Detailed information for compound 280805

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 965.108 | Formula: C42H72N14O12
  • H donors: 14 H acceptors: 13 LogP: -2.86 Rotable bonds: 39
    Rule of 5 violations (Lipinski): 4
  • SMILES: NCC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N)CC(C)C)[C@H](O)C)CC(C)C)[C@H](CC)C)C)C)Cc1nc[nH]c1)CC(=O)N
  • InChi: 1S/C42H72N14O12/c1-10-21(6)33(41(67)54-27(12-20(4)5)40(66)56-34(24(9)57)42(68)52-26(35(45)61)11-19(2)3)55-32(60)17-47-36(62)22(7)49-37(63)23(8)50-38(64)28(13-25-16-46-18-48-25)53-39(65)29(14-30(44)58)51-31(59)15-43/h16,18-24,26-29,33-34,57H,10-15,17,43H2,1-9H3,(H2,44,58)(H2,45,61)(H,46,48)(H,47,62)(H,49,63)(H,50,64)(H,51,59)(H,52,68)(H,53,65)(H,54,67)(H,55,60)(H,56,66)/t21-,22-,23-,24+,26-,27-,28-,29-,33-,34-/m0/s1
  • InChiKey: BBHBQLLLLMLAQL-VSIZVFMCSA-N  


Substructure search Similarity search

Network

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Synonyms

No synonyms found for this compound

Targets

Known targets for this compound

No curated genes were found associated with this compound

Predicted pathogen targets for this compound

By orthology
No druggable targets predicted by orthology data
By sequence similarity to non orthologous known druggable targets
No druggable targets predicted by sequence similarity
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Trichomonas vaginalis CMGC family protein kinase 0.1412 0.4333 0.4333
Leishmania major cytochrome p450-like protein 0.0014 0.0003 0.0003
Loa Loa (eye worm) hypothetical protein 0.0111 0.0303 0.055
Trypanosoma brucei nucleoside transporter 1, putative 0.0308 0.0914 0.0914
Echinococcus multilocularis bromodomain adjacent to zinc finger domain 0.0074 0.0187 0.0182
Loa Loa (eye worm) hypothetical protein 0.0036 0.007 0.0122
Loa Loa (eye worm) hypothetical protein 0.1776 0.5461 1
Schistosoma mansoni regulator of G protein signaling 17 19 20 (rgs17 19 20) 0.0022 0.0028 0.0014
Echinococcus multilocularis expressed conserved protein 0.0018 0.0016 0.001
Loa Loa (eye worm) hypothetical protein 0.0102 0.0276 0.05
Trichomonas vaginalis voltage and ligand gated potassium channel, putative 0.004 0.0083 0.0083
Schistosoma mansoni serine/threonine protein kinase 0.0035 0.0068 0.0054
Echinococcus multilocularis protein jagged 2 0.0031 0.0056 0.005
Schistosoma mansoni regulator of G protein signaling 0.0022 0.0028 0.0014
Loa Loa (eye worm) hypothetical protein 0.036 0.1075 0.1964
Schistosoma mansoni intermediate filament proteins 0.0031 0.0056 0.0042
Echinococcus multilocularis regulator of G protein signaling 3 0.0022 0.0028 0.0022
Schistosoma mansoni integrin alpha 0.0476 0.1434 0.1422
Loa Loa (eye worm) hypothetical protein 0.0174 0.0498 0.0907
Brugia malayi phosphofructokinase 0.0127 0.0351 0.0638
Loa Loa (eye worm) hypothetical protein 0.0031 0.0054 0.0094
Schistosoma mansoni serine/threonine protein kinase 0.0018 0.0016 0.0002
Echinococcus multilocularis cGMP dependent protein kinase 1 0.0018 0.0016 0.001
Trypanosoma brucei pyruvate kinase 1 0.0039 0.0079 0.0079
Schistosoma mansoni serine/threonine protein kinase 0.0018 0.0016 0.0002
Schistosoma mansoni equilibrative nucleoside transporter 0.0308 0.0914 0.0902
Brugia malayi PHD-finger family protein 0.0033 0.0062 0.0107
Brugia malayi Flap endonuclease-1 0.003 0.0053 0.0091
Echinococcus multilocularis pyruvate kinase 0.0039 0.0079 0.0074
Giardia lamblia Histone acetyltransferase GCN5 0.0046 0.01 0.0079
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0053 0.0124 0.0221
Loa Loa (eye worm) hypothetical protein 0.1776 0.5461 1
Trypanosoma brucei cytochrome P450, putative 0.0014 0.0003 0.0003
Echinococcus multilocularis axis inhibition protein axin 0.0022 0.0028 0.0022
Echinococcus granulosus A kinase anchor protein 10 mitochondrial 0.0022 0.0028 0.0022
Echinococcus granulosus cGMP dependent protein kinase 1 0.0018 0.0016 0.001
Brugia malayi intermediate filament protein 0.0031 0.0056 0.0097
Echinococcus multilocularis equilibrative nucleoside transporter 3 0.1468 0.4506 0.4502
Brugia malayi Muscleblind-like protein 0.0174 0.0498 0.0907
Loa Loa (eye worm) hypothetical protein 0.002 0.002 0.0031
Trypanosoma brucei nucleoside transporter 1, putative 0.0308 0.0914 0.0914
Trypanosoma brucei unspecified product 0.0308 0.0914 0.0914
Loa Loa (eye worm) pyruvate kinase 0.0039 0.0079 0.0139
Giardia lamblia Tenascin-X 0.0031 0.0056 0.0036
Echinococcus granulosus equilibrative nucleoside transporter 0.1776 0.5461 0.5458
Echinococcus multilocularis regulator of G protein signaling 0.0022 0.0028 0.0022
Brugia malayi regulator of G-protein signaling egl-10 0.0022 0.0028 0.0045
Echinococcus multilocularis musashi 0.0031 0.0056 0.005
Plasmodium falciparum pyruvate kinase 0.0039 0.0079 0.7542
Trypanosoma brucei adenosine transporter 2 0.0308 0.0914 0.0914
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0053 0.0124 0.011
Echinococcus granulosus pyruvate kinase 0.0039 0.0079 0.0074
Trypanosoma cruzi DNA repair and recombination helicase protein PIF6, putative 0.3242 1 1
Onchocerca volvulus 0.0031 0.0056 0.000004247
Echinococcus multilocularis cGMP dependent protein kinase 1 0.0018 0.0016 0.001
Chlamydia trachomatis pyruvate kinase 0.0039 0.0079 1
Schistosoma mansoni gcn5proteinral control of amino-acid synthesis 5-like 2 gcnl2 0.0172 0.0491 0.0477
Schistosoma mansoni serine/threonine protein kinase 0.0018 0.0016 0.0002
Echinococcus granulosus fibrillin 1 0.0031 0.0056 0.005
Echinococcus multilocularis muscleblind protein 1 0.0174 0.0498 0.0493
Echinococcus granulosus fibrillin 2 0.0031 0.0056 0.005
Trypanosoma cruzi nucleoside transporter-like, putative 0.0308 0.0914 0.0914
Loa Loa (eye worm) runx1 0.0065 0.0159 0.0286
Echinococcus granulosus mitogen activated protein kinase 0.1412 0.4333 0.433
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0053 0.0124 0.0118
Schistosoma mansoni protein kinase 0.0321 0.0954 0.0941
Trichomonas vaginalis voltage and ligand gated potassium channel, putative 0.004 0.0083 0.0083
Trypanosoma brucei DNA repair and recombination helicase protein PIF6 0.3242 1 1
Echinococcus multilocularis gcn5proteinral control of amino acid synthesis 0.0172 0.0491 0.0485
Loa Loa (eye worm) hypothetical protein 0.0054 0.0126 0.0224
Brugia malayi Iron-sulfur cluster assembly accessory protein 0.0056 0.0133 0.0238
Echinococcus multilocularis fibrillin 2 0.0031 0.0056 0.005
Loa Loa (eye worm) PXA domain-containing protein 0.0022 0.0028 0.0045
Giardia lamblia Tenascin-37 0.0031 0.0056 0.0036
Giardia lamblia Hypothetical protein 0.1776 0.5461 0.5452
Onchocerca volvulus Equilibrative nucleoside transporter, putative homolog 0.1776 0.5461 1
Echinococcus granulosus cGMP dependent protein kinase 1 0.0018 0.0016 0.001
Leishmania major PIF1 helicase-like protein, putative,DNA repair and recombination protein, mitochondrial precursor, putative 0.3242 1 1
Entamoeba histolytica phosphofructokinase, putative 0.0127 0.0351 0.0351
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0053 0.0124 0.0118
Toxoplasma gondii nucleoside transporter protein 0.0308 0.0914 0.2091
Brugia malayi hypothetical protein 0.0022 0.0028 0.0045
Entamoeba histolytica phosphofructokinase, putative 0.0127 0.0351 0.0351
Trichomonas vaginalis equilibrative nucleoside transporter, putative 0.1776 0.5461 0.5461
Trichomonas vaginalis pyruvate kinase, putative 0.0039 0.0079 0.0079
Plasmodium falciparum pyruvate kinase 2 0.002 0.0021 0.0555
Echinococcus multilocularis G protein coupled receptor 139 0.0134 0.0373 0.0368
Echinococcus granulosus cGMP dependent protein kinase 0.0018 0.0016 0.001
Treponema pallidum diphosphate--fructose-6-phosphate 1-phosphotransferase 0.0127 0.0351 1
Echinococcus multilocularis beta adrenergic receptor kinase 0.0035 0.0068 0.0062
Schistosoma mansoni lamin 0.0031 0.0056 0.0042
Schistosoma mansoni methyl-cpg binding protein mbd 0.002 0.002 0.0006
Echinococcus granulosus pyruvate kinase 0.002 0.0021 0.0015
Leishmania major protein kinase, putative 0.0018 0.0016 0.0016
Giardia lamblia High cysteine protein 0.0031 0.0056 0.0036
Trypanosoma brucei purine nucleoside transporter 0.0308 0.0914 0.0914
Trypanosoma cruzi nucleoside transporter 1, putative 0.0308 0.0914 0.0914
Entamoeba histolytica nucleoside transporter, putative 0.0308 0.0914 0.0914
Echinococcus multilocularis integrin alpha ps 0.0214 0.062 0.0615
Trypanosoma brucei adenosine transporter 2 0.0308 0.0914 0.0914
Loa Loa (eye worm) pyruvate kinase-PB 0.0027 0.0043 0.0073
Trichomonas vaginalis teneurin and N-acetylglucosamine-1-phosphodiester alpha-N-acetylglucosaminidase, putative 0.0031 0.0056 0.0056
Echinococcus multilocularis equilibrative nucleoside transporter protein 0.1776 0.5461 0.5458
Trypanosoma brucei adenosine transporter 2, putative 0.0308 0.0914 0.0914
Brugia malayi hypothetical protein 0.0516 0.1558 0.2849
Trichomonas vaginalis phosphofructokinase, putative 0.0034 0.0065 0.0065
Trichomonas vaginalis equilibrative nucleoside transporter, putative 0.0308 0.0914 0.0914
Echinococcus granulosus integrin alpha ps 0.0214 0.062 0.0615
Plasmodium falciparum ATP-dependent 6-phosphofructokinase 0.0034 0.0065 0.5824
Giardia lamblia Pyrophosphate-fructose 6-phosphate 1-phosphotransferase alpha subunit 0.0034 0.0065 0.0044
Schistosoma mansoni flap endonuclease-1 0.0027 0.0044 0.003
Loa Loa (eye worm) flap endonuclease-1 0.003 0.0053 0.0091
Trichomonas vaginalis equilibrative nucleoside transporter, putative 0.0308 0.0914 0.0914
Loa Loa (eye worm) voltage and ligand gated potassium channel 0.0043 0.0092 0.0163
Leishmania major nucleobase transporter 0.0308 0.0914 0.0914
Leishmania major pyruvate kinase 0.0039 0.0079 0.0079
Loa Loa (eye worm) RGS-3 protein 0.0022 0.0028 0.0045
Trypanosoma cruzi mitogen activated protein kinase 2, putative 0.1412 0.4333 0.4333
Trypanosoma brucei protein kinase, putative 0.1412 0.4333 0.4333
Echinococcus multilocularis survival motor neuron protein 1 0.0276 0.0813 0.0807
Leishmania major flap endonuclease-1 (FEN-1), putative 0.003 0.0053 0.0053
Echinococcus multilocularis ATP dependent DNA helicase PIF1 0.3242 1 1
Schistosoma mansoni 6-phosphofructokinase 0.0127 0.0351 0.0338
Schistosoma mansoni integrin alpha-ps 0.0214 0.062 0.0607
Loa Loa (eye worm) hypothetical protein 0.0374 0.1117 0.2041
Echinococcus multilocularis integrin alpha ps 0.0102 0.0276 0.027
Echinococcus granulosus axis inhibition protein axin 0.0022 0.0028 0.0022
Brugia malayi 6-phosphofructokinase 0.0127 0.0351 0.0638
Loa Loa (eye worm) hypothetical protein 0.0308 0.0914 0.1669
Leishmania major hypothetical protein, conserved 0.0018 0.0014 0.0014
Trypanosoma cruzi ISWI complex protein 0.0018 0.0014 0.0014
Brugia malayi Regulator of G protein signaling domain containing protein 0.0022 0.0028 0.0045
Echinococcus granulosus integrin alpha ps 0.0102 0.0276 0.027
Brugia malayi hypothetical protein 0.0022 0.0028 0.0045
Loa Loa (eye worm) phosphofructokinase 0.0127 0.0351 0.0638
Schistosoma mansoni hypothetical protein 0.0102 0.0276 0.0262
Echinococcus multilocularis adam 0.0031 0.0056 0.005
Echinococcus multilocularis Protein lozenge 0.0065 0.0159 0.0154
Loa Loa (eye worm) pyruvate kinase 0.0039 0.0079 0.0139
Schistosoma mansoni regulator of G protein signaling 0.0022 0.0028 0.0014
Toxoplasma gondii hypothetical protein 0.0031 0.0056 0.0106
Trypanosoma brucei nucleobase/nucleoside transporter 8.1, putative 0.0308 0.0914 0.0914
Plasmodium falciparum histone acetyltransferase GCN5 0.0046 0.01 1
Schistosoma mansoni hypothetical protein 0.3242 1 1
Entamoeba histolytica hypothetical protein 0.0022 0.0028 0.0028
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.002 0.002 0.0006
Echinococcus multilocularis axis inhibition protein axin 0.0022 0.0028 0.0022
Echinococcus multilocularis mitogen activated protein kinase 3 0.1412 0.4333 0.433
Brugia malayi Integrin alpha pat-2 precursor 0.0476 0.1434 0.2622
Trypanosoma cruzi nucleobase transporter, putative 0.0308 0.0914 0.0914
Loa Loa (eye worm) AGC/GRK/GRK protein kinase 0.0035 0.0068 0.0118
Schistosoma mansoni serine/threonine protein kinase 0.0035 0.0068 0.0054
Trypanosoma brucei nucleobase/nucleoside transporter 8.1, putative 0.0308 0.0914 0.0914
Echinococcus multilocularis pyruvate kinase 0.002 0.0021 0.0015
Schistosoma mansoni serine/threonine protein kinase 0.0035 0.0068 0.0054
Loa Loa (eye worm) cytoplasmic intermediate filament protein 0.0017 0.0011 0.0014
Leishmania major mitogen activated protein kinase, putative,map kinase, putative 0.1412 0.4333 0.4333
Giardia lamblia High cysteine protein 0.0031 0.0056 0.0036
Trichomonas vaginalis conserved hypothetical protein 0.0022 0.0028 0.0028
Schistosoma mansoni lamin 0.0031 0.0056 0.0042
Loa Loa (eye worm) hypothetical protein 0.0276 0.0813 0.1483
Trichomonas vaginalis regulator of G protein signaling 5, rgs5, putative 0.0022 0.0028 0.0028
Onchocerca volvulus Equilibrative nucleoside transporter, putative homolog 0.1776 0.5461 1
Brugia malayi PXA domain containing protein 0.0022 0.0028 0.0045
Giardia lamblia Neurogenic locus notch-like protein 0.0031 0.0056 0.0036
Loa Loa (eye worm) AGC/PKG protein kinase 0.0018 0.0016 0.0023
Trypanosoma cruzi cytochrome P450, putative 0.0014 0.0003 0.0003
Brugia malayi 6-phosphofructokinase 0.0127 0.0351 0.0638
Echinococcus multilocularis lamin 0.0031 0.0056 0.005
Onchocerca volvulus 0.0516 0.1558 0.2779
Loa Loa (eye worm) DEAH box polypeptide 35 0.0036 0.007 0.0122
Plasmodium vivax 6-phosphofructokinase, putative 0.0034 0.0065 0.4888
Echinococcus granulosus Regulator of G protein signaling 20 0.0022 0.0028 0.0022
Mycobacterium leprae PROBABLE 6-PHOSPHOFRUCTOKINASE PFKA (PHOSPHOHEXOKINASE) (PHOSPHOFRUCTOKINASE) 0.0127 0.0351 1
Trichomonas vaginalis equilibrative nucleoside transporter, putative 0.0308 0.0914 0.0914
Trichomonas vaginalis conserved hypothetical protein 0.0022 0.0028 0.0028
Loa Loa (eye worm) hypothetical protein 0.0148 0.0418 0.076
Schistosoma mansoni integrin alpha-ps 0.0111 0.0303 0.029
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0053 0.0124 0.011
Echinococcus granulosus pyruvate kinase 0.002 0.0021 0.0015
Schistosoma mansoni pyruvate kinase 0.0039 0.0079 0.0065
Trypanosoma brucei flap endonuclease-1 (FEN-1), putative 0.003 0.0053 0.0053
Leishmania major inosine-guanosine transporter;with=GeneDB:LinJ36_V3.2040 0.0308 0.0914 0.0914
Brugia malayi hypothetical protein 0.0308 0.0914 0.1669
Brugia malayi regulator of G-protein signaling rgs-7 0.0022 0.0028 0.0045
Echinococcus multilocularis 6 phosphofructokinase 0.0127 0.0351 0.0346
Brugia malayi MAP kinase sur-1 0.1412 0.4333 0.7933
Trichomonas vaginalis conserved hypothetical protein 0.0022 0.0028 0.0028
Echinococcus granulosus bromodomain adjacent to zinc finger domain 0.0042 0.0089 0.0083
Loa Loa (eye worm) hypothetical protein 0.0031 0.0056 0.0097
Trypanosoma cruzi nucleoside transporter-like, putative 0.0308 0.0914 0.0914
Echinococcus multilocularis A kinase anchor protein 10, mitochondrial 0.0022 0.0028 0.0022
Onchocerca volvulus Pyruvate kinase homolog 0.0039 0.0079 0.0043
Echinococcus multilocularis mitogen activated protein kinase 0.1412 0.4333 0.433
Echinococcus granulosus histone acetyltransferase KAT2B 0.0164 0.0468 0.0462
Loa Loa (eye worm) 6-phosphofructokinase 0.0127 0.0351 0.0638
Loa Loa (eye worm) intermediate filament tail domain-containing protein 0.0031 0.0056 0.0097
Toxoplasma gondii CMGC kinase, MAPK family (ERK) MAPK-1 0.1412 0.4333 1
Echinococcus multilocularis neuropeptide receptor 0.0134 0.0373 0.0368
Echinococcus granulosus histone acetyltransferase KAT2B 0.0052 0.0121 0.0116
Plasmodium falciparum flap endonuclease 1 0.003 0.0053 0.4393
Schistosoma mansoni regulator of G protein signaling 17 19 20 (rgs17 19 20) 0.0022 0.0028 0.0014
Trichomonas vaginalis equilibrative nucleoside transporter, putative 0.1776 0.5461 0.5461
Trypanosoma cruzi DNA repair and recombination helicase protein PIF7, putative 0.3242 1 1
Echinococcus granulosus methyl CpG binding domain protein 2 0.002 0.002 0.0015
Echinococcus multilocularis atpase aaa+ type core atpase aaa type core 0.0945 0.2887 0.2883
Trichomonas vaginalis phosphofructokinase, putative 0.0034 0.0065 0.0065
Trypanosoma brucei adenosine transporter, putative 0.0308 0.0914 0.0914
Schistosoma mansoni regulator of G protein signaling 3 rgs3 0.0022 0.0028 0.0014
Trypanosoma cruzi ISWI complex protein 0.0018 0.0014 0.0014
Toxoplasma gondii 6-phosphofructokinase 0.0034 0.0065 0.0126
Plasmodium falciparum ADP-dependent DNA helicase RecQ 0.0022 0.0027 0.1254
Brugia malayi Bromodomain containing protein 0.0049 0.011 0.0196
Leishmania major ATP-dependent phosphofructokinase 0.0127 0.0351 0.0351
Brugia malayi acetyltransferase, GNAT family protein 0.0172 0.0491 0.0893
Trypanosoma cruzi nucleoside transporter 1, putative 0.0308 0.0914 0.0914
Loa Loa (eye worm) hypothetical protein 0.0082 0.0214 0.0387
Trypanosoma brucei STE group serine/threonine-protein kinase, putative 0.0017 0.0011 0.0011
Echinococcus multilocularis equilibrative nucleoside transporter 3 0.1776 0.5461 0.5458
Echinococcus multilocularis regulator of G protein signaling 7 0.0022 0.0028 0.0022
Trypanosoma cruzi pyruvate kinase 2, putative 0.0039 0.0079 0.0079
Schistosoma mansoni neuropeptide receptor 0.0134 0.0373 0.036
Echinococcus granulosus axis inhibition protein axin 0.0022 0.0028 0.0022
Trichomonas vaginalis bromodomain-containing protein, putative 0.0052 0.0121 0.0121
Echinococcus granulosus calcium activated potassium channel 0.0016 0.0007 0.0001
Echinococcus multilocularis zinc finger protein 0.0027 0.0042 0.0037
Echinococcus granulosus beta-adrenergic receptor kinase 0.0035 0.0068 0.0062
Trypanosoma brucei adenosine transporter 2, putative 0.0308 0.0914 0.0914
Trichomonas vaginalis CMGC family protein kinase 0.1412 0.4333 0.4333
Brugia malayi Bloom's syndrome protein homolog 0.0025 0.0036 0.006
Leishmania major mitogen activated protein kinase 4, putative;with=GeneDB:LmxM19.1440 0.1412 0.4333 0.4333
Echinococcus multilocularis potassium voltage gated channel subfamily H 0.0043 0.0092 0.0086
Trichomonas vaginalis phosphofructokinase, putative 0.0034 0.0065 0.0065
Entamoeba histolytica nucleoside transporter, putative 0.1776 0.5461 0.5461
Loa Loa (eye worm) bromodomain containing protein 0.0025 0.0035 0.0059
Trichomonas vaginalis phosphofructokinase, putative 0.0127 0.0351 0.0351
Entamoeba histolytica Flap nuclease, putative 0.003 0.0053 0.0053
Trypanosoma brucei nucleobase/nucleoside transporter 8.1, putative 0.0308 0.0914 0.0914
Leishmania major PIF1 helicase-like protein, putative,DNA repair and recombination protein, mitochondrial precursor, putative 0.3242 1 1
Echinococcus granulosus bromodomain adjacent to zinc finger domain 0.0074 0.0187 0.0182
Entamoeba histolytica hypothetical protein 0.0022 0.0028 0.0028
Schistosoma mansoni voltage-gated potassium channel 0.0047 0.0104 0.009
Schistosoma mansoni axis inhibition protein axin 0.0022 0.0028 0.0014
Loa Loa (eye worm) hypothetical protein 0.0516 0.1558 0.2849
Trichomonas vaginalis phosphofructokinase, putative 0.0127 0.0351 0.0351
Loa Loa (eye worm) hypothetical protein 0.0022 0.0028 0.0045
Giardia lamblia Flap structure-specific endonuclease 0.003 0.0053 0.0032
Brugia malayi Pyruvate kinase, muscle isozyme 0.0039 0.0079 0.0139
Trichomonas vaginalis equilibrative nucleoside transporter, putative 0.0308 0.0914 0.0914
Plasmodium vivax flap endonuclease 1, putative 0.003 0.0053 0.38
Echinococcus multilocularis bloom syndrome protein 0.0025 0.0036 0.003
Loa Loa (eye worm) hypothetical protein 0.0015 0.0006 0.0005
Brugia malayi EGF-like domain containing protein 0.0031 0.0056 0.0097
Giardia lamblia Tenascin-like 0.0031 0.0056 0.0036
Trypanosoma cruzi nucleoside transporter 1, putative 0.0308 0.0914 0.0914
Mycobacterium ulcerans pyruvate kinase 0.0039 0.0079 0.2185
Loa Loa (eye worm) intermediate filament protein 0.0031 0.0056 0.0097
Brugia malayi Integrin alpha cytoplasmic region family protein 0.036 0.1075 0.1964
Trypanosoma brucei unspecified product 0.0308 0.0914 0.0914
Toxoplasma gondii flap structure-specific endonuclease 1, putative 0.003 0.0053 0.0098
Loa Loa (eye worm) hypothetical protein 0.0516 0.1558 0.2849
Toxoplasma gondii histone lysine acetyltransferase GCN5-A 0.0052 0.0121 0.0257
Brugia malayi cytoplasmic intermediate filament protein 0.0017 0.0011 0.0014
Echinococcus multilocularis muscleblind protein 0.0174 0.0498 0.0493
Schistosoma mansoni regulator of G protein signaling 0.0022 0.0028 0.0014
Trichomonas vaginalis pyruvate kinase, putative 0.0039 0.0079 0.0079
Echinococcus granulosus histone lysine methyltransferase setb 0.002 0.002 0.0015
Echinococcus granulosus muscleblind protein 0.0174 0.0498 0.0493
Trypanosoma brucei adenosine transporter 2, putative 0.0308 0.0914 0.0914
Echinococcus granulosus neuropeptide receptor 0.0134 0.0373 0.0368
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0053 0.0124 0.011
Trichomonas vaginalis DNA helicase recq1, putative 0.0025 0.0036 0.0036
Leishmania major pyruvate kinase 0.0039 0.0079 0.0079
Echinococcus multilocularis regulator of G protein signaling 3 0.0022 0.0028 0.0022
Loa Loa (eye worm) hypothetical protein 0.0031 0.0056 0.0097
Toxoplasma gondii phosphofructokinase domain-containing protein 0.0034 0.0065 0.0126
Echinococcus multilocularis pyruvate kinase 0.0031 0.0054 0.0048
Loa Loa (eye worm) 6-phosphofructokinase 0.0127 0.0351 0.0638
Trypanosoma cruzi mitogen-activated protein kinase 11, putative 0.1412 0.4333 0.4333
Brugia malayi Bromodomain containing protein 0.0092 0.0242 0.0438
Brugia malayi Pyruvate kinase, M2 isozyme 0.0039 0.0079 0.0139
Brugia malayi Intermediate filament tail domain containing protein 0.0031 0.0056 0.0097
Echinococcus granulosus mitogen activated protein kinase 3 0.1412 0.4333 0.433
Trypanosoma brucei pyruvate kinase 1, putative 0.0039 0.0079 0.0079
Trichomonas vaginalis conserved hypothetical protein 0.0022 0.0028 0.0028
Schistosoma mansoni zinc finger protein 0.0027 0.0042 0.0028
Giardia lamblia Tenascin precursor 0.0031 0.0056 0.0036
Brugia malayi hypothetical protein 0.0276 0.0813 0.1483
Schistosoma mansoni z-protein (S1r protein) 0.0022 0.0028 0.0014
Entamoeba histolytica nucleoside transporter, putative 0.0308 0.0914 0.0914
Brugia malayi A-kinase anchor protein 10, precursor 0.0022 0.0028 0.0045
Trypanosoma cruzi flap endonuclease-1 (FEN-1), putative 0.003 0.0053 0.0053
Trypanosoma brucei adenosine transporter 2, putative 0.0308 0.0914 0.0914
Trichomonas vaginalis CMGC family protein kinase 0.1412 0.4333 0.4333
Schistosoma mansoni pyruvate kinase 0.0039 0.0079 0.0065
Loa Loa (eye worm) hypothetical protein 0.0045 0.0097 0.0172
Brugia malayi Integrin beta pat-3 precursor 0.0976 0.2981 0.5456
Echinococcus granulosus bloom syndrome protein 0.0025 0.0036 0.003
Brugia malayi PXA domain containing protein 0.0022 0.0028 0.0045
Trypanosoma brucei nucleobase/nucleoside transporter 8.1 0.0308 0.0914 0.0914
Loa Loa (eye worm) hypothetical protein 0.0039 0.0079 0.0139
Echinococcus multilocularis fibrillin 1 0.0031 0.0056 0.005
Schistosoma mansoni acetyl-CoA C-acetyltransferase 0.0026 0.004 0.0026
Echinococcus granulosus 6 phosphofructokinase 0.0127 0.0351 0.0346
Trichomonas vaginalis DNA helicase recq, putative 0.0025 0.0036 0.0036
Leishmania major nucleoside transporter 1, putative 0.0308 0.0914 0.0914
Onchocerca volvulus Pyruvate kinase homolog 0.0039 0.0079 0.0043
Brugia malayi EGF-like domain containing protein 0.0031 0.0056 0.0097
Brugia malayi hypothetical protein 0.1776 0.5461 1
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0053 0.0124 0.0118
Loa Loa (eye worm) hypothetical protein 0.002 0.002 0.0031
Giardia lamblia Kinase, CMGC MAPK 0.1412 0.4333 0.4321
Schistosoma mansoni survival motor neuron protein 0.0056 0.0133 0.0119
Onchocerca volvulus 0.0056 0.0133 0.0142
Loa Loa (eye worm) RecQ helicase 0.0025 0.0036 0.006
Brugia malayi Probable G protein-coupled receptor kinase F19C6.1, putative 0.0035 0.0068 0.0118
Trichomonas vaginalis 6-phosphofructokinase, putative 0.0034 0.0065 0.0065
Mycobacterium tuberculosis Probable 6-phosphofructokinase PfkA (phosphohexokinase) (phosphofructokinase) 0.0127 0.0351 1
Echinococcus multilocularis calcium activated potassium channel 0.0016 0.0007 0.0001
Loa Loa (eye worm) hypothetical protein 0.0037 0.0074 0.013
Loa Loa (eye worm) hypothetical protein 0.0027 0.0043 0.0073
Loa Loa (eye worm) kelch domain-containing protein family protein 0.0148 0.0418 0.076
Echinococcus multilocularis integrin alpha ps 0.0214 0.062 0.0615
Leishmania major protein kinase, putative 0.0018 0.0016 0.0016
Schistosoma mansoni integrin beta subunit 0.0575 0.1739 0.1727
Loa Loa (eye worm) AGC/GRK/BARK protein kinase 0.0035 0.0068 0.0118
Loa Loa (eye worm) hypothetical protein 0.0022 0.0028 0.0045
Brugia malayi Voltage-gated potassium channel, HERG (KCNH2)-related. C. elegans unc-103 ortholog 0.0043 0.0092 0.0163
Echinococcus granulosus pyruvate kinase 0.002 0.0021 0.0015
Giardia lamblia Neurogenic locus Notch protein precursor 0.0031 0.0056 0.0036
Echinococcus granulosus zinc finger protein 0.0027 0.0042 0.0037
Trichomonas vaginalis cat eye syndrome critical region protein 2, cscr2, putative 0.0052 0.0121 0.0121
Echinococcus granulosus equilibrative nucleoside transporter 3 0.1776 0.5461 0.5458
Entamoeba histolytica hypothetical protein, conserved 0.3242 1 1
Giardia lamblia Rrm3p helicase 0.3242 1 1
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0053 0.0124 0.0221
Trichomonas vaginalis CMGC family protein kinase 0.1412 0.4333 0.4333
Entamoeba histolytica phosphofructokinase, putative 0.0127 0.0351 0.0351
Echinococcus granulosus integrin alpha 3 0.0365 0.109 0.1085
Trichomonas vaginalis phosphofructokinase, putative 0.0127 0.0351 0.0351
Echinococcus granulosus lamin 0.0031 0.0056 0.005
Loa Loa (eye worm) pyruvate kinase 0.0039 0.0079 0.0139
Trypanosoma brucei adenosine transporter, putative 0.0308 0.0914 0.0914
Schistosoma mansoni hypothetical protein 0.0024 0.0033 0.0019
Echinococcus multilocularis pyruvate kinase 0.002 0.0021 0.0015
Loa Loa (eye worm) integrin alpha pat-2 0.0734 0.2233 0.4086
Trichomonas vaginalis equilibrative nucleoside transporter, putative 0.1776 0.5461 0.5461
Plasmodium vivax 6-phosphofructokinase, putative 0.0034 0.0065 0.4888
Trypanosoma cruzi ATP-dependent 6-phosphofructokinase, glycosomal 0.0127 0.0351 0.0351
Plasmodium falciparum ATP-dependent 6-phosphofructokinase 0.0034 0.0065 0.5824
Trypanosoma cruzi mitogen activated protein kinase 4, putative 0.1412 0.4333 0.4333
Loa Loa (eye worm) hypothetical protein 0.0022 0.0028 0.0045
Entamoeba histolytica DNA repair and recombination protein, putative 0.3242 1 1
Trypanosoma cruzi mitogen-activated protein kinase 11, putative 0.1412 0.4333 0.4333
Trichomonas vaginalis phosphofructokinase, putative 0.0034 0.0065 0.0065
Loa Loa (eye worm) hypothetical protein 0.0022 0.0028 0.0045
Toxoplasma gondii phosphofructokinase PFKII 0.0034 0.0065 0.0126
Toxoplasma gondii pyruvate kinase PyK1 0.0039 0.0079 0.016
Trichomonas vaginalis conserved hypothetical protein 0.0022 0.0028 0.0028
Onchocerca volvulus Pyruvate kinase homolog 0.0039 0.0079 0.0043
Plasmodium vivax pyruvate kinase, putative 0.0039 0.0079 0.6194
Echinococcus multilocularis expressed protein 0.0435 0.1307 0.1302
Schistosoma mansoni serine/threonine protein kinase 0.1412 0.4333 0.4325
Echinococcus granulosus regulator of G protein signaling 7 0.0022 0.0028 0.0022
Echinococcus multilocularis Regulator of G protein signaling 20 0.0022 0.0028 0.0022
Trypanosoma cruzi nucleobase transporter, putative 0.0308 0.0914 0.0914
Toxoplasma gondii nucleoside transporter protein 0.0308 0.0914 0.2091
Brugia malayi hypothetical protein 0.0148 0.0418 0.076
Schistosoma mansoni hypothetical protein 0.0056 0.0133 0.0119
Entamoeba histolytica pyrophosphate-dependent phosphofructokinase 0.0034 0.0065 0.0065
Loa Loa (eye worm) hypothetical protein 0.0031 0.0056 0.0097
Echinococcus granulosus intermediate filament protein 0.0031 0.0056 0.005
Schistosoma mansoni bromodomain containing protein 0.0078 0.02 0.0186
Schistosoma mansoni blooms syndrome DNA helicase 0.002 0.002 0.0006
Echinococcus multilocularis histone lysine methyltransferase setb histone lysine methyltransferase eggless 0.002 0.002 0.0015
Giardia lamblia hypothetical protein 0.0031 0.0056 0.0036
Trypanosoma cruzi cytochrome P450, putative 0.0014 0.0003 0.0003
Brugia malayi Egg laying defective protein 4 0.0018 0.0016 0.0023
Toxoplasma gondii histone lysine acetyltransferase GCN5-B 0.0052 0.0121 0.0257
Mycobacterium ulcerans 6-phosphofructokinase 0.0127 0.0351 1
Schistosoma mansoni 6-phosphofructokinase 0.0127 0.0351 0.0338
Echinococcus multilocularis flap endonuclease 1 0.003 0.0053 0.0047
Trypanosoma cruzi nucleobase transporter, putative 0.0308 0.0914 0.0914
Trypanosoma cruzi DNA repair and recombination helicase protein PIF7, putative 0.3242 1 1
Entamoeba histolytica pyruvate kinase, putative 0.0027 0.0043 0.0043
Trypanosoma brucei nucleobase/nucleoside transporter 8.1, putative 0.0308 0.0914 0.0914
Loa Loa (eye worm) PHD-finger family protein 0.0024 0.0033 0.0055
Echinococcus multilocularis methyl CpG binding domain protein 2 0.002 0.002 0.0015
Trichomonas vaginalis phosphofructokinase, putative 0.0034 0.0065 0.0065
Echinococcus granulosus pyruvate kinase 0.0039 0.0079 0.0074
Plasmodium vivax pyruvate kinase 2, putative 0.002 0.0021 0.0881
Trypanosoma brucei adenosine transporter 2, putative 0.0308 0.0914 0.0914
Loa Loa (eye worm) hypothetical protein 0.0031 0.0056 0.0097
Echinococcus granulosus potassium voltage gated channel subfamily H 0.0043 0.0092 0.0086
Leishmania major nucleoside transporter 1, putative 0.0308 0.0914 0.0914
Loa Loa (eye worm) acetyltransferase 0.0172 0.0491 0.0893
Entamoeba histolytica acetyltransferase, GNAT family 0.0046 0.01 0.01
Leishmania major nucleobase transporter 0.0308 0.0914 0.0914
Echinococcus multilocularis regulator of G protein signaling 7 0.0022 0.0028 0.0022
Echinococcus granulosus survival motor neuron protein 1 0.0276 0.0813 0.0807
Echinococcus multilocularis integrin beta 2 0.0723 0.2198 0.2193
Echinococcus multilocularis pyruvate kinase 0.002 0.0021 0.0015
Trypanosoma brucei ATP-dependent 6-phosphofructokinase, glycosomal 0.0127 0.0351 0.0351
Loa Loa (eye worm) integrin beta-2 0.0976 0.2981 0.5456
Brugia malayi EGF-like domain containing protein 0.0031 0.0056 0.0097
Toxoplasma gondii nucleoside transporter protein 0.0308 0.0914 0.2091
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.002 0.002 0.0006
Schistosoma mansoni methyl-cpg binding protein mbd 0.002 0.002 0.0006
Loa Loa (eye worm) hypothetical protein 0.0263 0.0773 0.141
Trypanosoma brucei nucleobase/nucleoside transporter 8.1, putative 0.0308 0.0914 0.0914
Loa Loa (eye worm) hypothetical protein 0.0052 0.0119 0.0212
Echinococcus multilocularis bromodomain adjacent to zinc finger domain 0.0042 0.0089 0.0083
Echinococcus granulosus integrin beta 2 0.0723 0.2198 0.2193
Trypanosoma brucei DNA repair and recombination helicase protein PIF7 0.3242 1 1
Toxoplasma gondii pyruvate kinase PyKII 0.002 0.0021 0.0024
Schistosoma mansoni pyruvate kinase 0.002 0.0021 0.0007
Schistosoma mansoni regulator of G protein signaling 0.0022 0.0028 0.0014
Loa Loa (eye worm) G protein signaling regulator EGL-10 0.0022 0.0028 0.0045
Schistosoma mansoni axis inhibition protein axin 0.0022 0.0028 0.0014
Trypanosoma brucei ISWI complex protein 0.0018 0.0014 0.0014
Loa Loa (eye worm) hypothetical protein 0.0015 0.0004 0.0001
Echinococcus granulosus fetal alzheimer antigen falz 0.0026 0.004 0.0034
Trichomonas vaginalis equilibrative nucleoside transporter, putative 0.0308 0.0914 0.0914
Echinococcus granulosus lamin dm0 0.0031 0.0056 0.005
Trichomonas vaginalis conserved hypothetical protein 0.0022 0.0028 0.0028
Trichomonas vaginalis equilibrative nucleoside transporter, putative 0.1776 0.5461 0.5461
Trypanosoma cruzi pyruvate kinase 2, putative 0.0039 0.0079 0.0079
Schistosoma mansoni lozenge 0.0065 0.0159 0.0146
Brugia malayi Kelch motif family protein 0.0148 0.0418 0.076
Plasmodium vivax histone acetyltransferase GCN5, putative 0.0052 0.0121 1
Echinococcus granulosus regulator of G protein signaling 7 0.0022 0.0028 0.0022
Loa Loa (eye worm) CMGC/MAPK/ERK1 protein kinase 0.1412 0.4333 0.7933
Echinococcus granulosus expressed protein 0.0435 0.1307 0.1302
Schistosoma mansoni regulator of G protein signaling 0.0022 0.0028 0.0014
Echinococcus multilocularis lamin dm0 0.0031 0.0056 0.005
Schistosoma mansoni voltage-gated potassium channel 0.0047 0.0104 0.009
Loa Loa (eye worm) hypothetical protein 0.0022 0.0028 0.0045
Trichomonas vaginalis phosphofructokinase, putative 0.0034 0.0065 0.0065
Trichomonas vaginalis phosphofructokinase, putative 0.0127 0.0351 0.0351
Brugia malayi Probable ATP-dependent helicase DHX35 0.0036 0.007 0.0122
Entamoeba histolytica hypothetical protein 0.0022 0.0028 0.0028
Giardia lamblia Pyruvate kinase 0.0039 0.0079 0.0059
Echinococcus granulosus flap endonuclease 1 0.003 0.0053 0.0047
Loa Loa (eye worm) hypothetical protein 0.1776 0.5461 1
Loa Loa (eye worm) hypothetical protein 0.0022 0.0028 0.0045
Echinococcus multilocularis fetal alzheimer antigen, falz 0.0026 0.004 0.0034
Echinococcus multilocularis pyruvate kinase 0.0039 0.0079 0.0074
Trichomonas vaginalis flap endonuclease-1, putative 0.003 0.0053 0.0053
Echinococcus granulosus regulator of G protein signaling 3 0.0022 0.0028 0.0022
Echinococcus granulosus adam 0.0031 0.0056 0.005
Echinococcus granulosus regulator of G protein signaling 3 0.0022 0.0028 0.0022
Loa Loa (eye worm) hypothetical protein 0.0031 0.0056 0.0097
Echinococcus multilocularis integrin alpha 3 0.0365 0.109 0.1085
Trichomonas vaginalis hypothetical protein 0.0031 0.0056 0.0056
Trypanosoma brucei mitogen activated protein kinase 4, putative 0.1412 0.4333 0.4333
Loa Loa (eye worm) hypothetical protein 0.0015 0.0004 0.0001
Trichomonas vaginalis conserved hypothetical protein 0.3242 1 1
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0053 0.0124 0.0118
Loa Loa (eye worm) hypothetical protein 0.0174 0.0498 0.0907
Brugia malayi Regulator of G protein signaling domain containing protein 0.0022 0.0028 0.0045
Trypanosoma brucei nucleobase/nucleoside transporter 8.1 0.0308 0.0914 0.0914
Brugia malayi Nucleoside transporter family protein 0.1776 0.5461 1
Toxoplasma gondii protein kinase G AGC kinase family member PKG 0.0018 0.0016 0.0013
Brugia malayi EGF-like domain containing protein 0.0031 0.0056 0.0097
Trypanosoma brucei purine nucleoside transporter 0.0308 0.0914 0.0914

Activities

Activity type Activity value Assay description Source Reference
Activity (functional) 0 % Compound was tested for antagonist activity expressed as percentage response at 10 microM, relative to maixmal orexin-A induced response against OX1 receptor; IA is Inactive ChEMBL. 11266181

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

No external resources registered for this compound

Bibliographic References

1 literature reference was collected for this gene.

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