
Echinococcus granulosus COUP TF:Svp nuclear hormone receptor 0.0017 0.0043 0.0026
Trichomonas vaginalis PIKK family atypical protein kinase 0.0045 0.0435 0.0431
Loa Loa (eye worm) hypothetical protein 0.0017 0.0043 0.0044
Loa Loa (eye worm) phosphatidylinositol kinase 0.0045 0.0435 0.0449
Echinococcus granulosus expressed conserved protein 0.0082 0.096 0.0975
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0041 0.0372 0.0384
Trypanosoma brucei phosphatidylinositol 4-kinase alpha, putative 0.0045 0.0435 0.0431
Plasmodium vivax phosphatidylinositol 4-kinase, putative 0.0045 0.0435 1
Echinococcus multilocularis sterol regulatory element binding protein 0.0038 0.0328 0.0311
Loa Loa (eye worm) hypothetical protein 0.0087 0.1029 0.1062
Echinococcus multilocularis COUP TF:Svp nuclear hormone receptor 0.0017 0.0043 0.0025
Entamoeba histolytica acyl-coA synthetase, putative 0.0041 0.0374 0.0368
Trichomonas vaginalis PIKK family atypical protein kinase 0.07 0.9687 1
Trichomonas vaginalis PIKK family atypical protein kinase 0.0188 0.245 0.2516
Mycobacterium ulcerans acyl-CoA synthetase 0.0041 0.0374 0.2094
Schistosoma mansoni hypothetical protein 0.0036 0.0309 0.0301
Leishmania major target of rapamycin (TOR) kinase 2, putative 0.07 0.9687 1
Trypanosoma brucei phosphatidylinositol 4-kinase, putative 0.0045 0.0435 0.0431
Echinococcus multilocularis FTZ F1 nuclear receptor protein 0.0017 0.0043 0.0025
Mycobacterium ulcerans fatty-acid-CoA ligase 0.0041 0.0374 0.2094
Echinococcus granulosus Phosphatidylinositol 4 kinase type 2 beta 0.0045 0.0435 0.0431
Loa Loa (eye worm) hypothetical protein 0.0017 0.0043 0.0044
Entamoeba histolytica phosphatidylinositol 3-kinase, putative 0.0045 0.0435 0.0431
Loa Loa (eye worm) phosphatidylinositol 3 0.07 0.9687 1
Mycobacterium leprae conserved hypothetical protein 0.0045 0.0435 1
Loa Loa (eye worm) nuclear hormone receptor family member nhr-1 0.0017 0.0043 0.0044
Trypanosoma brucei phosphatidylinositol 3-kinase catalytic subunit, putative 0.0045 0.0435 0.0431
Trichomonas vaginalis PIKK family atypical protein kinase 0.0235 0.3113 0.3202
Loa Loa (eye worm) hypothetical protein 0.0017 0.0043 0.0044
Trichomonas vaginalis PIKK family atypical protein kinase 0.0418 0.5706 0.5883
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.0235 0.3113 0.3214
Trichomonas vaginalis PIKK family atypical protein kinase 0.0557 0.7663 0.7907
Echinococcus multilocularis Zinc finger, PHD finger 0.0045 0.0435 0.0418
Schistosoma mansoni phosphatidylinositol 3-and 4-kinase 0.0235 0.3113 0.3202
Schistosoma mansoni transcription factor LCR-F1 0.0032 0.0249 0.024
Trichomonas vaginalis PIKK family atypical protein kinase 0.0235 0.3113 0.3202
Mycobacterium ulcerans long-chain-fatty-acid-CoA ligase 0.0041 0.0374 0.2094
Entamoeba histolytica hypothetical protein 0.0045 0.0435 0.0431
Trichomonas vaginalis phosphatidylinositol kinase, putative 0.0045 0.0435 0.0431
Schistosoma mansoni patched 1 0.0038 0.0328 0.0321
Trypanosoma brucei phosphatidylinositol kinase related protein, putative 0.0132 0.1667 0.1706
Leishmania major phosphatidylinositol kinase related protein, putative 0.0045 0.0435 0.0431
Trichomonas vaginalis PIKK family atypical protein kinase 0.0557 0.7663 0.7907
Trypanosoma cruzi phosphatidylinositol 3-kinase, putative 0.0132 0.1667 0.1706
Trypanosoma cruzi phosphatidylinositol kinase related protein, putative 0.0045 0.0435 0.0431
Loa Loa (eye worm) phosphatidylinositol 3 0.0045 0.0435 0.0449
Brugia malayi AMP-binding enzyme family protein 0.0041 0.0374 0.0386
Loa Loa (eye worm) hypothetical protein 0.0046 0.0448 0.0462
Schistosoma mansoni hypothetical protein 0.0036 0.0309 0.0301
Plasmodium vivax phosphatidylinositol 4-kinase, putative 0.0045 0.0435 1
Echinococcus granulosus retinoic acid receptor rxr beta a 0.0017 0.0043 0.0026
Schistosoma mansoni hypothetical protein 0.0032 0.0249 0.024
Toxoplasma gondii phosphatidylinositol 3- and 4-kinase 0.0045 0.0435 0.0585
Leishmania major phosphatidylinositol 4-kinase, putative 0.0045 0.0435 0.0431
Schistosoma mansoni nuclear hormone receptor 0.0017 0.0043 0.0026
Trichomonas vaginalis PIKK family atypical protein kinase 0.0557 0.7663 0.7907
Brugia malayi Nuclear hormone receptor family member nhr-1 0.0017 0.0043 0.0044
Trichomonas vaginalis phopsphatidylinositol 3-kinase, drosophila, putative 0.0045 0.0435 0.0431
Loa Loa (eye worm) abnormal chemotaxis protein 14 0.0038 0.0328 0.0339
Entamoeba histolytica hypothetical protein 0.0032 0.0249 0.024
Brugia malayi exodeoxyribonuclease III family protein 0.0016 0.0018 0.0018
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0041 0.0372 0.0367
Giardia lamblia Phosphoinositide-3-kinase, catalytic, alpha polypeptide 0.0045 0.0435 0.0431
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0041 0.0372 0.0384
Trichomonas vaginalis PIKK family atypical protein kinase 0.0377 0.5129 0.5286
Loa Loa (eye worm) phosphatidylinositol 3 0.0045 0.0435 0.0449
Trichomonas vaginalis PIKK family atypical protein kinase 0.0557 0.7663 0.7907
Loa Loa (eye worm) nuclear hormone receptor family member nhr-40 0.0017 0.0043 0.0044
Echinococcus multilocularis FKBP12 rapamycin complex associated protein 0.07 0.9687 0.9686
Entamoeba histolytica phosphatidylinositol-4,5-bisphosphate 3-kinase, putative 0.0045 0.0435 0.0431
Echinococcus multilocularis Phosphatidylinositol 4 kinase type 2 beta 0.0045 0.0435 0.0418
Trichomonas vaginalis phosphatidylinositol 3-kinase catalytic subunit gamma, putative 0.0045 0.0435 0.0431
Trypanosoma cruzi phosphatidylinositol 4-kinase, putative 0.0045 0.0435 0.0431
Trichomonas vaginalis PIKK family atypical protein kinase 0.0132 0.1667 0.1706
Trichomonas vaginalis phosphatidylinositol 3-kinase catalytic subunit alpha, beta, delta, putative 0.0045 0.0435 0.0431
Trichomonas vaginalis PIKK family atypical protein kinase 0.0378 0.5137 0.5295
Entamoeba histolytica phosphatidylinositol 4-kinase, putative 0.0045 0.0435 0.0431
Schistosoma mansoni hypothetical protein 0.0036 0.0309 0.0301
Loa Loa (eye worm) phosphatidylinositol 3 0.0235 0.3113 0.3214
Loa Loa (eye worm) hypothetical protein 0.0031 0.0228 0.0235
Toxoplasma gondii phosphatidylinositol 3- and 4-kinase 0.0045 0.0435 0.0585
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.0132 0.1667 0.1721
Trichomonas vaginalis phosphatidylinositol 4-kinase, putative 0.0045 0.0435 0.0431
Plasmodium vivax hypothetical protein 0.0045 0.0435 1
Leishmania major phosphatidylinositol 3-kinase, putative 0.0235 0.3113 0.3202
Brugia malayi Nuclear hormone receptor family member nhr-31 0.0017 0.0043 0.0044
Entamoeba histolytica hypothetical protein 0.0032 0.0249 0.024
Trichomonas vaginalis PIKK family atypical protein kinase 0.047 0.6431 0.6633
Echinococcus granulosus FTZ F1 nuclear receptor protein 0.0017 0.0043 0.0026
Loa Loa (eye worm) hypothetical protein 0.0041 0.0374 0.0386
Trichomonas vaginalis phosphatidylinositol 3-kinase class, putative 0.0045 0.0435 0.0431
Trichomonas vaginalis phosphatidylinositol 3-kinase class, putative 0.0045 0.0435 0.0431
Leishmania major phosphatidylinositol 4-kinase alpha, putative 0.0045 0.0435 0.0431
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0032 0.0249 0.024
Leishmania major target of rapamycin (TOR) kinase 1, putative 0.07 0.9687 1
Entamoeba histolytica phosphatidylinositol 3-kinase, putative 0.0045 0.0435 0.0431
Trichomonas vaginalis PIKK family atypical protein kinase 0.0235 0.3113 0.3202
Mycobacterium ulcerans long-chain-fatty-acid--CoA ligase 0.0041 0.0374 0.2094
Schistosoma mansoni thyroid hormone receptor 0.0017 0.0043 0.0026
Trypanosoma brucei Phosphatidylinositol 3-kinase tor1 0.07 0.9687 1
Brugia malayi AMP-binding enzyme family protein 0.0041 0.0374 0.0386

Activities

Activity type Activity value Assay description Source Reference
CC50 (ADMET) = 55.4 uM Cytotoxicity against human MT4 cells after 5 days by MTT assay ChEMBL. 22405288

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.