Detailed information for compound 1511328

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 362.405 | Formula: C19H14N4O2S
  • H donors: 1 H acceptors: 4 LogP: 3.69 Rotable bonds: 5
    Rule of 5 violations (Lipinski): 1
  • SMILES: CC(=O)Nc1sc2c(n1)ccc(c2)c1ccnc(n1)Oc1ccccc1
  • InChi: 1S/C19H14N4O2S/c1-12(24)21-19-23-16-8-7-13(11-17(16)26-19)15-9-10-20-18(22-15)25-14-5-3-2-4-6-14/h2-11H,1H3,(H,21,23,24)
  • InChiKey: ZVYXSMKMXOPLQI-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 mechanistic target of rapamycin (serine/threonine kinase) Starlite/ChEMBL References
Homo sapiens phosphatidylinositol-4,5-bisphosphate 3-kinase, catalytic subunit alpha Starlite/ChEMBL References

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Loa Loa (eye worm) phosphatidylinositol 3 Get druggable targets OG5_127444 All targets in OG5_127444
Candida albicans similar to N terminal region of S. cerevisiae TOR2 (YKL203C) and TOR1 (YJR066W) putative protein/phosphatidylinositol kinases in Get druggable targets OG5_127212 All targets in OG5_127212
Toxoplasma gondii target of rapamycin (TOR), putative Get druggable targets OG5_127212 All targets in OG5_127212
Echinococcus granulosus phosphatidylinositol 45 bisphosphate 3 kinase Get druggable targets OG5_127444 All targets in OG5_127444
Leishmania infantum phosphatidylinositol 3-kinase 2, putative Get druggable targets OG5_127444 All targets in OG5_127444
Trichomonas vaginalis PIKK family atypical protein kinase Get druggable targets OG5_127212 All targets in OG5_127212
Schistosoma mansoni ataxia telangiectasia mutated (atm)-related Get druggable targets OG5_127212 All targets in OG5_127212
Trichomonas vaginalis PIKK family atypical protein kinase Get druggable targets OG5_127212 All targets in OG5_127212
Trichomonas vaginalis PIKK family atypical protein kinase Get druggable targets OG5_127212 All targets in OG5_127212
Schistosoma mansoni phosphatidylinositol-45-bisphosphate 3-kinase catalytic subunit alpha PI3K Get druggable targets OG5_127444 All targets in OG5_127444
Trypanosoma cruzi Phosphatidylinositol 3-kinase tor1 Get druggable targets OG5_127212 All targets in OG5_127212
Trypanosoma brucei Phosphatidylinositol 3-kinase tor1 Get druggable targets OG5_127212 All targets in OG5_127212
Trichomonas vaginalis PIKK family atypical protein kinase Get druggable targets OG5_127212 All targets in OG5_127212
Trichomonas vaginalis PIKK family atypical protein kinase Get druggable targets OG5_127212 All targets in OG5_127212
Trichomonas vaginalis PIKK family atypical protein kinase Get druggable targets OG5_127212 All targets in OG5_127212
Trichomonas vaginalis PIKK family atypical protein kinase Get druggable targets OG5_127212 All targets in OG5_127212
Leishmania mexicana phosphatidylinositol 3 kinase, putative Get druggable targets OG5_127212 All targets in OG5_127212
Candida albicans similar to internal region of S. cerevisiae TOR2 (YKL203C) and TOR1 (YJR066W) protein/phosphatidylinositol kinases involved in n Get druggable targets OG5_127212 All targets in OG5_127212
Trichomonas vaginalis PIKK family atypical protein kinase Get druggable targets OG5_127212 All targets in OG5_127212
Giardia lamblia Phosphoinositide-3-kinase, catalytic, alpha polypeptide Get druggable targets OG5_127444 All targets in OG5_127444
Trypanosoma brucei phosphatidylinositol 3-kinase tor, putative Get druggable targets OG5_127212 All targets in OG5_127212
Schistosoma japonicum FKBP12-rapamycin complex-associated protein, putative Get druggable targets OG5_127212 All targets in OG5_127212
Leishmania mexicana phosphatidylinositol 3-kinase, putative Get druggable targets OG5_127444 All targets in OG5_127444
Trichomonas vaginalis phosphatidylinositol kinase, putative Get druggable targets OG5_127444 All targets in OG5_127444
Neospora caninum Phosphatidylinositol 3-kinase tor2, related Get druggable targets OG5_127212 All targets in OG5_127212
Trichomonas vaginalis phopsphatidylinositol 3-kinase, drosophila, putative Get druggable targets OG5_127444 All targets in OG5_127444
Giardia lamblia GTOR Get druggable targets OG5_127212 All targets in OG5_127212
Trypanosoma cruzi phosphatidylinositol 3-kinase 2, putative Get druggable targets OG5_127444 All targets in OG5_127444
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein Get druggable targets OG5_127444 All targets in OG5_127444
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_127212 All targets in OG5_127212
Trypanosoma brucei phosphatidylinositol 4-kinase, putative Get druggable targets OG5_127212 All targets in OG5_127212
Trichomonas vaginalis PIKK family atypical protein kinase Get druggable targets OG5_127212 All targets in OG5_127212
Schistosoma japonicum FKBP12-rapamycin complex-associated protein, putative Get druggable targets OG5_127212 All targets in OG5_127212
Trichomonas vaginalis PIKK family atypical protein kinase Get druggable targets OG5_127212 All targets in OG5_127212
Trichomonas vaginalis PIKK family atypical protein kinase Get druggable targets OG5_127212 All targets in OG5_127212
Trichomonas vaginalis PIKK family atypical protein kinase Get druggable targets OG5_127212 All targets in OG5_127212
Trypanosoma cruzi Phosphatidylinositol 3-kinase tor2 Get druggable targets OG5_127212 All targets in OG5_127212
Candida albicans frameshifted from upsteam TOR2 CDS (CaP19.9461) Get druggable targets OG5_127212 All targets in OG5_127212
Trichomonas vaginalis PIKK family atypical protein kinase Get druggable targets OG5_127212 All targets in OG5_127212
Trichomonas vaginalis PIKK family atypical protein kinase Get druggable targets OG5_127212 All targets in OG5_127212
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein Get druggable targets OG5_127212 All targets in OG5_127212
Entamoeba histolytica phosphatidylinositol3-kinaseTor2, putative Get druggable targets OG5_127212 All targets in OG5_127212
Echinococcus multilocularis FKBP12 rapamycin complex associated protein Get druggable targets OG5_127212 All targets in OG5_127212
Leishmania major target of rapamycin (TOR) kinase 1, putative Get druggable targets OG5_127212 All targets in OG5_127212
Candida albicans frameshifted from upstream TOR2 CDS (CaP19.1905) Get druggable targets OG5_127212 All targets in OG5_127212
Trichomonas vaginalis PIKK family atypical protein kinase Get druggable targets OG5_127212 All targets in OG5_127212
Leishmania braziliensis target of rapamycin (TOR) kinase 2, putative Get druggable targets OG5_127212 All targets in OG5_127212
Trichomonas vaginalis PIKK family atypical protein kinase Get druggable targets OG5_127212 All targets in OG5_127212
Leishmania infantum target of rapamycin (TOR) kinase 1, putative Get druggable targets OG5_127212 All targets in OG5_127212
Leishmania donovani Phosphatidylinositol 3-kinase tor2 Get druggable targets OG5_127212 All targets in OG5_127212
Trypanosoma brucei gambiense phosphatidylinositol 3-kinase tor, putative Get druggable targets OG5_127212 All targets in OG5_127212
Leishmania mexicana phosphatidylinositol 3-kinase (tor2)-like protein Get druggable targets OG5_127212 All targets in OG5_127212
Entamoeba histolytica phosphatidylinositol 3-kinase 1, putative Get druggable targets OG5_127444 All targets in OG5_127444
Entamoeba histolytica hypothetical protein Get druggable targets OG5_127444 All targets in OG5_127444
Trichomonas vaginalis phosphatidylinositol 3-kinase catalytic subunit alpha, beta, delta, putative Get druggable targets OG5_127444 All targets in OG5_127444
Trichomonas vaginalis PIKK family atypical protein kinase Get druggable targets OG5_127212 All targets in OG5_127212
Leishmania major target of rapamycin (TOR) kinase 2, putative Get druggable targets OG5_127212 All targets in OG5_127212
Trichomonas vaginalis PIKK family atypical protein kinase Get druggable targets OG5_127212 All targets in OG5_127212
Trypanosoma congolense Phosphatidylinositol 3-kinase tor2 Get druggable targets OG5_127212 All targets in OG5_127212
Trypanosoma congolense Phosphatidylinositol 3-kinase tor1 Get druggable targets OG5_127212 All targets in OG5_127212
Trichomonas vaginalis phosphatidylinositol 3-kinase catalytic subunit gamma, putative Get druggable targets OG5_127444 All targets in OG5_127444
Trichomonas vaginalis PIKK family atypical protein kinase Get druggable targets OG5_127212 All targets in OG5_127212
Trichomonas vaginalis PIKK family atypical protein kinase Get druggable targets OG5_127212 All targets in OG5_127212
Leishmania donovani Phosphatidylinositol 3-kinase tor1 Get druggable targets OG5_127212 All targets in OG5_127212
Trypanosoma brucei gambiense phosphatidylinositol 3 kinase, putative Get druggable targets OG5_127212 All targets in OG5_127212
Leishmania infantum target of rapamycin (TOR) kinase 2, putative Get druggable targets OG5_127212 All targets in OG5_127212
Loa Loa (eye worm) phosphatidylinositol 3 Get druggable targets OG5_127212 All targets in OG5_127212
Echinococcus multilocularis phosphatidylinositol 4,5 bisphosphate 3 kinase Get druggable targets OG5_127444 All targets in OG5_127444
Schistosoma japonicum ko:K07203 FKBP12-rapamycin complex-associated protein, putative Get druggable targets OG5_127212 All targets in OG5_127212
Candida albicans similar to internal region of S. cerevisiae TOR2 (YKL203C) and TOR1 (YJR066W) protein/phosphatidylinositol kinases involved in n Get druggable targets OG5_127212 All targets in OG5_127212
Entamoeba histolytica phosphatidylinositol 3-kinase, putative Get druggable targets OG5_127444 All targets in OG5_127444
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_127444 All targets in OG5_127444
Echinococcus granulosus FKBP12 rapamycin complex associated protein Get druggable targets OG5_127212 All targets in OG5_127212
Candida albicans similar to N terminal region of S. cerevisiae TOR2 (YKL203C) and TOR1 (YJR066W) putative protein/phosphatidylinositol kinases in Get druggable targets OG5_127212 All targets in OG5_127212
Trichomonas vaginalis phosphatidylinositol 3-kinase class, putative Get druggable targets OG5_127444 All targets in OG5_127444
Trichomonas vaginalis PIKK family atypical protein kinase Get druggable targets OG5_127212 All targets in OG5_127212
Trichomonas vaginalis PIKK family atypical protein kinase Get druggable targets OG5_127212 All targets in OG5_127212
Trichomonas vaginalis PIKK family atypical protein kinase Get druggable targets OG5_127212 All targets in OG5_127212
Trichomonas vaginalis PIKK family atypical protein kinase Get druggable targets OG5_127212 All targets in OG5_127212
Trichomonas vaginalis PIKK family atypical protein kinase Get druggable targets OG5_127212 All targets in OG5_127212
Schistosoma japonicum FKBP12-rapamycin complex-associated protein, putative Get druggable targets OG5_127212 All targets in OG5_127212
Entamoeba histolytica FKBP-rapamycin associated protein (FRAP), putative Get druggable targets OG5_127212 All targets in OG5_127212
Entamoeba histolytica phosphatidylinositol 3-kinase, putative Get druggable targets OG5_127444 All targets in OG5_127444
Schistosoma japonicum ko:K00922 phosphatidylinositol-4,5-bisphosphate 3-kinase [EC2.7.1.153], putative Get druggable targets OG5_127444 All targets in OG5_127444
Trypanosoma cruzi phosphatidylinositol 3-kinase 2, putative Get druggable targets OG5_127444 All targets in OG5_127444
Leishmania donovani phosphatidylinositol 3-kinase 2, putative Get druggable targets OG5_127444 All targets in OG5_127444
By sequence similarity to non orthologous known druggable targets
Species Potential target Known druggable target Length Alignment span Identity
Entamoeba histolytica phosphatidylinositol 3-kinase, putative phosphatidylinositol-4,5-bisphosphate 3-kinase, catalytic subunit alpha 1068 aa 927 aa 29.0 %
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Leishmania major NADH-cytochrome b5 reductase, putative 0.0059 0.029 0.0189
Trypanosoma brucei NADH-cytochrome b5 reductase, putative 0.0059 0.029 0.0608
Leishmania major reductase, putative 0.0059 0.029 0.0189
Giardia lamblia Nitric oxide synthase, inducible 0.0459 0.4191 1
Trypanosoma brucei carnitine O-palmitoyltransferase, putative 0.0169 0.1369 0.2872
Mycobacterium ulcerans formate dehydrogenase H FdhF 0.0518 0.4765 1
Toxoplasma gondii flavodoxin domain-containing protein 0.0257 0.2221 1
Trichomonas vaginalis PIKK family atypical protein kinase 0.0047 0.0171 0.0287
Trypanosoma cruzi NADH-dependent fumarate reductase, putative 0.0059 0.029 0.0349
Mycobacterium tuberculosis Possible electron transfer protein FdxB 0.0059 0.029 0.5
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.0058 0.0279 0.0145
Trichomonas vaginalis PIKK family atypical protein kinase 0.0036 0.0066 0.0065
Trichomonas vaginalis NADPH cytochrome P450, putative 0.0198 0.1647 0.3408
Echinococcus multilocularis methionine synthase reductase 0.032 0.2834 0.4152
Onchocerca volvulus 0.0169 0.1369 1
Brugia malayi Choline O-acetyltransferase 0.0169 0.1369 0.125
Trypanosoma cruzi hypothetical protein, conserved 0.0169 0.1369 0.2045
Trichomonas vaginalis PIKK family atypical protein kinase 0.0033 0.0035 0.0001
Schistosoma mansoni 5-methyl tetrahydrofolate-homocysteine methyltransferase reductase 0.032 0.2834 0.5828
Entamoeba histolytica type A flavoprotein, putative 0.0198 0.1647 1
Trypanosoma cruzi hypothetical protein, conserved 0.0169 0.1369 0.2045
Leishmania major carnitine/choline acetyltransferase, putative 0.0169 0.1369 0.1913
Trypanosoma brucei NADPH-cytochrome p450 reductase, putative 0.0518 0.4765 1
Trypanosoma cruzi phosphatidylinositol 3-kinase vps34-like 0.0043 0.0136 0.0107
Loa Loa (eye worm) FAD binding domain-containing protein 0.032 0.2834 0.2785
Leishmania major choline/Carnitine o-acyltransferase-like protein 0.0688 0.6432 1
Brugia malayi Choline/Carnitine o-acyltransferase family protein 0.0169 0.1369 0.125
Trypanosoma brucei NADH-cytochrome b5 reductase, putative 0.0059 0.029 0.0608
Mycobacterium tuberculosis Probable monooxygenase 0.0059 0.029 0.5
Trypanosoma cruzi carnitine O-palmitoyltransferase II, putative 0.0342 0.3047 0.4682
Leishmania major carnitine palmitoyltransferase-like protein 0.0342 0.3047 0.4594
Trichomonas vaginalis PIKK family atypical protein kinase 0.0039 0.0093 0.0123
Trypanosoma cruzi hypothetical protein, conserved 0.0169 0.1369 0.2045
Trypanosoma cruzi carnitine/choline acetyltransferase, putative 0.0169 0.1369 0.2045
Onchocerca volvulus 0.0169 0.1369 1
Trypanosoma brucei NADH-dependent fumarate reductase, putative 0.0059 0.029 0.0608
Entamoeba histolytica type A flavoprotein, putative 0.0198 0.1647 1
Toxoplasma gondii NADH-cytochrome b5 reductase 1, putative 0.0059 0.029 0.0703
Entamoeba histolytica phosphatidylinositol 3-kinase, putative 0.0056 0.0261 0.0831
Echinococcus granulosus phosphatidylinositol 45 bisphosphate 3 kinase 0.0226 0.192 0.2666
Trichomonas vaginalis PIKK family atypical protein kinase 0.0044 0.0143 0.0229
Trypanosoma brucei carnitine O-palmitoyltransferase II, putative 0.0169 0.1369 0.2872
Trypanosoma brucei NADH-cytochrome b5 reductase, putative 0.0059 0.029 0.0608
Trypanosoma cruzi NADH-cytochrome b5 reductase, putative 0.0059 0.029 0.0349
Trypanosoma cruzi choline/carnitine O-acetyltransferase, putative 0.0169 0.1369 0.2045
Trichomonas vaginalis phosphatidylinositol kinase, putative 0.0043 0.0136 0.0212
Trypanosoma cruzi carnitine/choline acetyltransferase, putative 0.0169 0.1369 0.2045
Trypanosoma brucei NADH-cytochrome b5 reductase, putative 0.0059 0.029 0.0608
Mycobacterium tuberculosis Possible oxygenase 0.0059 0.029 0.5
Trypanosoma cruzi nitrate reductase, putative 0.0059 0.029 0.0349
Entamoeba histolytica phosphatidylinositol 3-kinase, putative 0.0098 0.0668 0.3521
Loa Loa (eye worm) carnitine O-palmitoyltransferase I isoform 0.0169 0.1369 0.131
Trypanosoma cruzi NADH-dependent fumarate reductase, putative 0.0059 0.029 0.0349
Plasmodium falciparum S-adenosyl-L-methionine-dependent tRNA 4-demethylwyosine synthase, putative 0.0198 0.1647 0.3033
Leishmania major target of rapamycin (TOR) kinase 2, putative 0.0058 0.0279 0.0172
Mycobacterium tuberculosis Probable oxidoreductase 0.0059 0.029 0.5
Trichomonas vaginalis PIKK family atypical protein kinase 0.0047 0.0171 0.0287
Schistosoma mansoni NADPH flavin oxidoreductase 0.0261 0.226 0.4588
Trypanosoma cruzi Flavodoxin/Radical SAM superfamily/Wyosine base formation, putative 0.0198 0.1647 0.2482
Echinococcus multilocularis NADH cytochrome b5 reductase 3 0.0059 0.029 0.0017
Loa Loa (eye worm) cytochrome b5 reductase 4 0.0059 0.029 0.0224
Trypanosoma cruzi p450 reductase, putative 0.0059 0.029 0.0349
Trypanosoma cruzi hypothetical protein, conserved 0.0169 0.1369 0.2045
Leishmania major NADPH-cytochrome p450 reductase-like protein 0.0518 0.4765 0.7338
Trypanosoma cruzi oxidoreductase-like protein, putative 0.0059 0.029 0.0349
Trichomonas vaginalis sulfite reductase, putative 0.0518 0.4765 1
Trichomonas vaginalis PIKK family atypical protein kinase 0.0044 0.0143 0.0229
Trypanosoma cruzi hypothetical protein, conserved 0.0169 0.1369 0.2045
Onchocerca volvulus 0.0169 0.1369 1
Plasmodium vivax hypothetical protein, conserved 0.0198 0.1647 0.3033
Echinococcus multilocularis NADPH cytochrome P450 reductase 0.0518 0.4765 0.7291
Plasmodium vivax NADPH-cytochrome p450 reductase, putative 0.0518 0.4765 1
Trypanosoma brucei target of rapamycin kinase 3, putative 0.0047 0.0171 0.0359
Entamoeba histolytica type A flavoprotein, putative 0.0198 0.1647 1
Trichomonas vaginalis PIKK family atypical protein kinase 0.004 0.0105 0.0147
Echinococcus multilocularis carnitine O palmitoyltransferase 1, liver 0.0688 0.6432 1
Echinococcus granulosus NADH cytochrome b5 reductase 3 0.0059 0.029 0.0017
Trichomonas vaginalis PIKK family atypical protein kinase 0.0047 0.0171 0.0287
Toxoplasma gondii flavodoxin domain-containing protein 0.0257 0.2221 1
Loa Loa (eye worm) hypothetical protein 0.0169 0.1369 0.131
Echinococcus multilocularis cytochrome b5 reductase 4 0.0059 0.029 0.0017
Trypanosoma cruzi phosphatidylinositol 3-kinase 2, putative 0.0122 0.0903 0.1314
Trypanosoma brucei NADPH--cytochrome P450 reductase, putative 0.0518 0.4765 1
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.008 0.0497 0.0366
Echinococcus granulosus choline O acetyltransferase 0.0169 0.1369 0.1771
Giardia lamblia Flavohemoprotein lateral transfer candidate 0.0059 0.029 0.0647
Loa Loa (eye worm) hypothetical protein 0.0518 0.4765 0.473
Trichomonas vaginalis PIKK family atypical protein kinase 0.005 0.0202 0.0352
Leishmania major cytochrome-b5 reductase, putative 0.0059 0.029 0.0189
Leishmania major hypothetical protein, conserved 0.0198 0.1647 0.2357
Trichomonas vaginalis PIKK family atypical protein kinase 0.0044 0.0143 0.0229
Trypanosoma brucei carnitine O-palmitoyltransferase II, putative 0.0342 0.3047 0.6395
Trypanosoma cruzi NADPH--cytochrome P450 reductase, putative 0.0198 0.1647 0.2482
Trichomonas vaginalis NADPH cytochrome P450, putative 0.0198 0.1647 0.3408
Schistosoma mansoni cytochrome P450 reductase 0.0518 0.4765 1
Entamoeba histolytica phosphatidylinositol3-kinaseTor2, putative 0.0058 0.0279 0.0949
Trypanosoma cruzi NADH-cytochrome b5 reductase, putative 0.0059 0.029 0.0349
Plasmodium falciparum nitric oxide synthase, putative 0.0518 0.4765 1
Echinococcus multilocularis NADPH dependent diflavin oxidoreductase 1 0.0518 0.4765 0.7291
Trypanosoma brucei oxidoreductase-protein, putative 0.0059 0.029 0.0608
Trypanosoma brucei phosphatidylinositol 3-kinase, putative 0.0043 0.0136 0.0285
Schistosoma mansoni phosphatidylinositol-45-bisphosphate 3-kinase catalytic subunit alpha PI3K 0.0226 0.192 0.3854
Trichomonas vaginalis PIKK family atypical protein kinase 0.0033 0.0035 0.0001
Trichomonas vaginalis PIKK family atypical protein kinase 0.0044 0.0143 0.0229
Trichomonas vaginalis PIKK family atypical protein kinase 0.0044 0.0143 0.0229
Echinococcus granulosus phosphatidylinositol 4 phosphate 3 kinase C2 0.008 0.0497 0.0354
Chlamydia trachomatis sulfite reductase 0.032 0.2834 1
Trichomonas vaginalis phosphatidylinositol 3-kinase catalytic subunit gamma, putative 0.0122 0.0903 0.1836
Trichomonas vaginalis phosphatidylinositol 3-kinase class, putative 0.0085 0.0542 0.1072
Trypanosoma cruzi NADH-cytochrome b5 reductase, putative 0.0059 0.029 0.0349
Trypanosoma brucei NADH-cytochrome b5 reductase, putative 0.0059 0.029 0.0608
Giardia lamblia GTOR 0.0058 0.0279 0.0622
Leishmania major NADH-dependent fumarate reductase-like protein 0.0059 0.029 0.0189
Trypanosoma brucei NADH-cytochrome b5 reductase-like protein 0.0059 0.029 0.0608
Trypanosoma cruzi NADH-dependent fumarate reductase, putative 0.0059 0.029 0.0349
Treponema pallidum flavodoxin 0.0198 0.1647 1
Trypanosoma cruzi Flavodoxin/Radical SAM superfamily/Wyosine base formation, putative 0.0198 0.1647 0.2482
Trichomonas vaginalis PIKK family atypical protein kinase 0.0044 0.0143 0.0229
Entamoeba histolytica type A flavoprotein, putative 0.0198 0.1647 1
Loa Loa (eye worm) flavodoxin family protein 0.0198 0.1647 0.1591
Trichomonas vaginalis PIKK family atypical protein kinase 0.0036 0.0063 0.0059
Loa Loa (eye worm) choline O-acetyltransferase 0.0169 0.1369 0.131
Trypanosoma cruzi Phosphatidylinositol 3-kinase tor1 0.0058 0.0279 0.0333
Brugia malayi flavodoxin family protein 0.0518 0.4765 0.4693
Trypanosoma brucei carnitine O-acetyltransferase, putative 0.0169 0.1369 0.2872
Trypanosoma cruzi NADH-dependent fumarate reductase, putative 0.0059 0.029 0.0349
Entamoeba histolytica hypothetical protein 0.0098 0.0668 0.3521
Echinococcus multilocularis carnitine O palmitoyltransferase 2 0.0342 0.3047 0.4499
Schistosoma mansoni NADH-cytochrome B5 reductase 0.0059 0.029 0.0333
Echinococcus multilocularis phosphatidylinositol 4 phosphate 3 kinase C2 0.008 0.0497 0.0354
Leishmania major NADH-cytochrome b5 reductase, putative 0.0059 0.029 0.0189
Trypanosoma cruzi phosphatidylinositol 3-kinase 2, putative 0.0122 0.0903 0.1314
Schistosoma mansoni diflavin oxidoreductase 0.0257 0.2221 0.4505
Loa Loa (eye worm) phosphatidylinositol 3 0.0058 0.0279 0.0213
Trichomonas vaginalis PIKK family atypical protein kinase 0.0033 0.0035 0.0001
Brugia malayi phosphoinositide 3'-hydroxykinase p110-alpha subunit, putative 0.0104 0.0732 0.0604
Mycobacterium tuberculosis Hypothetical oxidoreductase 0.0059 0.029 0.5
Trypanosoma cruzi choline/carnitine O-acyltransferase, putative 0.0688 0.6432 1
Loa Loa (eye worm) diaphorase 0.0059 0.029 0.0224
Trypanosoma cruzi target of rapamycin kinase 3 0.0047 0.0171 0.0163
Trichomonas vaginalis phosphatidylinositol 3-kinase catalytic subunit alpha, beta, delta, putative 0.0085 0.0542 0.1072
Echinococcus granulosus carnitine O palmitoyltransferase 2 0.0342 0.3047 0.4499
Trichomonas vaginalis PIKK family atypical protein kinase 0.0033 0.0035 0.0001
Trypanosoma cruzi cytochrome P450 reductase, putative 0.0518 0.4765 0.7381
Trypanosoma cruzi cytochrome-b5 reductase, putative 0.0059 0.029 0.0349
Leishmania major NADH-dependent fumarate reductase, putative 0.0059 0.029 0.0189
Giardia lamblia Hypothetical protein 0.0459 0.4191 1
Trypanosoma cruzi NADH-cytochrome b5 reductase, putative 0.0059 0.029 0.0349
Loa Loa (eye worm) choline/Carnitine O-acyltransferase 0.0342 0.3047 0.3
Trichomonas vaginalis PIKK family atypical protein kinase 0.0036 0.0066 0.0065
Loa Loa (eye worm) hypothetical protein 0.008 0.0497 0.0433
Trichomonas vaginalis phosphatidylinositol kinase, putative 0.0122 0.0903 0.1836
Brugia malayi FAD binding domain containing protein 0.0518 0.4765 0.4693
Trichomonas vaginalis PIKK family atypical protein kinase 0.0058 0.0279 0.0516
Trichomonas vaginalis PIKK family atypical protein kinase 0.0044 0.0143 0.0229
Onchocerca volvulus 0.0169 0.1369 1
Trypanosoma cruzi choline/carnitine O-acyltransferase, putative 0.0169 0.1369 0.2045
Entamoeba histolytica phosphatidylinositol 3-kinase 1, putative 0.0115 0.0835 0.4628
Trypanosoma cruzi cytochrome-b5 reductase, putative 0.0059 0.029 0.0349
Schistosoma mansoni ataxia telangiectasia mutated (atm)-related 0.0058 0.0279 0.031
Trypanosoma brucei NADH-dependent fumarate reductase 0.0059 0.029 0.0608
Echinococcus granulosus cytochrome b5 reductase 4 0.0059 0.029 0.0017
Trypanosoma brucei Phosphatidylinositol 3-kinase tor1 0.0058 0.0279 0.0586
Plasmodium vivax flavodoxin domain containing protein 0.0459 0.4191 0.8717
Trypanosoma cruzi cytochrome P450 reductase, putative 0.0518 0.4765 0.7381
Trichomonas vaginalis PIKK family atypical protein kinase 0.0058 0.0279 0.0516
Echinococcus granulosus NADPH dependent diflavin oxidoreductase 1 0.0518 0.4765 0.7291
Trypanosoma cruzi reductase, putative 0.0059 0.029 0.0349
Trichomonas vaginalis PIKK family atypical protein kinase 0.0036 0.0066 0.0065
Trypanosoma brucei NADPH-dependent diflavin oxidoreductase 1 0.0518 0.4765 1
Echinococcus granulosus NADPH cytochrome P450 reductase 0.0518 0.4765 0.7291
Trypanosoma cruzi NADH-cytochrome b5 reductase, putative 0.0059 0.029 0.0349
Entamoeba histolytica phosphatidylinositol 3-kinase, putative 0.0122 0.0903 0.508
Entamoeba histolytica FKBP-rapamycin associated protein (FRAP), putative 0.0058 0.0279 0.0949
Trypanosoma cruzi carnitine O-acetyltransferase, putative 0.0169 0.1369 0.2045
Trypanosoma brucei phosphatidylinositol 4-kinase, putative 0.0058 0.0279 0.0586
Trypanosoma brucei nitrate reductase, putative 0.0059 0.029 0.0608
Loa Loa (eye worm) FAD binding domain-containing protein 0.0518 0.4765 0.473
Trichomonas vaginalis phosphatidylinositol 3-kinase catalytic subunit alpha, beta, delta, putative 0.0043 0.0136 0.0212
Echinococcus multilocularis phosphatidylinositol 4,5 bisphosphate 3 kinase 0.0226 0.192 0.2666
Trichomonas vaginalis PIKK family atypical protein kinase 0.0047 0.0171 0.0287
Loa Loa (eye worm) phosphatidylinositol 3 0.0202 0.1684 0.1628
Trichomonas vaginalis PIKK family atypical protein kinase 0.0036 0.0063 0.0059
Echinococcus multilocularis choline O acetyltransferase 0.0169 0.1369 0.1771
Brugia malayi flavodoxin family protein 0.0198 0.1647 0.1532
Leishmania major p450 reductase, putative 0.0518 0.4765 0.7338
Trypanosoma brucei NADH-dependent fumarate reductase 0.0059 0.029 0.0608
Trypanosoma cruzi Phosphatidylinositol 3-kinase tor2 0.0058 0.0279 0.0333
Brugia malayi FAD binding domain containing protein 0.032 0.2834 0.2735
Leishmania major target of rapamycin (TOR) kinase 1, putative 0.0058 0.0279 0.0172
Trypanosoma cruzi p450 reductase, putative 0.0518 0.4765 0.7381
Brugia malayi diaphorase 0.0059 0.029 0.0156
Trypanosoma cruzi NADH-dependent fumarate reductase, putative 0.0059 0.029 0.0349
Brugia malayi Cytochrome b5-like Heme/Steroid binding domain containing protein 0.0059 0.029 0.0156
Trypanosoma cruzi NADH-cytochrome b5 reductase, putative 0.0059 0.029 0.0349
Trypanosoma brucei hypothetical protein, conserved 0.0169 0.1369 0.2872
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.0122 0.0903 0.0778
Plasmodium falciparum NADPH--cytochrome P450 reductase, putative 0.0198 0.1647 0.3033
Entamoeba histolytica type A flavoprotein, putative 0.0198 0.1647 1
Trypanosoma cruzi choline/carnitine O-acyltransferase, putative 0.0688 0.6432 1
Toxoplasma gondii ferredoxin NADP+ oxidoreductase FNR 0.0059 0.029 0.0703
Leishmania major oxidoreductase-like protein 0.0059 0.029 0.0189
Trypanosoma cruzi NADH-dependent fumarate reductase, putative 0.0059 0.029 0.0349
Trichomonas vaginalis NADPH cytochrome P450, putative 0.0198 0.1647 0.3408
Schistosoma mansoni cytochrome B5 0.0059 0.029 0.0333
Trypanosoma cruzi oxidoreductase-protein, putative 0.0059 0.029 0.0349
Trichomonas vaginalis phopsphatidylinositol 3-kinase, drosophila, putative 0.0122 0.0903 0.1836
Loa Loa (eye worm) hypothetical protein 0.0042 0.0122 0.0055
Trichomonas vaginalis PIKK family atypical protein kinase 0.0047 0.0171 0.0287
Brugia malayi Choline/Carnitine o-acyltransferase family protein 0.0342 0.3047 0.2952
Echinococcus granulosus carnitine O palmitoyltransferase 1 liver 0.0688 0.6432 1
Trypanosoma brucei NADPH--cytochrome P450 reductase, putative 0.0518 0.4765 1
Trypanosoma cruzi NADPH-dependent FMN/FAD containing oxidoreductase, putative 0.0518 0.4765 0.7381
Echinococcus granulosus methionine synthase reductase 0.032 0.2834 0.4152
Trichomonas vaginalis NADPH fad oxidoreductase, putative 0.0459 0.4191 0.8786
Echinococcus granulosus cytochrome b5 reductase 4 0.0059 0.029 0.0017
Trypanosoma brucei NADH-dependent fumarate reductase, putative 0.0059 0.029 0.0608
Trichomonas vaginalis PIKK family atypical protein kinase 0.0058 0.0279 0.0516
Trichomonas vaginalis phosphatidylinositol 3-kinase class, putative 0.0043 0.0136 0.0212
Schistosoma mansoni choline o-acyltransferase 0.0169 0.1369 0.2663
Trypanosoma brucei S-adenosyl-L-methionine-dependent tRNA 4-demethylwyosine synthase, putative 0.0198 0.1647 0.3456
Brugia malayi Choline O-acetyltransferase 0.0169 0.1369 0.125
Schistosoma mansoni choline o-acyltransferase 0.0169 0.1369 0.2663
Trichomonas vaginalis NADPH cytochrome P450, putative 0.0198 0.1647 0.3408
Leishmania major cytochrome-b5 reductase, putative 0.0059 0.029 0.0189
Leishmania major NADH-cytochrome b5 reductase, putative 0.0059 0.029 0.0189
Leishmania major nitrate reductase, putative 0.0059 0.029 0.0189
Giardia lamblia Phosphoinositide-3-kinase, catalytic, alpha polypeptide 0.0061 0.0306 0.0688
Trypanosoma brucei NADH-cytochrome b5 reductase, putative 0.0059 0.029 0.0608
Leishmania major cytochrome P450 reductase, putative 0.0459 0.4191 0.6421

Activities

Activity type Activity value Assay description Source Reference
IC50 (binding) > 6000 nM Inhibition of mTOR assessed as inhibition of 4EBP1 phosphorylation by TR-FRET assay ChEMBL. 21332118
Ki (binding) = 102 nM Inhibition of human PI3Kalpha expressed in Sf9 cells ChEMBL. 21332118

Phenotypes

Whole-cell/tissue/organism interactions

We have no records of whole-cell/tissue assays done with this compound What does this mean?

Many chemical entities in TDR Targets come from high-throughput screenings with whole cells or tissue samples, and not all assayed compounds have been tested against a single a single target protein, probably because they get ruled out during screening process. Even if these compounds may have not been of interest in the original screening, they may come as interesting leads for other screening assays. Furthermore, we may be able to propose drug-target associations using chemical similarities and network patterns.

Annotated phenotypes:

We have no manually annotated phenotypes for this drug. What does this mean? / Care to help?
In TDR Targets, information about phenotypes that are caused by drugs, or by genetic manipulation of cells (e.g. gene knockouts or knockdowns) is manually curated from the literature. These descriptions help to describe the potential of the target for drug development. If no information is available for this gene or if the information is incomplete, this may mean that i) the papers containing this information either appeared after the curation effort for this organism was carried out or they were inadvertently missed by curators; or that ii) the curation effort for this organism has not yet started.
 
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External resources for this compound

Bibliographic References

1 literature reference was collected for this gene.

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