Detailed information for compound 1110486

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 534.565 | Formula: C30H26N6O4
  • H donors: 3 H acceptors: 4 LogP: 3.96 Rotable bonds: 7
    Rule of 5 violations (Lipinski): 2
  • SMILES: COc1ccc2c(c1)c(/C=C\1/Oc3c(C1=O)cc(cc3)NC(=O)Nc1cccnc1)c([nH]2)c1c(C)nn(c1C)C
  • InChi: 1S/C30H26N6O4/c1-16-27(17(2)36(3)35-16)28-22(21-13-20(39-4)8-9-24(21)34-28)14-26-29(37)23-12-18(7-10-25(23)40-26)32-30(38)33-19-6-5-11-31-15-19/h5-15,34H,1-4H3,(H2,32,33,38)/b26-14+
  • InChiKey: GQKMWAFJWXSCNB-VULFUBBASA-N  

Network

Hover on a compound node to display the structore

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
Trichomonas vaginalis PIKK family atypical protein kinase Get druggable targets OG5_127212 All targets in OG5_127212
Giardia lamblia GTOR 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 donovani phosphatidylinositol 3-kinase 2, putative Get druggable targets OG5_127444 All targets in OG5_127444
Echinococcus multilocularis FKBP12 rapamycin complex associated protein Get druggable targets OG5_127212 All targets in OG5_127212
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein Get druggable targets OG5_127444 All targets in OG5_127444
Schistosoma japonicum FKBP12-rapamycin complex-associated protein, putative 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
Leishmania infantum phosphatidylinositol 3-kinase 2, putative Get druggable targets OG5_127444 All targets in OG5_127444
Schistosoma japonicum FKBP12-rapamycin complex-associated protein, putative Get druggable targets OG5_127212 All targets in OG5_127212
Trypanosoma brucei phosphatidylinositol 3-kinase tor, putative 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
Leishmania braziliensis target of rapamycin (TOR) kinase 2, putative 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
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 ko:K00922 phosphatidylinositol-4,5-bisphosphate 3-kinase [EC2.7.1.153], putative 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
Trypanosoma cruzi Phosphatidylinositol 3-kinase tor2 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
Trichomonas vaginalis phopsphatidylinositol 3-kinase, drosophila, putative Get druggable targets OG5_127444 All targets in OG5_127444
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
Trichomonas vaginalis PIKK family atypical protein kinase 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
Leishmania mexicana phosphatidylinositol 3-kinase (tor2)-like protein 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
Entamoeba histolytica phosphatidylinositol 3-kinase, putative Get druggable targets OG5_127444 All targets in OG5_127444
Echinococcus multilocularis phosphatidylinositol 4,5 bisphosphate 3 kinase Get druggable targets OG5_127444 All targets in OG5_127444
Trypanosoma congolense Phosphatidylinositol 3-kinase tor2 Get druggable targets OG5_127212 All targets in OG5_127212
Loa Loa (eye worm) hypothetical protein 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
Trypanosoma cruzi phosphatidylinositol 3-kinase 2, putative Get druggable targets OG5_127444 All targets in OG5_127444
Leishmania mexicana phosphatidylinositol 3 kinase, putative 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
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 phosphatidylinositol 3-kinase catalytic subunit gamma, putative Get druggable targets OG5_127444 All targets in OG5_127444
Loa Loa (eye worm) phosphatidylinositol 3 Get druggable targets OG5_127444 All targets in OG5_127444
Toxoplasma gondii target of rapamycin (TOR), 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
Neospora caninum Phosphatidylinositol 3-kinase tor2, 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
Trypanosoma cruzi Phosphatidylinositol 3-kinase tor1 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 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 brucei phosphatidylinositol 4-kinase, putative 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
Loa Loa (eye worm) phosphatidylinositol 3 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
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
Candida albicans frameshifted from upstream TOR2 CDS (CaP19.1905) 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
Trichomonas vaginalis PIKK family atypical protein kinase 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
Echinococcus granulosus FKBP12 rapamycin complex associated protein 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
Trichomonas vaginalis phosphatidylinositol 3-kinase catalytic subunit alpha, beta, delta, putative Get druggable targets OG5_127444 All targets in OG5_127444
Leishmania major target of rapamycin (TOR) kinase 1, putative 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
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
Leishmania infantum target of rapamycin (TOR) kinase 1, 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
Entamoeba histolytica hypothetical protein 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
Trypanosoma congolense Phosphatidylinositol 3-kinase tor1 Get druggable targets OG5_127212 All targets in OG5_127212
Loa Loa (eye worm) hypothetical protein 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 phosphatidylinositol kinase, 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 japonicum ko:K07203 FKBP12-rapamycin complex-associated protein, putative 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
Trichomonas vaginalis PIKK family atypical protein kinase 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
Trichomonas vaginalis PIKK family atypical protein kinase 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 major target of rapamycin (TOR) kinase 2, 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
Trypanosoma brucei gambiense phosphatidylinositol 3-kinase tor, putative Get druggable targets OG5_127212 All targets in OG5_127212

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
Trichomonas vaginalis PIKK family atypical protein kinase 0.0044 0.032 0.083
Toxoplasma gondii acyl-CoA:diacylglycerol acyltransferase 1-related enzyme 0.0021 0.0013 0.0408
Trichomonas vaginalis Clan SC, family S33, methylesterase-like serine peptidase 0.0071 0.0683 0.177
Schistosoma mansoni membrane-bound acyltransferase/hhat 0.0021 0.0013 0.0013
Leishmania major 3-oxoacyl-(acyl-carrier protein) reductase, putative 0.0059 0.0523 0.7664
Plasmodium falciparum lysophospholipase, putative 0.0071 0.0683 1
Trypanosoma cruzi glycerol uptake protein, putative 0.0021 0.0013 0.0097
Echinococcus granulosus lysophospholipid acyltransferase 7 0.0021 0.0013 0.0013
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0154 0.1788 0.1788
Trypanosoma brucei FAT domain/Rapamycin binding domain/Phosphatidylinositol 3- and 4-kinase, putative 0.0026 0.0084 0.1228
Plasmodium vivax pyruvate kinase, putative 0.0035 0.0206 0.3022
Leishmania major glycerol uptake protein, putative 0.0021 0.0013 0.0192
Brugia malayi phosphoinositide 3'-hydroxykinase p110-alpha subunit, putative 0.0104 0.1121 0.1737
Schistosoma mansoni transcription factor LCR-F1 0.0084 0.0852 0.0852
Brugia malayi 3-hydroxyacyl-CoA dehydrogenase type II 0.0059 0.0523 0.0811
Loa Loa (eye worm) hypothetical protein 0.0025 0.0065 0.01
Trichomonas vaginalis PIKK family atypical protein kinase 0.0047 0.0358 0.0927
Echinococcus granulosus geminin 0.019 0.2258 0.2258
Schistosoma mansoni pyruvate kinase 0.0035 0.0206 0.0206
Trypanosoma brucei pyruvate kinase 1 0.0035 0.0206 0.3022
Mycobacterium tuberculosis Probable lipase LipE 0.0039 0.0259 0.0845
Schistosoma mansoni amidase 0.0104 0.1119 0.1119
Loa Loa (eye worm) hypothetical protein 0.0035 0.0206 0.032
Brugia malayi Muscleblind-like protein 0.0506 0.6455 1
Mycobacterium leprae Probable lipase LipE 0.0039 0.0259 0.1113
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0039 0.0259 0.0259
Loa Loa (eye worm) follicle stimulating hormone receptor 0.0263 0.323 0.5003
Mycobacterium tuberculosis Probable esterase/lipase LipP 0.0039 0.0259 0.0845
Loa Loa (eye worm) 3-hydroxyacyl-CoA dehydrogenase type II 0.0055 0.0471 0.0729
Trichomonas vaginalis glutaminase, putative 0.031 0.3859 1
Trichomonas vaginalis PIKK family atypical protein kinase 0.0022 0.0026 0.0068
Trypanosoma cruzi GUP1, putative 0.0021 0.0013 0.0097
Toxoplasma gondii target of rapamycin (TOR), putative 0.0044 0.032 1
Loa Loa (eye worm) hypothetical protein 0.0039 0.0259 0.0402
Trypanosoma cruzi target of rapamycin kinase 3 0.0047 0.0358 0.2644
Trichomonas vaginalis PIKK family atypical protein kinase 0.0033 0.0174 0.045
Schistosoma mansoni ataxia telangiectasia mutated (atm)-related 0.0058 0.0505 0.0505
Schistosoma mansoni hypothetical protein 0.0084 0.0852 0.0852
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0154 0.1788 0.1788
Echinococcus granulosus diacylglycerol O acyltransferase 1 0.0021 0.0013 0.0013
Mycobacterium ulcerans lysophospholipase 0.0071 0.0683 0.177
Trichomonas vaginalis PIKK family atypical protein kinase 0.0044 0.032 0.083
Schistosoma mansoni hypothetical protein 0.0021 0.0013 0.0013
Loa Loa (eye worm) hypothetical protein 0.008 0.0801 0.1242
Trypanosoma cruzi glycerol uptake protein, putative 0.0021 0.0013 0.0097
Mycobacterium ulcerans beta-lactamase 0.0039 0.0259 0.0672
Giardia lamblia Phosphoinositide-3-kinase, class 3 0.0031 0.0152 0.2798
Plasmodium falciparum pyruvate kinase 0.0035 0.0206 0.3022
Brugia malayi beta-lactamase 0.0039 0.0259 0.0402
Trypanosoma brucei target of rapamycin kinase 3, putative 0.0047 0.0358 0.5246
Trypanosoma cruzi GUP1, putative 0.0021 0.0013 0.0097
Trichomonas vaginalis conserved hypothetical protein 0.0071 0.0683 0.177
Trypanosoma brucei monoglyceride lipase, putative 0.0071 0.0683 1
Onchocerca volvulus Pyruvate kinase homolog 0.0035 0.0206 0.3786
Plasmodium falciparum diacylglycerol O-acyltransferase 0.0021 0.0013 0.0192
Entamoeba histolytica hydrolase, alpha/beta fold family domain containing protein 0.0071 0.0683 0.5041
Trypanosoma cruzi Phosphatidylinositol 3-kinase tor2 0.0058 0.0505 0.3728
Brugia malayi MBOAT family protein 0.0021 0.0013 0.002
Mycobacterium tuberculosis Conserved protein 0.0039 0.0259 0.0845
Trichomonas vaginalis Clan SC, family S33, methylesterase-like serine peptidase 0.0071 0.0683 0.177
Echinococcus granulosus sterol O acyltransferase 1 0.0021 0.0013 0.0013
Echinococcus multilocularis pyruvate kinase 0.0035 0.0206 0.0206
Mycobacterium tuberculosis Possible lysophospholipase 0.0071 0.0683 0.2226
Echinococcus multilocularis phosphatidylinositol 4,5 bisphosphate 3 kinase 0.0226 0.2737 0.2737
Leishmania major monoglyceride lipase, putative 0.0071 0.0683 1
Echinococcus granulosus fatty acid amide hydrolase 1 0.0104 0.1119 0.1119
Mycobacterium ulcerans hypothetical protein 0.0071 0.0683 0.177
Brugia malayi Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative 0.0039 0.0259 0.0402
Brugia malayi diacylglycerol acyltransferase 0.0021 0.0013 0.002
Trichomonas vaginalis PIKK family atypical protein kinase 0.0047 0.0358 0.0927
Trichomonas vaginalis PIKK family atypical protein kinase 0.0044 0.032 0.083
Leishmania major glycerol uptake protein, putative 0.0021 0.0013 0.0192
Giardia lamblia GTOR 0.0058 0.0505 0.9314
Loa Loa (eye worm) diacylglycerol acyltransferase 0.0021 0.0013 0.002
Echinococcus multilocularis 3 hydroxyacyl coenzyme A dehydrogenase type 2 0.0059 0.0523 0.0523
Echinococcus granulosus o acyltransferase membrane bound domain 0.0021 0.0013 0.0013
Trypanosoma brucei hypothetical protein, conserved 0.0039 0.0259 0.3798
Trichomonas vaginalis porcupine, putative 0.0021 0.0013 0.0034
Mycobacterium tuberculosis Probable pyruvate kinase PykA 0.0035 0.0206 0.0672
Mycobacterium tuberculosis Conserved protein 0.0039 0.0259 0.0845
Echinococcus granulosus zinc finger protein 0.022 0.2654 0.2654
Trypanosoma brucei phosphatidylinositol 3-kinase tor, putative 0.0029 0.0125 0.1835
Plasmodium falciparum lysophospholipase, putative 0.0071 0.0683 1
Trichomonas vaginalis PIKK family atypical protein kinase 0.0033 0.0174 0.045
Entamoeba histolytica phosphatidylinositol 3-kinase, putative 0.0043 0.031 0.2287
Plasmodium vivax PST-A protein 0.0071 0.0683 1
Loa Loa (eye worm) phosphatidylinositol 3 0.0036 0.0217 0.0336
Echinococcus multilocularis o acyltransferase (membrane bound) domain 0.0021 0.0013 0.0013
Brugia malayi MBOAT family protein 0.0021 0.0013 0.002
Leishmania major glycerol uptake protein, putative 0.0021 0.0013 0.0192
Trypanosoma brucei Phosphatidylinositol 3-kinase tor1 0.0058 0.0505 0.7395
Trichomonas vaginalis PIKK family atypical protein kinase 0.0058 0.0505 0.1309
Onchocerca volvulus 0.0039 0.0259 0.4824
Leishmania major phosphatidylinositol 3-kinase, putative 0.0022 0.0026 0.0384
Schistosoma mansoni sterol O-acyltransferase 1 0.0021 0.0013 0.0013
Loa Loa (eye worm) pyruvate kinase-PB 0.0025 0.0065 0.01
Toxoplasma gondii pyruvate kinase PyK1 0.0035 0.0206 0.644
Trichomonas vaginalis esterase, putative 0.0039 0.0259 0.0672
Wolbachia endosymbiont of Brugia malayi exonuclease III 0.002 0 0.5
Trichomonas vaginalis PIKK family atypical protein kinase 0.0033 0.0174 0.045
Mycobacterium tuberculosis Possible conserved lipoprotein LpqK 0.0039 0.0259 0.0845
Leishmania major pyruvate kinase 0.0035 0.0206 0.3022
Entamoeba histolytica membrane-bound O-acyltransferase (MBOAT ) family protein 0.0021 0.0013 0.0097
Brugia malayi glutaminase DH11.1 0.031 0.3859 0.5978
Trichomonas vaginalis D-aminoacylase, putative 0.0039 0.0259 0.0672
Echinococcus multilocularis tumor protein p63 0.0404 0.5105 0.5105
Mycobacterium ulcerans short-chain type dehydrogenase/reductase 0.0059 0.0523 0.1356
Trichomonas vaginalis pyruvate kinase, putative 0.0035 0.0206 0.0535
Entamoeba histolytica hypothetical protein, conserved 0.0021 0.0013 0.0097
Leishmania major pyruvate kinase 0.0035 0.0206 0.3022
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0056 0.0479 0.0743
Plasmodium vivax diacylglycerol O-acyltransferase, putative 0.0021 0.0013 0.0192
Echinococcus multilocularis Membrane bound O acyl transferase, MBOAT 0.0021 0.0013 0.0013
Trypanosoma brucei phosphatidylinositol 3-kinase, putative 0.0022 0.0026 0.0384
Leishmania major hypothetical protein, conserved 0.0021 0.0013 0.0192
Echinococcus granulosus beta LACTamase domain containing family member 0.0039 0.0259 0.0259
Echinococcus multilocularis muscleblind protein 1 0.0506 0.6455 0.6455
Entamoeba histolytica phosphatidylinositol 3-kinase, putative 0.0098 0.1034 0.7633
Trichomonas vaginalis PIKK family atypical protein kinase 0.0022 0.0026 0.0068
Schistosoma mansoni microtubule-associated protein tau 0.0773 1 1
Trypanosoma cruzi pyruvate kinase 2, putative 0.0035 0.0206 0.1523
Loa Loa (eye worm) hypothetical protein 0.0506 0.6455 1
Entamoeba histolytica vacuolar protein sorting 26 0.0021 0.0013 0.0097
Entamoeba histolytica phosphatidylinositol 3-kinase, putative 0.0122 0.1355 1
Schistosoma mansoni zinc finger protein 0.024 0.2929 0.2929
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0154 0.1788 0.277
Echinococcus granulosus muscleblind protein 0.0506 0.6455 0.6455
Schistosoma mansoni hypothetical protein 0.019 0.2258 0.2258
Trypanosoma cruzi phosphatidylinositol 3-kinase vps34-like 0.0043 0.031 0.2287
Brugia malayi Pyruvate kinase, M2 isozyme 0.0035 0.0206 0.032
Schistosoma mansoni leukocyte receptor cluster (lrc) member 4 protein 0.0021 0.0013 0.0013
Trichomonas vaginalis Clan SC, family S33, methylesterase-like serine peptidase 0.0071 0.0683 0.177
Trichomonas vaginalis phopsphatidylinositol 3-kinase, drosophila, putative 0.0122 0.1355 0.351
Loa Loa (eye worm) hypothetical protein 0.0506 0.6455 1
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0154 0.1788 0.1788
Loa Loa (eye worm) hypothetical protein 0.0039 0.0259 0.0402
Loa Loa (eye worm) hypothetical protein 0.0021 0.0013 0.002
Trichomonas vaginalis Clan SC, family S33, methylesterase-like serine peptidase 0.0071 0.0683 0.177
Echinococcus granulosus o acyltransferase membrane bound domain 0.0021 0.0013 0.0013
Mycobacterium tuberculosis Probable esterase LipL 0.0039 0.0259 0.0845
Loa Loa (eye worm) phosphatidylinositol 3 0.0202 0.2417 0.3744
Loa Loa (eye worm) pyruvate kinase 0.0035 0.0206 0.032
Trichomonas vaginalis PIKK family atypical protein kinase 0.0033 0.0173 0.0448
Schistosoma mansoni hypothetical protein 0.019 0.2258 0.2258
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.0022 0.0026 0.0041
Schistosoma mansoni cellular tumor antigen P53 0.0059 0.0524 0.0524
Trypanosoma cruzi pyruvate kinase 2, putative 0.0035 0.0206 0.1523
Onchocerca volvulus Pyruvate kinase homolog 0.0035 0.0206 0.3786
Brugia malayi amidase 0.0104 0.1119 0.1733
Entamoeba histolytica hypothetical protein 0.0098 0.1034 0.7633
Trichomonas vaginalis phosphatidylinositol 3-kinase class, putative 0.0085 0.0863 0.2236
Trypanosoma cruzi Phosphatidylinositol 3-kinase tor1 0.0058 0.0505 0.3728
Leishmania major target of rapamycin kinase (TOR) kinase 3 0.0047 0.0358 0.5246
Loa Loa (eye worm) pyruvate kinase 0.0035 0.0206 0.032
Echinococcus multilocularis muscleblind protein 0.0506 0.6455 0.6455
Echinococcus multilocularis pyruvate kinase 0.0035 0.0206 0.0206
Trichomonas vaginalis transmembrane protein nessy, putative 0.0021 0.0013 0.0034
Loa Loa (eye worm) membrane bound O-acyltransferase domain containing 1 0.0021 0.0013 0.002
Trichomonas vaginalis PIKK family atypical protein kinase 0.0047 0.0358 0.0927
Echinococcus multilocularis protein cysteine N palmitoyltransferase 0.024 0.2929 0.2929
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0154 0.1788 0.1788
Brugia malayi latrophilin 2 splice variant baaae 0.0038 0.0245 0.0379
Entamoeba histolytica hypothetical protein 0.0084 0.0852 0.6289
Echinococcus multilocularis o acyltransferase (membrane bound) domain 0.0021 0.0013 0.0013
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0154 0.1788 0.1788
Trichomonas vaginalis PIKK family atypical protein kinase 0.0022 0.0026 0.0068
Echinococcus multilocularis fatty acid amide hydrolase 1 0.0104 0.1119 0.1119
Trichomonas vaginalis PIKK family atypical protein kinase 0.0036 0.0215 0.0557
Trichomonas vaginalis PIKK family atypical protein kinase 0.0044 0.032 0.083
Mycobacterium tuberculosis Possible penicillin-binding protein 0.0251 0.3068 1
Schistosoma mansoni phosphatidylinositol 3-and 4-kinase 0.0022 0.0026 0.0026
Onchocerca volvulus 0.0039 0.0259 0.4824
Trichomonas vaginalis phosphatidylinositol kinase, putative 0.0122 0.1355 0.351
Entamoeba histolytica hypothetical protein 0.0084 0.0852 0.6289
Echinococcus granulosus Membrane bound O acyl transferase MBOAT 0.0021 0.0013 0.0013
Trichomonas vaginalis PIKK family atypical protein kinase 0.004 0.0268 0.0694
Trichomonas vaginalis PIKK family atypical protein kinase 0.0047 0.0358 0.0927
Mycobacterium ulcerans hypothetical protein 0.0039 0.0259 0.0672
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0084 0.0852 0.0852
Toxoplasma gondii ABC1 family protein 0.0039 0.0259 0.8094
Trichomonas vaginalis phosphatidylinositol 3-kinase catalytic subunit gamma, putative 0.0122 0.1355 0.351
Loa Loa (eye worm) beta-lactamase 0.0039 0.0259 0.0402
Trichomonas vaginalis PIKK family atypical protein kinase 0.0036 0.0215 0.0557
Plasmodium falciparum esterase, putative 0.0071 0.0683 1
Trichomonas vaginalis PIKK family atypical protein kinase 0.0036 0.0211 0.0546
Trichomonas vaginalis PIKK family atypical protein kinase 0.0044 0.032 0.083
Trichomonas vaginalis PIKK family atypical protein kinase 0.0044 0.032 0.083
Loa Loa (eye worm) hypothetical protein 0.0021 0.0013 0.002
Trypanosoma brucei phosphatidylinositol 3-related kinase, putative 0.0022 0.0026 0.0384
Leishmania major glycerol uptake protein, putative 0.0021 0.0013 0.0192
Trypanosoma cruzi monoglyceride lipase, putative 0.0071 0.0683 0.5041
Trypanosoma brucei pyruvate kinase 1, putative 0.0035 0.0206 0.3022
Trichomonas vaginalis conserved hypothetical protein 0.0071 0.0683 0.177
Schistosoma mansoni o-acyltransferase (membrane bound) domain containing protein 0.0021 0.0013 0.0013
Onchocerca volvulus 0.0039 0.0259 0.4824
Echinococcus multilocularis zinc finger protein 0.022 0.2654 0.2654
Plasmodium vivax hypothetical protein, conserved 0.0039 0.0259 0.3798
Mycobacterium tuberculosis Probable short-chain type dehydrogenase/reductase 0.0059 0.0523 0.1706
Entamoeba histolytica phosphatidylinositol3-kinaseTor2, putative 0.0058 0.0505 0.3728
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.0122 0.1355 0.2099
Loa Loa (eye worm) MBOAT family protein 0.0021 0.0013 0.002
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0084 0.0852 0.0852
Giardia lamblia Pyruvate kinase 0.0035 0.0206 0.3805
Trichomonas vaginalis PIKK family atypical protein kinase 0.0039 0.0252 0.0654
Schistosoma mansoni fatty-acid amide hydrolase 0.0104 0.1119 0.1119
Onchocerca volvulus 0.0059 0.0524 1
Echinococcus granulosus phosphatidylinositol 4 phosphate 3 kinase C2 0.008 0.0801 0.0801
Trichomonas vaginalis pyruvate kinase, putative 0.0035 0.0206 0.0535
Trichomonas vaginalis PIKK family atypical protein kinase 0.0036 0.0211 0.0546
Trichomonas vaginalis PIKK family atypical protein kinase 0.0047 0.0358 0.0927
Brugia malayi MBOAT family protein 0.0021 0.0013 0.002
Trichomonas vaginalis conserved hypothetical protein 0.0021 0.0013 0.0034
Entamoeba histolytica phosphatidylinositol 3-kinase, putative 0.0043 0.031 0.2287
Trichomonas vaginalis penicillin-binding protein, putative 0.0039 0.0259 0.0672
Entamoeba histolytica pyruvate kinase, putative 0.0025 0.0065 0.0477
Schistosoma mansoni o-acyltransferase (membrane bound) domain containing protein 0.0021 0.0013 0.0013
Echinococcus multilocularis membrane bound acyltransferase:hhat 0.0021 0.0013 0.0013
Echinococcus granulosus fatty acid amide hydrolase 1 0.0104 0.1119 0.1119
Trichomonas vaginalis D-aminoacylase, putative 0.0039 0.0259 0.0672
Brugia malayi beta-lactamase family protein 0.0039 0.0259 0.0402
Loa Loa (eye worm) hypothetical protein 0.0039 0.0259 0.0402
Brugia malayi Pyruvate kinase, muscle isozyme 0.0035 0.0206 0.032
Leishmania major glycerol uptake protein, putative 0.0021 0.0013 0.0192
Echinococcus multilocularis diacylglycerol O acyltransferase 1 0.0021 0.0013 0.0013
Leishmania major hypothetical protein, conserved 0.0039 0.0259 0.3798
Loa Loa (eye worm) hypothetical protein 0.0059 0.0524 0.0811
Trypanosoma brucei glycerol uptake protein, putative 0.0021 0.0013 0.0192
Treponema pallidum alginate O-acetylation protein (algI) 0.0021 0.0013 1
Trichomonas vaginalis PIKK family atypical protein kinase 0.0033 0.0173 0.0448
Loa Loa (eye worm) hypothetical protein 0.0104 0.1119 0.1733
Schistosoma mansoni glutaminase 0.031 0.3859 0.3859
Mycobacterium tuberculosis Probable conserved lipoprotein 0.0039 0.0259 0.0845
Trichomonas vaginalis D-aminoacylase, putative 0.0039 0.0259 0.0672
Loa Loa (eye worm) hypothetical protein 0.0021 0.0013 0.002
Trichomonas vaginalis valacyclovir hydrolase, putative 0.0071 0.0683 0.177
Schistosoma mansoni phosphatidylinositol-45-bisphosphate 3-kinase catalytic subunit alpha PI3K 0.0226 0.2737 0.2737
Trichomonas vaginalis Clan SC, family S33, methylesterase-like serine peptidase 0.0071 0.0683 0.177
Schistosoma mansoni o-acyltransferase (membrane bound) domain containing protein 0.0021 0.0013 0.0013
Loa Loa (eye worm) glutaminase 0.031 0.3859 0.5978
Mycobacterium ulcerans short-chain type dehydrogenase/reductase 0.0059 0.0523 0.1356
Echinococcus multilocularis geminin 0.019 0.2258 0.2258
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0154 0.1788 0.1788
Mycobacterium tuberculosis Probable hydrolase 0.0039 0.0259 0.0845
Echinococcus multilocularis beta LACTamase domain containing family member 0.0039 0.0259 0.0259
Echinococcus multilocularis sterol O acyltransferase 1 0.0021 0.0013 0.0013
Leishmania major target of rapamycin (TOR) kinase 2, putative 0.0058 0.0505 0.7395
Loa Loa (eye worm) glutaminase 2 0.031 0.3859 0.5978
Loa Loa (eye worm) hypothetical protein 0.0039 0.0259 0.0402
Trypanosoma cruzi glycerol uptake protein, putative 0.0021 0.0013 0.0097
Entamoeba histolytica membrane-bound O-acyltransferase (MBOAT ) family protein 0.0021 0.0013 0.0097
Trypanosoma cruzi phosphatidylinositol 3-related kinase, putative 0.0022 0.0026 0.0193
Echinococcus granulosus 3 hydroxyacyl coenzyme A dehydrogenase type 2 0.0059 0.0523 0.0523
Mycobacterium tuberculosis Probable lipase LipD 0.0039 0.0259 0.0845
Trichomonas vaginalis conserved hypothetical protein 0.0021 0.0013 0.0034
Trichomonas vaginalis PIKK family atypical protein kinase 0.0044 0.032 0.083
Schistosoma mansoni 3-hydroxyacyl-CoA dehydrogenase 0.0059 0.0523 0.0523
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0154 0.1788 0.1788
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.0058 0.0505 0.0782
Trichomonas vaginalis phosphatidylinositol kinase, putative 0.0043 0.031 0.0803
Mycobacterium ulcerans pyruvate kinase 0.0035 0.0206 0.0535
Echinococcus multilocularis pyruvate kinase 0.0028 0.0108 0.0108
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0056 0.0479 0.0743
Mycobacterium ulcerans glutaminase 0.031 0.3859 1
Mycobacterium ulcerans fusion of enoyl-CoA hydratase, EchA21 and lipase, LipE 0.0039 0.0259 0.0672
Trichomonas vaginalis PIKK family atypical protein kinase 0.0058 0.0505 0.1309
Brugia malayi follicle stimulating hormone receptor 0.0263 0.323 0.5003
Echinococcus granulosus tumor protein p63 0.0404 0.5105 0.5105
Echinococcus granulosus pyruvate kinase 0.0035 0.0206 0.0206
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0039 0.0259 0.0259
Trichomonas vaginalis PIKK family atypical protein kinase 0.005 0.04 0.1036
Loa Loa (eye worm) hhat protein 0.0021 0.0013 0.002
Brugia malayi Calcitonin receptor-like protein seb-1 0.0056 0.0479 0.0743
Trypanosoma cruzi phosphatidylinositol 3-kinase 2, putative 0.0122 0.1355 1
Entamoeba histolytica hypothetical protein 0.0021 0.0013 0.0097
Loa Loa (eye worm) MBOAT family protein 0.024 0.2929 0.4537
Echinococcus multilocularis phosphatidylinositol 3 and 4 kinase 0.0022 0.0026 0.0026
Loa Loa (eye worm) hypothetical protein 0.0039 0.0259 0.0402
Loa Loa (eye worm) hypothetical protein 0.0039 0.0259 0.0402
Loa Loa (eye worm) hypothetical protein 0.0038 0.0245 0.0379
Toxoplasma gondii acyl-CoA:cholesterol acyltransferase alpha ACAT1-alpha 0.0021 0.0013 0.0408
Entamoeba histolytica hydrolase, alpha/beta fold family domain containing protein 0.0071 0.0683 0.5041
Leishmania major phosphatidylinositol 3-related kinase, putative 0.0022 0.0026 0.0384
Brugia malayi Hhat protein 0.0021 0.0013 0.002
Echinococcus granulosus phosphatidylinositol 45 bisphosphate 3 kinase 0.0226 0.2737 0.2737
Mycobacterium ulcerans esterase/lipase LipP 0.0039 0.0259 0.0672
Trichomonas vaginalis phosphatidylinositol 3-kinase catalytic subunit alpha, beta, delta, putative 0.0043 0.031 0.0803
Loa Loa (eye worm) hypothetical protein 0.0042 0.0291 0.0451
Schistosoma mansoni hypothetical protein 0.0038 0.0245 0.0245
Entamoeba histolytica phosphatidylinositol 3-kinase 1, putative 0.0115 0.1262 0.9314
Echinococcus multilocularis o acyltransferase (membrane bound) domain 0.0021 0.0013 0.0013
Loa Loa (eye worm) phosphatidylinositol 3 0.0022 0.0026 0.0041
Loa Loa (eye worm) hypothetical protein 0.0021 0.0013 0.002
Trypanosoma cruzi phosphatidylinositol 3-kinase, putative 0.0036 0.0217 0.1601
Echinococcus granulosus phosphatidylinositol 3 and 4 kinase 0.0022 0.0026 0.0026
Trichomonas vaginalis PIKK family atypical protein kinase 0.0058 0.0505 0.1309
Schistosoma mansoni phosphatidylinositol-45-bisphosphate 3-kinase catalytic subunit alpha PI3K 0.0043 0.031 0.031
Loa Loa (eye worm) phosphatidylinositol 3 0.0058 0.0505 0.0782
Trypanosoma cruzi hypothetical protein, conserved 0.0039 0.0259 0.1915
Echinococcus granulosus o acyltransferase membrane bound domain 0.0021 0.0013 0.0013
Brugia malayi beta-lactamase family protein 0.0039 0.0259 0.0402
Brugia malayi MBOAT family protein 0.0021 0.0013 0.002
Trichomonas vaginalis PIKK family atypical protein kinase 0.0033 0.0173 0.0448
Toxoplasma gondii hypothetical protein 0.0021 0.0013 0.0408
Trypanosoma brucei monoglyceride lipase, putative 0.0071 0.0683 1
Plasmodium falciparum lysophospholipase, putative 0.0071 0.0683 1
Trichomonas vaginalis penicillin-binding protein, putative 0.0039 0.0259 0.0672
Echinococcus multilocularis fatty acid amide hydrolase 1 0.0104 0.1119 0.1119
Trichomonas vaginalis phosphatidylinositol 3-kinase catalytic subunit alpha, beta, delta, putative 0.0085 0.0863 0.2236
Giardia lamblia Phosphoinositide-3-kinase, catalytic, alpha polypeptide 0.0061 0.0542 1
Mycobacterium ulcerans lipase LipD 0.0039 0.0259 0.0672
Mycobacterium tuberculosis Conserved protein 0.0039 0.0259 0.0845
Echinococcus multilocularis phosphatidylinositol 4 phosphate 3 kinase C2 0.008 0.0801 0.0801
Echinococcus multilocularis lysophospholipid acyltransferase 7 0.0021 0.0013 0.0013
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0154 0.1788 0.277
Trypanosoma brucei glycerol uptake protein, putative 0.0021 0.0013 0.0192
Loa Loa (eye worm) hhat protein 0.0021 0.0013 0.002
Mycobacterium leprae POSSIBLE LYSOPHOSPHOLIPASE 0.0071 0.0683 1
Entamoeba histolytica FKBP-rapamycin associated protein (FRAP), putative 0.0058 0.0505 0.3728
Onchocerca volvulus Pyruvate kinase homolog 0.0035 0.0206 0.3786
Echinococcus granulosus FKBP12 rapamycin complex associated protein 0.0058 0.0505 0.0505
Echinococcus multilocularis FKBP12 rapamycin complex associated protein 0.0058 0.0505 0.0505
Trichomonas vaginalis PIKK family atypical protein kinase 0.0022 0.0026 0.0068
Loa Loa (eye worm) hypothetical protein 0.0056 0.0479 0.0743
Loa Loa (eye worm) pyruvate kinase 0.0035 0.0206 0.032
Loa Loa (eye worm) beta-LACTamase domain containing family member 0.0039 0.0259 0.0402
Trichomonas vaginalis phosphatidylinositol 3-kinase class, putative 0.0043 0.031 0.0803
Trypanosoma brucei phosphatidylinositol 4-kinase, putative 0.0058 0.0505 0.7395
Echinococcus granulosus pyruvate kinase 0.0035 0.0206 0.0206
Entamoeba histolytica hypothetical protein 0.0084 0.0852 0.6289
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.008 0.0801 0.1242
Schistosoma mansoni pyruvate kinase 0.0035 0.0206 0.0206
Mycobacterium leprae conserved hypothetical protein 0.0039 0.0259 0.1113
Entamoeba histolytica hypothetical protein 0.0084 0.0852 0.6289
Trichomonas vaginalis conserved hypothetical protein 0.0021 0.0013 0.0034
Echinococcus granulosus membrane bound acyltransferase:hhat 0.0021 0.0013 0.0013
Trypanosoma cruzi hypothetical protein, conserved 0.0039 0.0259 0.1915
Schistosoma mansoni diacylglycerol O-acyltransferase 1 0.0021 0.0013 0.0013
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.0043 0.031 0.048
Leishmania major target of rapamycin (TOR) kinase 1, putative 0.0058 0.0505 0.7395
Entamoeba histolytica phosphatidylinositol 3-kinase, putative 0.0056 0.0481 0.3549
Entamoeba histolytica membrane-bound O-acyltransferase (MBOAT ) family protein 0.0021 0.0013 0.0097
Echinococcus granulosus protein cysteine N palmitoyltransferase 0.024 0.2929 0.2929
Trichomonas vaginalis PIKK family atypical protein kinase 0.0022 0.0026 0.0068
Trichomonas vaginalis PIKK family atypical protein kinase 0.0036 0.0215 0.0557
Echinococcus multilocularis microtubule associated protein 2 0.0773 1 1
Trypanosoma brucei phosphatidylinositol 3-kinase, putative 0.0043 0.031 0.4536
Trichomonas vaginalis PIKK family atypical protein kinase 0.0033 0.0174 0.045
Brugia malayi hypothetical protein 0.0084 0.0852 0.132
Brugia malayi MBOAT family protein 0.024 0.2929 0.4537
Loa Loa (eye worm) MBOAT family protein 0.0021 0.0013 0.002
Trypanosoma cruzi phosphatidylinositol 3-kinase 2, putative 0.0122 0.1355 1
Trypanosoma cruzi phosphatidylinositol 3-related kinase, putative 0.0022 0.0026 0.0193
Chlamydia trachomatis pyruvate kinase 0.0035 0.0206 0.5

Activities

Activity type Activity value Assay description Source Reference
IC50 (binding) = 0.5 nM Inhibition of PI3Kalpha ChEMBL. 20483602
IC50 (binding) = 5.2 nM Inhibition of mTOR ChEMBL. 20483602
IC50 (functional) = 76 nM Cytotoxicity against human MDA-MB-361 cells ChEMBL. 20483602

Phenotypes

Whole-cell/tissue/organism interactions

Species name Source Reference Is orphan
Homo sapiens ChEMBL23 20483602

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

1 literature reference was collected for this gene.

If you have references for this compound, please enter them in a user comment (below) or Contact us.