Detailed information for compound 1993177

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 315.393 | Formula: C15H17N5OS
  • H donors: 4 H acceptors: 3 LogP: 2.6 Rotable bonds: 3
    Rule of 5 violations (Lipinski): 1
  • SMILES: OC1CCCC1Nc1[nH]nc(c1c1nc2c(s1)cccc2)N
  • InChi: 1S/C15H17N5OS/c16-13-12(15-18-9-4-1-2-7-11(9)22-15)14(20-19-13)17-8-5-3-6-10(8)21/h1-2,4,7-8,10,21H,3,5-6H2,(H4,16,17,19,20)
  • InChiKey: DJDXSJPMGTWXON-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

No synonyms found for this compound

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens integrin-linked kinase Starlite/ChEMBL No references

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Brugia malayi integrin-linked kinase Get druggable targets OG5_132787 All targets in OG5_132787
Schistosoma mansoni protein kinase Get druggable targets OG5_132787 All targets in OG5_132787
Schistosoma mansoni protein kinase Get druggable targets OG5_132787 All targets in OG5_132787
Schistosoma japonicum ko:K06272 integrin-linked kinase, putative Get druggable targets OG5_132787 All targets in OG5_132787
Echinococcus granulosus integrin linked protein kinase Get druggable targets OG5_132787 All targets in OG5_132787
Echinococcus multilocularis integrin linked protein kinase Get druggable targets OG5_132787 All targets in OG5_132787
Schistosoma japonicum Integrin-linked protein kinase, putative Get druggable targets OG5_132787 All targets in OG5_132787
Loa Loa (eye worm) TKL/MLK/ILK protein kinase Get druggable targets OG5_132787 All targets in OG5_132787
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 NADPH--cytochrome P450 reductase, putative 0.0015 0.0044 0.0064
Echinococcus granulosus aldo keto reductase family 1 member B4 0.0028 0.0163 0.0163
Echinococcus granulosus hypothetical protein 0.0028 0.0163 0.0163
Toxoplasma gondii histone lysine methyltransferase SET1 0.0066 0.0515 0.2455
Trichomonas vaginalis esterase, putative 0.0042 0.0289 0.0956
Mycobacterium tuberculosis Probable hydrolase 0.0042 0.0289 0.1225
Echinococcus multilocularis FKBP12 rapamycin complex associated protein 0.0022 0.0108 0.0108
Entamoeba histolytica fructose-1,6-bisphosphate aldolase, putative 0.0338 0.3021 1
Schistosoma mansoni ataxia telangiectasia mutated (atm) 0.003 0.0184 0.0643
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0338 0.3021 1
Trypanosoma brucei target of rapamycin kinase 3, putative 0.0022 0.0108 0.0403
Giardia lamblia Endonuclease/Exonuclease/phosphatase 0.0023 0.0116 0.0292
Echinococcus multilocularis NADPH cytochrome P450 reductase 0.0015 0.0044 0.0044
Loa Loa (eye worm) matrix metalloproteinase 0.0139 0.1192 0.3817
Loa Loa (eye worm) CXXC zinc finger family protein 0.0035 0.0227 0.0716
Plasmodium vivax NADPH-cytochrome p450 reductase, putative 0.0015 0.0044 0.0056
Brugia malayi hydrolase, alpha/beta fold family protein 0.0176 0.1527 0.5057
Mycobacterium leprae Probable lipase LipE 0.0042 0.0289 0.1962
Echinococcus granulosus NADPH dependent diflavin oxidoreductase 1 0.0015 0.0044 0.0044
Trypanosoma cruzi hypothetical protein, conserved 0.0042 0.0289 0.1428
Trypanosoma cruzi phosphatidylinositol 3-related kinase, putative 0.0022 0.0108 0.0469
Brugia malayi Prenyltransferase and squalene oxidase repeat family protein 0.0217 0.1906 0.6315
Wolbachia endosymbiont of Brugia malayi extracellular metallopeptidase 0.0963 0.8793 1
Echinococcus multilocularis aldo keto reductase family 1, member B4 0.0028 0.0163 0.0163
Giardia lamblia Aldose reductase 0.0028 0.0163 0.0451
Schistosoma mansoni hypothetical protein 0.0198 0.1729 0.6056
Leishmania major aldehyde reductase, putative,oxidoreductase, putative 0.0028 0.0163 0.0719
Trypanosoma cruzi apurinic/apyrimidinic endonuclease 0.0023 0.0116 0.0512
Trypanosoma cruzi hypothetical protein, conserved 0.0087 0.0708 0.3649
Trichomonas vaginalis aldo-keto reductase, putative 0.0028 0.0163 0.0541
Loa Loa (eye worm) prenyltransferase and squalene oxidase repeat family protein 0.0217 0.1906 0.6113
Schistosoma mansoni phosphatidylinositol 3-and 4-kinase 0.0022 0.0108 0.0378
Trichomonas vaginalis PIKK family atypical protein kinase 0.0022 0.0108 0.0357
Trypanosoma cruzi protein farnesyltransferase alpha subunit, putative 0.0093 0.076 0.3928
Echinococcus multilocularis serotonin receptor 0.0095 0.0783 0.0783
Trichomonas vaginalis PIKK family atypical protein kinase 0.0012 0.0019 0.0064
Mycobacterium tuberculosis Probable epoxide hydrolase EphA (epoxide hydratase) (arene-oxide hydratase) 0.0113 0.0946 0.4011
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0338 0.3021 1
Giardia lamblia Aldose reductase 0.0028 0.0163 0.0451
Echinococcus multilocularis protein prenyltransferase alpha subunit 0.0093 0.076 0.076
Mycobacterium tuberculosis Halimadienyl diphosphate synthase 0.0116 0.0979 0.4154
Echinococcus multilocularis aldo keto reductase 0.0028 0.0163 0.0163
Trichomonas vaginalis protein farnesyltransferase alpha subunit/RAB geranylgeranyl transferase alpha subunit, putative 0.0227 0.2 0.6619
Schistosoma mansoni protein kinase 0.01 0.0831 0.2911
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0108 0.0906 0.3173
Treponema pallidum fructose-bisphosphate aldolase 0.0338 0.3021 1
Echinococcus multilocularis aldo keto reductase family 1, member B4 0.0028 0.0163 0.0163
Trichomonas vaginalis PIKK family atypical protein kinase 0.0022 0.0108 0.0357
Trichomonas vaginalis D-aminoacylase, putative 0.0042 0.0289 0.0956
Toxoplasma gondii prenyltransferase and squalene oxidase repeat-containing protein 0.0217 0.1906 0.9522
Plasmodium vivax farnesyltransferase beta subunit, putative 0.0217 0.1906 0.6641
Echinococcus granulosus phosphatidylinositol 3 and 4 kinase 0.0022 0.0108 0.0108
Echinococcus multilocularis aldo keto reductase family 1, member B4 0.0028 0.0163 0.0163
Schistosoma mansoni protein farnesyltransferase alpha subunit 0.032 0.2855 1
Plasmodium falciparum AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.0023 0.0116 0.0255
Echinococcus granulosus matrix metallopeptidase 7 M10 family 0.0507 0.4583 0.4583
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0042 0.0289 0.1011
Echinococcus multilocularis aldo keto reductase family 1, member B4 0.0028 0.0163 0.0163
Echinococcus multilocularis aldo keto reductase family 1, member B4 0.0028 0.0163 0.0163
Trichomonas vaginalis geranylgeranyl transferase type II beta subunit, putative 0.0217 0.1906 0.6308
Trichomonas vaginalis PIKK family atypical protein kinase 0.0022 0.0108 0.0357
Loa Loa (eye worm) oxidoreductase 0.0028 0.0163 0.0511
Echinococcus granulosus protein farnesyltransferase subunit beta 0.0217 0.1906 0.1906
Trichomonas vaginalis PIKK family atypical protein kinase 0.0022 0.0108 0.0357
Loa Loa (eye worm) oxidoreductase 0.0028 0.0163 0.0511
Loa Loa (eye worm) matrixin family protein 0.0309 0.2759 0.8855
Onchocerca volvulus 0.0035 0.0227 0.0214
Trichomonas vaginalis PIKK family atypical protein kinase 0.0022 0.0108 0.0357
Schistosoma mansoni aldo-keto reductase 0.0028 0.0163 0.0572
Trypanosoma brucei phosphatidylinositol 3-kinase, putative 0.0022 0.0108 0.0403
Mycobacterium tuberculosis Conserved protein 0.0042 0.0289 0.1225
Onchocerca volvulus 0.0042 0.0289 0.0421
Loa Loa (eye worm) hypothetical protein 0.0026 0.0145 0.045
Brugia malayi flavodoxin family protein 0.0015 0.0044 0.0136
Schistosoma mansoni cpg binding protein 0.0037 0.0246 0.086
Brugia malayi Matrixin family protein 0.0139 0.1192 0.3944
Trichomonas vaginalis aldo-keto reductase, putative 0.0028 0.0163 0.0541
Loa Loa (eye worm) hypothetical protein 0.0139 0.1192 0.3817
Trichomonas vaginalis conserved hypothetical protein 0.0014 0.0032 0.0107
Leishmania major farnesyltransferase beta subunit 0.0217 0.1906 1
Echinococcus granulosus DNA apurinic or apyrimidinic site lyase 0.0023 0.0116 0.0116
Leishmania major phosphatidylinositol 3-kinase, putative 0.0022 0.0108 0.0423
Leishmania major NADPH-cytochrome p450 reductase-like protein 0.0015 0.0044 0.0084
Trichomonas vaginalis PIKK family atypical protein kinase 0.0022 0.0108 0.0357
Trichomonas vaginalis PIKK family atypical protein kinase 0.0022 0.0108 0.0357
Echinococcus multilocularis beta LACTamase domain containing family member 0.0042 0.0289 0.0289
Brugia malayi Matrixin family protein 0.0139 0.1192 0.3944
Trichomonas vaginalis PIKK family atypical protein kinase 0.0022 0.0108 0.0357
Mycobacterium tuberculosis Probable esterase LipL 0.0042 0.0289 0.1225
Plasmodium falciparum protein farnesyltransferase subunit beta 0.0217 0.1906 0.6622
Plasmodium falciparum protein farnesyltransferase subunit alpha 0.032 0.2855 1
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0338 0.3021 1
Trichomonas vaginalis sulfite reductase, putative 0.0015 0.0044 0.0147
Trypanosoma cruzi apurinic/apyrimidinic endonuclease, putative 0.0023 0.0116 0.0512
Schistosoma mansoni ap endonuclease 0.0023 0.0116 0.0406
Loa Loa (eye worm) FAD binding domain-containing protein 0.0015 0.0044 0.0128
Schistosoma mansoni geranylgeranyl transferase type I beta subunit 0.0303 0.27 0.9455
Schistosoma mansoni matrix metallopeptidase-7 (M10 family) 0.0139 0.1192 0.4173
Plasmodium falciparum geranylgeranyl transferase type-2 subunit alpha, putative 0.0093 0.076 0.2547
Onchocerca volvulus Matrilysin homolog 0.0139 0.1192 0.345
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0108 0.0906 0.0906
Echinococcus multilocularis serotonin receptor 0.0095 0.0783 0.0783
Mycobacterium tuberculosis Probable lipase LipD 0.0042 0.0289 0.1225
Entamoeba histolytica aldose reductase, putative 0.0028 0.0163 0.048
Toxoplasma gondii FATC domain-containing protein 0.003 0.0184 0.0769
Trichomonas vaginalis PIKK family atypical protein kinase 0.0022 0.0108 0.0357
Trichomonas vaginalis protein farnesyltransferase alpha subunit, putative 0.0093 0.076 0.2517
Trichomonas vaginalis PIKK family atypical protein kinase 0.0022 0.0108 0.0357
Trypanosoma cruzi hypothetical protein, conserved 0.0093 0.076 0.3928
Schistosoma mansoni cpg binding protein 0.0035 0.0227 0.0796
Trichomonas vaginalis aldo-keto reductase, putative 0.0028 0.0163 0.0541
Mycobacterium ulcerans epoxide hydrolase EphA 0.0113 0.0946 0.5331
Trichomonas vaginalis protein farnesyltransferase alpha subunit, putative 0.032 0.2855 0.9451
Echinococcus multilocularis aldo keto reductase 0.0028 0.0163 0.0163
Schistosoma mansoni rab geranylgeranyl transferase alpha subunit 0.0093 0.076 0.2663
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0108 0.0906 0.0906
Loa Loa (eye worm) hypothetical protein 0.0028 0.0163 0.0511
Trichomonas vaginalis aldo-keto reductase, putative 0.0028 0.0163 0.0541
Brugia malayi beta-lactamase family protein 0.0042 0.0289 0.0948
Toxoplasma gondii hypothetical protein 0.0227 0.2 1
Trichomonas vaginalis PIKK family atypical protein kinase 0.0022 0.0108 0.0357
Echinococcus multilocularis aldehyde reductase 0.002 0.0089 0.0089
Mycobacterium ulcerans hydrolase 0.017 0.1472 0.8299
Trichomonas vaginalis PIKK family atypical protein kinase 0.0022 0.0108 0.0357
Loa Loa (eye worm) hypothetical protein 0.0042 0.0289 0.0914
Loa Loa (eye worm) hypothetical protein 0.0095 0.0783 0.2502
Loa Loa (eye worm) hypothetical protein 0.0042 0.0289 0.0914
Trypanosoma cruzi p450 reductase, putative 0.0015 0.0044 0.0132
Trypanosoma brucei protein farnesyltransferase alpha subunit, putative 0.0093 0.076 0.3886
Schistosoma mansoni protein farnesyltransferase subunit beta 0.0217 0.1906 0.6675
Giardia lamblia GTOR 0.0022 0.0108 0.0265
Toxoplasma gondii Rab geranylgeranyl transferase type II beta subunit, putative 0.0087 0.0708 0.3432
Onchocerca volvulus 0.0042 0.0289 0.0421
Echinococcus multilocularis tm gpcr rhodopsin gpcr rhodopsin superfamily 0.1093 1 1
Echinococcus granulosus protein farnesyltransferase alpha subunit 0.032 0.2855 0.2855
Trypanosoma cruzi Protein prenyltransferase alpha subunit repeat, putative 0.0093 0.076 0.3928
Echinococcus granulosus aldo keto reductase 0.0028 0.0163 0.0163
Mycobacterium leprae PROBABLE OXIDOREDUCTASE 0.0028 0.0163 0.111
Echinococcus multilocularis aldo keto reductase family 1, member B4 0.0028 0.0163 0.0163
Echinococcus multilocularis aldo keto reductase family 1, member B4 0.0028 0.0163 0.0163
Loa Loa (eye worm) prenyltransferase and squalene oxidase repeat family protein 0.0303 0.27 0.8666
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0338 0.3021 1
Onchocerca volvulus 0.0042 0.0289 0.0421
Trichomonas vaginalis ap endonuclease, putative 0.0023 0.0116 0.0384
Brugia malayi Matrixin family protein 0.0139 0.1192 0.3944
Leishmania major hypothetical protein, conserved 0.0042 0.0289 0.1386
Echinococcus granulosus aldo keto reductase family 1 member B4 0.0028 0.0163 0.0163
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0108 0.0906 0.2898
Echinococcus multilocularis aldo keto reductase family 1, member B4 0.0028 0.0163 0.0163
Trichomonas vaginalis D-aminoacylase, putative 0.0042 0.0289 0.0956
Leishmania major lanosterol synthase, putative 0.0029 0.0176 0.0788
Trypanosoma cruzi phosphatidylinositol kinase related protein, putative 0.0026 0.0145 0.0664
Trypanosoma brucei phosphatidylinositol 3-related kinase, putative 0.0022 0.0108 0.0403
Brugia malayi beta-lactamase 0.0042 0.0289 0.0948
Loa Loa (eye worm) prenyltransferase alpha subunit repeat containing protein 0.0093 0.076 0.243
Trypanosoma brucei protein farnesyltransferase beta subunit 0.0217 0.1906 1
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0074 0.0589 0.2061
Loa Loa (eye worm) hypothetical protein 0.032 0.2855 0.9167
Leishmania major target of rapamycin kinase (TOR) kinase 3 0.0022 0.0108 0.0423
Trichomonas vaginalis aldo/keto reductase, putative 0.0028 0.0163 0.0541
Loa Loa (eye worm) hypothetical protein 0.0042 0.0289 0.0914
Echinococcus multilocularis serine:threonine protein kinase SMG1 0.0012 0.0019 0.0019
Brugia malayi beta-lactamase family protein 0.0042 0.0289 0.0948
Mycobacterium tuberculosis Probable esterase/lipase LipP 0.0042 0.0289 0.1225
Trichomonas vaginalis aldo-keto reductase, putative 0.0028 0.0163 0.0541
Echinococcus multilocularis serine protein kinase ATM 0.003 0.0184 0.0184
Echinococcus multilocularis DNA (apurinic or apyrimidinic site) lyase 0.0023 0.0116 0.0116
Loa Loa (eye worm) hypothetical protein 0.0139 0.1192 0.3817
Brugia malayi oxidoreductase, aldo/keto reductase family protein 0.0028 0.0163 0.0532
Loa Loa (eye worm) hypothetical protein 0.0087 0.0708 0.2261
Trypanosoma cruzi aldo/keto reductase, putative 0.0028 0.0163 0.0764
Onchocerca volvulus 0.0198 0.1729 0.5255
Trypanosoma brucei hypothetical protein, conserved 0.0093 0.076 0.3886
Mycobacterium ulcerans short chain dehydrogenase 0.0202 0.1774 1
Echinococcus multilocularis geranylgeranyl transferase type I beta subunit 0.0303 0.27 0.27
Loa Loa (eye worm) hypothetical protein 0.0015 0.0044 0.0128
Echinococcus granulosus serine protein kinase ATM 0.003 0.0184 0.0184
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0108 0.0906 0.0906
Mycobacterium ulcerans lipase LipD 0.0042 0.0289 0.1628
Trichomonas vaginalis PIKK family atypical protein kinase 0.0022 0.0108 0.0357
Trichomonas vaginalis D-aminoacylase, putative 0.0042 0.0289 0.0956
Loa Loa (eye worm) hypothetical protein 0.0087 0.0708 0.2261
Trichomonas vaginalis aldo-keto reductase, putative 0.0028 0.0163 0.0541
Schistosoma mansoni cytochrome P450 reductase 0.0015 0.0044 0.0155
Schistosoma mansoni ap endonuclease 0.0023 0.0116 0.0406
Loa Loa (eye worm) matrixin family protein 0.0337 0.3016 0.9683
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0108 0.0906 0.3173
Echinococcus granulosus geranylgeranyl transferase type I beta subunit 0.0303 0.27 0.27
Echinococcus multilocularis geranylgeranyl transferase type 2 subunit alpha 0.0093 0.076 0.076
Trichomonas vaginalis PIKK family atypical protein kinase 0.0022 0.0108 0.0357
Trichomonas vaginalis PIKK family atypical protein kinase 0.0022 0.0108 0.0357
Trypanosoma cruzi phosphatidylinositol 3-related kinase, putative 0.0022 0.0108 0.0469
Trichomonas vaginalis geranylgeranyl transferase type I beta subunit, putative 0.0303 0.27 0.8936
Echinococcus granulosus aldo keto reductase family 1 member B4 0.0028 0.0163 0.0163
Trypanosoma cruzi phosphatidylinositol kinase related protein, putative 0.003 0.0184 0.0871
Mycobacterium tuberculosis Possible conserved lipoprotein LpqK 0.0042 0.0289 0.1225
Trichomonas vaginalis penicillin-binding protein, putative 0.0042 0.0289 0.0956
Echinococcus granulosus aldo keto reductase family 1 member B4 0.0028 0.0163 0.0163
Leishmania major apurinic/apyrimidinic endonuclease-redox protein 0.0023 0.0116 0.0466
Loa Loa (eye worm) beta-LACTamase domain containing family member 0.0042 0.0289 0.0914
Schistosoma mansoni biogenic amine (5HT) receptor 0.0095 0.0783 0.2741
Loa Loa (eye worm) hypothetical protein 0.0042 0.0289 0.0914
Trichomonas vaginalis PIKK family atypical protein kinase 0.0022 0.0108 0.0357
Plasmodium falciparum geranylgeranyltransferase, putative 0.0087 0.0708 0.236
Trypanosoma cruzi Phosphatidylinositol 3-kinase tor1 0.0022 0.0108 0.0469
Mycobacterium tuberculosis Probable peptidoglycan hydrolase 0.017 0.1472 0.6244
Onchocerca volvulus 0.0139 0.1192 0.345
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0338 0.3021 1
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0338 0.3021 1
Brugia malayi Matrixin family protein 0.0139 0.1192 0.3944
Echinococcus granulosus histone lysine N methyltransferase MLL3 0.0011 0.0005 0.0005
Mycobacterium tuberculosis Probable conserved lipoprotein 0.0042 0.0289 0.1225
Mycobacterium ulcerans fusion of enoyl-CoA hydratase, EchA21 and lipase, LipE 0.0042 0.0289 0.1628
Schistosoma mansoni matrix metallopeptidase-9 (M10 family) 0.0116 0.0973 0.3406
Schistosoma mansoni protein kinase 0.01 0.0831 0.2911
Trypanosoma brucei apurinic/apyrimidinic endonuclease, putative 0.0023 0.0116 0.0446
Trichomonas vaginalis dihydrodiol dehydrogenase, putative 0.0028 0.0163 0.0541
Trichomonas vaginalis aldo-keto reductase, putative 0.0028 0.0163 0.0541
Trichomonas vaginalis geranylgeranyl transferase type I beta subunit, putative 0.0217 0.1906 0.6308
Trichomonas vaginalis aldo-keto reductase, putative 0.0028 0.0163 0.0541
Toxoplasma gondii hypothetical protein 0.0093 0.076 0.37
Loa Loa (eye worm) hypothetical protein 0.014 0.1197 0.3833
Echinococcus granulosus serine:threonine protein kinase SMG1 0.0012 0.0019 0.0019
Mycobacterium ulcerans hypothetical protein 0.0042 0.0289 0.1628
Echinococcus multilocularis neuropeptide FF receptor 2 0.014 0.1197 0.1197
Trypanosoma brucei aldo-keto reductase, putative 0.0028 0.0163 0.0699
Echinococcus granulosus neuropeptide FF receptor 2 0.014 0.1197 0.1197
Schistosoma mansoni geranylgeranyl transferase type I beta subunit 0.0303 0.27 0.9455
Entamoeba histolytica hypothetical protein 0.003 0.0184 0.0547
Echinococcus granulosus aldo keto reductase family 1 member B4 0.0028 0.0163 0.0163
Echinococcus granulosus aldo keto reductase family 1 member B4 0.0028 0.0163 0.0163
Echinococcus granulosus biogenic amine 5HT receptor 0.0095 0.0783 0.0783
Trichomonas vaginalis PIKK family atypical protein kinase 0.0022 0.0108 0.0357
Trichomonas vaginalis penicillin-binding protein, putative 0.0042 0.0289 0.0956
Trichomonas vaginalis PIKK family atypical protein kinase 0.0022 0.0108 0.0357
Loa Loa (eye worm) phosphatidylinositol 3 0.0022 0.0108 0.0332
Wolbachia endosymbiont of Brugia malayi exonuclease III 0.0023 0.0116 0.0132
Entamoeba histolytica geranylgeranyl transferase beta subunit 0.0303 0.27 0.8929
Trypanosoma brucei lanosterol synthase 0.0116 0.0979 0.5054
Brugia malayi Matrix metalloprotease, N-terminal domain containing protein 0.017 0.1472 0.4875
Brugia malayi oxidoreductase, aldo/keto reductase family protein 0.0028 0.0163 0.0532
Echinococcus granulosus integrin linked protein kinase 0.01 0.0831 0.0831
Brugia malayi CXXC zinc finger family protein 0.0035 0.0227 0.0743
Brugia malayi Tachykinin-like peptides receptor 99D 0.014 0.1197 0.3961
Giardia lamblia Rab geranylgeranyltransferase 0.032 0.2855 0.9446
Leishmania major protein farnesyltransferase alpha subunit, putative 0.0093 0.076 0.3898
Loa Loa (eye worm) oxidoreductase 0.0028 0.0163 0.0511
Trypanosoma cruzi protein farnesyltransferase, putative 0.0217 0.1906 1
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0338 0.3021 1
Schistosoma mansoni ataxia telangiectasia mutated (atm)-related 0.0022 0.0108 0.0378
Onchocerca volvulus Matrilysin homolog 0.0309 0.2759 0.8709
Loa Loa (eye worm) oxidoreductase 0.0028 0.0163 0.0511
Leishmania major phosphatidylinositol 3-related kinase, putative 0.0022 0.0108 0.0423
Loa Loa (eye worm) hypothetical protein 0.0095 0.0783 0.2502
Echinococcus granulosus FKBP12 rapamycin complex associated protein 0.0022 0.0108 0.0108
Mycobacterium leprae PROBABLE HYDROLASE 0.017 0.1472 1
Loa Loa (eye worm) hypothetical protein 0.017 0.1472 0.4718
Entamoeba histolytica FKBP-rapamycin associated protein (FRAP), putative 0.0022 0.0108 0.0295
Leishmania major prostaglandin f2-alpha synthase/D-arabinose dehydrogenase 0.0028 0.0163 0.0719
Trichomonas vaginalis PIKK family atypical protein kinase 0.0012 0.0019 0.0064
Schistosoma mansoni polycystin 1-related 0.0085 0.0686 0.2403
Mycobacterium tuberculosis Probable fructose-bisphosphate aldolase Fba 0.0165 0.1427 0.6054
Loa Loa (eye worm) hypothetical protein 0.0014 0.0032 0.0089
Leishmania major target of rapamycin (TOR) kinase 1, putative 0.0022 0.0108 0.0423
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0108 0.0906 0.3173
Trichomonas vaginalis PIKK family atypical protein kinase 0.0014 0.0032 0.0107
Mycobacterium tuberculosis Probable oxidoreductase 0.0028 0.0163 0.0693
Treponema pallidum exodeoxyribonuclease (exoA) 0.0023 0.0116 0.0384
Mycobacterium tuberculosis Conserved protein 0.0042 0.0289 0.1225
Trypanosoma cruzi hypothetical protein, conserved 0.0087 0.0708 0.3649
Echinococcus multilocularis aldo keto reductase 0.0028 0.0163 0.0163
Loa Loa (eye worm) hypothetical protein 0.0042 0.0289 0.0914
Mycobacterium ulcerans exodeoxyribonuclease III protein XthA 0.0023 0.0116 0.0654
Echinococcus multilocularis aldo keto reductase family 1, member B4 0.0028 0.0163 0.0163
Loa Loa (eye worm) TKL/MLK/ILK protein kinase 0.01 0.0831 0.2658
Trypanosoma brucei Protein prenyltransferase alpha subunit repeat, putative 0.0093 0.076 0.3886
Trypanosoma cruzi aldo-keto reductase 0.0028 0.0163 0.0764
Mycobacterium ulcerans formate dehydrogenase H FdhF 0.0015 0.0044 0.025
Echinococcus granulosus aldo keto reductase 0.0028 0.0163 0.0163
Trichomonas vaginalis PIKK family atypical protein kinase 0.003 0.0184 0.0608
Trichomonas vaginalis PIKK family atypical protein kinase 0.0022 0.0108 0.0357
Trypanosoma brucei phosphatidylinositol kinase related protein, putative 0.003 0.0184 0.0807
Trypanosoma cruzi hypothetical protein, conserved 0.0042 0.0289 0.1428
Entamoeba histolytica Rab geranylgeranyltransferase beta subunit, putative 0.0087 0.0708 0.2293
Schistosoma mansoni aldo-keto reductase 0.0028 0.0163 0.0572
Loa Loa (eye worm) beta-lactamase 0.0042 0.0289 0.0914
Echinococcus granulosus geranylgeranyl transferase type 2 subunit alpha 0.0093 0.076 0.076
Toxoplasma gondii aldose reductase, putative 0.0028 0.0163 0.0666
Giardia lamblia Fructose-bisphosphate aldolase 0.0338 0.3021 1
Trichomonas vaginalis aldo/keto reductase, putative 0.0028 0.0163 0.0541
Entamoeba histolytica exodeoxyribonuclease III, putative 0.0023 0.0116 0.0322
Mycobacterium tuberculosis Probable lipase LipE 0.0042 0.0289 0.1225
Echinococcus multilocularis NADPH dependent diflavin oxidoreductase 1 0.0015 0.0044 0.0044
Plasmodium vivax AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.0023 0.0116 0.0309
Trichomonas vaginalis PIKK family atypical protein kinase 0.0012 0.0019 0.0064
Mycobacterium ulcerans fructose-bisphosphate aldolase 0.0165 0.1427 0.8047
Onchocerca volvulus Epoxide hydrolase 1 homolog 0.0351 0.3143 1
Brugia malayi integrin-linked kinase 0.01 0.0831 0.2748
Echinococcus granulosus aldehyde reductase 0.002 0.0089 0.0089
Echinococcus multilocularis aldo keto reductase family 1, member B4 0.0028 0.0163 0.0163
Echinococcus multilocularis aldo keto reductase 0.0028 0.0163 0.0163
Mycobacterium tuberculosis Probable exodeoxyribonuclease III protein XthA (exonuclease III) (EXO III) (AP endonuclease VI) 0.0023 0.0116 0.0492
Mycobacterium ulcerans esterase/lipase LipP 0.0042 0.0289 0.1628
Loa Loa (eye worm) hypothetical protein 0.0042 0.0289 0.0914
Trichomonas vaginalis PIKK family atypical protein kinase 0.0022 0.0108 0.0357
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.003 0.0184 0.0599
Leishmania major geranylgeranyltransferase, putative 0.0087 0.0708 0.3618
Trichomonas vaginalis protein farnesyltransferase beta subunit, putative 0.0087 0.0708 0.2342
Trichomonas vaginalis PIKK family atypical protein kinase 0.0022 0.0108 0.0357
Plasmodium vivax prenyltransferase alpha subunit, putative 0.032 0.2855 1
Leishmania major p450 reductase, putative 0.0015 0.0044 0.0084
Trichomonas vaginalis PIKK family atypical protein kinase 0.0012 0.0019 0.0064
Trichomonas vaginalis PIKK family atypical protein kinase 0.0022 0.0108 0.0357
Brugia malayi Protein prenyltransferase alpha subunit repeat containing protein 0.032 0.2855 0.9467
Brugia malayi FAD binding domain containing protein 0.0015 0.0044 0.0136
Trypanosoma cruzi phosphatidylinositol kinase related protein, putative 0.0022 0.0108 0.0471
Schistosoma mansoni fkbp-rapamycin associated protein 0.0012 0.0019 0.0068
Echinococcus granulosus aldo keto reductase 0.0028 0.0163 0.0163
Schistosoma mansoni geranylgeranyl transferase type II beta subunit 0.0087 0.0708 0.2478
Plasmodium vivax geranylgeranyltransferase, putative 0.0087 0.0708 0.2403
Toxoplasma gondii prenyltransferase and squalene oxidase repeat-containing protein 0.0087 0.0708 0.3432
Echinococcus granulosus protein prenyltransferase alpha subunit 0.0093 0.076 0.076
Trypanosoma cruzi cytochrome P450 reductase, putative 0.0015 0.0044 0.0132
Trichomonas vaginalis ap endonuclease, putative 0.0023 0.0116 0.0384
Trypanosoma brucei geranylgeranyl transferase type II beta subunit, putative 0.0087 0.0708 0.3605
Trypanosoma brucei NADPH--cytochrome P450 reductase, putative 0.0015 0.0044 0.0064
Brugia malayi oxidoreductase, aldo/keto reductase family protein 0.0028 0.0163 0.0532
Plasmodium vivax conserved Plasmodium protein, unknown function 0.013 0.1103 0.3801
Echinococcus granulosus beta LACTamase domain containing family member 0.0042 0.0289 0.0289
Trypanosoma cruzi lanosterol synthase, putative 0.0116 0.0979 0.5088
Echinococcus multilocularis protein farnesyltransferase subunit beta 0.0217 0.1906 0.1906
Trypanosoma cruzi hypothetical protein, conserved 0.0093 0.076 0.3928
Giardia lamblia Prenyltransferase 0.0217 0.1906 0.6273
Trypanosoma cruzi cytochrome P450 reductase, putative 0.0015 0.0044 0.0132
Trichomonas vaginalis PIKK family atypical protein kinase 0.0022 0.0108 0.0357
Leishmania major phosphatidylinositol kinase related protein, putative 0.0022 0.0108 0.0425
Entamoeba histolytica aldose reductase, putative 0.0028 0.0163 0.048
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.0022 0.0108 0.0347
Leishmania major target of rapamycin (TOR) kinase 2, putative 0.0022 0.0108 0.0423
Echinococcus multilocularis Rab geranylgeranyltransferase, beta subunit 0.0087 0.0708 0.0708
Echinococcus multilocularis aldo keto reductase family 1, member B4 0.0028 0.0163 0.0163
Giardia lamblia Rab geranylgeranyltransferase 0.0087 0.0708 0.227
Trypanosoma cruzi NADPH-dependent FMN/FAD containing oxidoreductase, putative 0.0015 0.0044 0.0132
Trichomonas vaginalis geranylgeranyl transferase type beta subunit, putative 0.0217 0.1906 0.6308
Echinococcus multilocularis integrin linked protein kinase 0.01 0.0831 0.0831
Loa Loa (eye worm) exodeoxyribonuclease III family protein 0.0023 0.0116 0.0358
Trypanosoma cruzi target of rapamycin kinase 3 0.0022 0.0108 0.0469
Echinococcus granulosus NADPH cytochrome P450 reductase 0.0015 0.0044 0.0044
Onchocerca volvulus Matrix metalloproteinase homolog 0.0309 0.2759 0.8709
Trichomonas vaginalis PIKK family atypical protein kinase 0.0012 0.0019 0.0064
Echinococcus multilocularis cpg binding protein 0.0037 0.0246 0.0246
Echinococcus multilocularis matrix metallopeptidase 7 (M10 family) 0.0507 0.4583 0.4583
Trichomonas vaginalis NADPH fad oxidoreductase, putative 0.0013 0.0028 0.0094
Trichomonas vaginalis aldo/keto reductase, putative 0.0028 0.0163 0.0541
Trichomonas vaginalis PIKK family atypical protein kinase 0.0022 0.0108 0.0357
Echinococcus multilocularis phosphatidylinositol 3 and 4 kinase 0.0022 0.0108 0.0108
Loa Loa (eye worm) hydrolase 0.0348 0.3115 1
Echinococcus granulosus cpg binding protein 0.0037 0.0246 0.0246
Trichomonas vaginalis PIKK family atypical protein kinase 0.0012 0.0019 0.0064
Brugia malayi Protein prenyltransferase alpha subunit repeat containing protein 0.0093 0.076 0.2513
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0338 0.3021 1
Toxoplasma gondii exonuclease III APE 0.0023 0.0116 0.0425
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.0022 0.0108 0.0347
Giardia lamblia Rab geranylgeranyltransferase 0.0093 0.076 0.2445
Trypanosoma brucei NADPH-cytochrome p450 reductase, putative 0.0015 0.0044 0.0064
Trichomonas vaginalis dihydrodiol dehydrogenase, putative 0.0028 0.0163 0.0541
Brugia malayi Prenyltransferase and squalene oxidase repeat family protein 0.0303 0.27 0.8951
Trypanosoma brucei Phosphatidylinositol 3-kinase tor1 0.0022 0.0108 0.0403
Trichomonas vaginalis PIKK family atypical protein kinase 0.0012 0.0019 0.0064
Schistosoma mansoni pol-related 0.0028 0.0163 0.0572
Loa Loa (eye worm) phosphatidylinositol 3 0.0022 0.0108 0.0332
Trypanosoma cruzi Phosphatidylinositol 3-kinase tor2 0.0022 0.0108 0.0469
Trichomonas vaginalis dihydrodiol dehydrogenase, putative 0.0028 0.0163 0.0541
Brugia malayi Probable protein farnesyltransferase beta subunit, putative 0.0087 0.0708 0.2338
Mycobacterium ulcerans beta-lactamase 0.0042 0.0289 0.1628
Entamoeba histolytica phosphatidylinositol3-kinaseTor2, putative 0.0022 0.0108 0.0295
Trypanosoma brucei prostaglandin f synthase 0.0028 0.0163 0.0699
Toxoplasma gondii target of rapamycin (TOR), putative 0.0022 0.0108 0.0383
Toxoplasma gondii ABC1 family protein 0.0042 0.0289 0.1303
Trypanosoma brucei Protein prenyltransferase alpha subunit repeat, putative 0.0093 0.076 0.3886
Trypanosoma brucei hypothetical protein, conserved 0.0042 0.0289 0.1368
Trichomonas vaginalis protein farnesyltransferase alpha subunit, putative 0.032 0.2855 0.9451
Trichomonas vaginalis type I geranylgeranyltransferase beta subunit, putative 0.0217 0.1906 0.6308
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0108 0.0906 0.2996
Echinococcus granulosus aldo keto reductase family 1 member B4 0.0028 0.0163 0.0163
Loa Loa (eye worm) prenyltransferase alpha subunit repeat containing protein 0.032 0.2855 0.9167
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0108 0.0906 0.0906
Plasmodium vivax hypothetical protein, conserved 0.0042 0.0289 0.0921
Brugia malayi Matrixin family protein 0.0337 0.3016 1
Echinococcus granulosus aldo keto reductase family 1 member B4 0.0028 0.0163 0.0163
Trypanosoma cruzi lanosterol synthase, putative 0.0116 0.0979 0.5088
Trichomonas vaginalis aldo-keto reductase, putative 0.0028 0.0163 0.0541
Trichomonas vaginalis PIKK family atypical protein kinase 0.0022 0.0108 0.0357
Trichomonas vaginalis geranylgeranyl transferase type II beta subunit, putative 0.0217 0.1906 0.6308
Trypanosoma brucei phosphatidylinositol 4-kinase, putative 0.0022 0.0108 0.0403
Plasmodium vivax geranylgeranyl transferase type2 beta subunit, putative 0.0087 0.0708 0.2403
Entamoeba histolytica Rab geranylgeranyltransferase alpha subunit, putative 0.0093 0.076 0.2468
Echinococcus multilocularis histone lysine N methyltransferase MLL3 0.0011 0.0005 0.0005
Mycobacterium leprae Conserved hypothetical protein 0.002 0.0089 0.0601
Trichomonas vaginalis geranylgeranyl transferase type II beta subunit, putative 0.0217 0.1906 0.6308
Brugia malayi oxidoreductase, aldo/keto reductase family protein 0.0028 0.0163 0.0532
Entamoeba histolytica protein farnesyltransferase alpha subunit, putative 0.032 0.2855 0.9448
Echinococcus granulosus aldo keto reductase family 1 member B4 0.0028 0.0163 0.0163
Brugia malayi Hemopexin family protein 0.0198 0.1729 0.5729
Leishmania major aldo-keto reductase-like protein 0.0028 0.0163 0.0719
Trichomonas vaginalis aldo-keto reductase, putative 0.0028 0.0163 0.0541
Trichomonas vaginalis protein farnesyltransferase alpha subunit/RAB geranylgeranyl transferase alpha subunit, putative 0.032 0.2855 0.9451
Plasmodium falciparum geranylgeranyl transferase type2 beta subunit, putative 0.0087 0.0708 0.236
Entamoeba histolytica fructose-1,6-bisphosphate aldolase, putative 0.0338 0.3021 1
Trichomonas vaginalis aldo-keto reductase, putative 0.0028 0.0163 0.0541
Mycobacterium tuberculosis Conserved protein 0.0042 0.0289 0.1225
Mycobacterium leprae Probable fructose bisphosphate aldolase Fba 0.0165 0.1427 0.9696
Mycobacterium leprae conserved hypothetical protein 0.0042 0.0289 0.1962
Trichomonas vaginalis PIKK family atypical protein kinase 0.0022 0.0108 0.0357
Trypanosoma cruzi geranylgeranyl transferase type II beta subunit, putative 0.0087 0.0708 0.3649
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.0012 0.0019 0.0053
Plasmodium vivax protein prenyltransferase alpha subunit, putative 0.0093 0.076 0.2589
Trypanosoma brucei NADPH-dependent diflavin oxidoreductase 1 0.0015 0.0044 0.0064
Loa Loa (eye worm) hypothetical protein 0.0139 0.1192 0.3817
Entamoeba histolytica aldose reductase, putative 0.0028 0.0163 0.048
Trypanosoma cruzi protein farnesyltransferase alpha subunit, putative 0.0093 0.076 0.3928
Schistosoma mansoni cpg binding protein 0.0037 0.0246 0.086
Brugia malayi Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative 0.0042 0.0289 0.0948
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0042 0.0289 0.1011
Brugia malayi exodeoxyribonuclease III family protein 0.0023 0.0116 0.0374
Mycobacterium tuberculosis Probable oxidoreductase 0.0202 0.1774 0.7523
Trichomonas vaginalis PIKK family atypical protein kinase 0.0022 0.0108 0.0357
Leishmania major prostaglandin f synthase, putative 0.0028 0.0163 0.0719
Loa Loa (eye worm) hypothetical protein 0.0012 0.0019 0.0047
Trichomonas vaginalis PIKK family atypical protein kinase 0.0022 0.0108 0.0357
Trichomonas vaginalis protein farnesyltransferase beta subunit, putative 0.0087 0.0708 0.2342
Mycobacterium ulcerans oxidoreductase 0.0028 0.0163 0.0921
Trypanosoma cruzi protein farnesyltransferase, putative 0.0217 0.1906 1
Trichomonas vaginalis PIKK family atypical protein kinase 0.0022 0.0108 0.0357
Entamoeba histolytica protein farnesyltransferase beta subunit, putative 0.0217 0.1906 0.6284
Trichomonas vaginalis aldo-keto reductase, putative 0.0028 0.0163 0.0541
Mycobacterium tuberculosis Possible penicillin-binding protein 0.0266 0.2358 1
Loa Loa (eye worm) oxidoreductase 0.0028 0.0163 0.0511
Echinococcus multilocularis protein farnesyltransferase alpha subunit 0.032 0.2855 0.2855
Onchocerca volvulus 0.0093 0.076 0.2003

Activities

Activity type Activity value Assay description Source Reference
IC50 (binding) = 3500 nM BindingDB_Patents: In Vitro Ezyme Assay. 5 uL of each compound dilution were robotically pipetted to Costar serocluster plates maintaining the same plate layout. All assay mixtures consisted of the following volumes: 5 uL diluted compound, 10 uL target enzyme preparation, 1 uL substrate, 5 uL assay ATP. From each assay mixture, 10 uL of assay mixture was spotted onto Millipore Multiscreen-PH opaque plates and washed twice for 10 minutes in 1% phosphoric acid. The plates were dried at 40 C. for 30 minutes, then substrate-phosphate complexes were quantitated by scintillation counting. These Millipore plates are in a 96-well format with immobilized P81 phosphocellulose membranes in the wells. Both the phosphorylated and non-phosphorylated form of the substrate bind to the membrane while ATP (unincorporated phosphate) is removed by subsequent wash steps. ChEMBL. No reference
IC50 (binding) = 3500 nM BindingDB_Patents: In Vitro Ezyme Assay. 5 uL of each compound dilution were robotically pipetted to Costar serocluster plates maintaining the same plate layout. All assay mixtures consisted of the following volumes: 5 uL diluted compound, 10 uL target enzyme preparation, 1 uL substrate, 5 uL assay ATP. From each assay mixture, 10 uL of assay mixture was spotted onto Millipore Multiscreen-PH opaque plates and washed twice for 10 minutes in 1% phosphoric acid. The plates were dried at 40 C. for 30 minutes, then substrate-phosphate complexes were quantitated by scintillation counting. These Millipore plates are in a 96-well format with immobilized P81 phosphocellulose membranes in the wells. Both the phosphorylated and non-phosphorylated form of the substrate bind to the membrane while ATP (unincorporated phosphate) is removed by subsequent wash steps. ChEMBL. No reference
IC50 (binding) = 3.5 uM Inhibition of full-length recombinant human GST-tagged ILK1 expressed in baculovirus infected insect Hi5 cells using CKRRRLASLR-amide as substrate after 15 mins by scintillation counting analysis in presence of [gamma-32P]-ATP ChEMBL. No reference

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.

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