Detailed information for compound 1133494

Basic information

Technical information
  • TDR Targets ID: 1133494
  • Name: (2S)-2-[[(2S)-2-[(ethoxy-hydroxyphosphoryl)am ino]-4-methylpentanoyl]amino]-3-(1H-indol-3-y l)propanoic acid
  • MW: 425.416 | Formula: C19H28N3O6P
  • H donors: 5 H acceptors: 5 LogP: 1.85 Rotable bonds: 12
    Rule of 5 violations (Lipinski): 1
  • SMILES: CCOP(=O)(N[C@H](C(=O)N[C@H](C(=O)O)Cc1c[nH]c2c1cccc2)CC(C)C)O
  • InChi: 1S/C19H28N3O6P/c1-4-28-29(26,27)22-16(9-12(2)3)18(23)21-17(19(24)25)10-13-11-20-15-8-6-5-7-14(13)15/h5-8,11-12,16-17,20H,4,9-10H2,1-3H3,(H,21,23)(H,24,25)(H2,22,26,27)/t16-,17-/m0/s1
  • InChiKey: BTNRHCBRXWWVAK-IRXDYDNUSA-N  


Substructure search Similarity search

Network

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Synonyms

  • (2S)-2-[[(2S)-2-[(ethoxy-hydroxy-phosphoryl)amino]-4-methyl-pentanoyl]amino]-3-(1H-indol-3-yl)propanoic acid
  • (2S)-2-[[(2S)-2-[(ethoxy-hydroxyphosphoryl)amino]-4-methyl-1-oxopentyl]amino]-3-(1H-indol-3-yl)propanoic acid
  • (2S)-2-[[(2S)-2-[(ethoxy-hydroxy-phosphoryl)amino]-4-methyl-pentanoyl]amino]-3-(1H-indol-3-yl)propionic acid

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
Echinococcus multilocularis segment polarity protein dishevelled 0.002 0.0106 0.0106
Wolbachia endosymbiont of Brugia malayi 4'-phosphopantetheinyl transferase 0.0024 0.0226 1
Echinococcus multilocularis PDZ and LIM domain protein Zasp 0.002 0.0106 0.0106
Echinococcus multilocularis pdz domain containing protein 0.002 0.0106 0.0106
Echinococcus granulosus DNA apurinic or apyrimidinic site lyase 0.002 0.011 0.011
Brugia malayi Reprolysin 0.0026 0.0266 0.0266
Giardia lamblia DINP protein human, muc B family 0.0022 0.0165 0.0063
Schistosoma mansoni amyloid beta A4 protein related 0.002 0.0106 0.0106
Mycobacterium ulcerans DNA polymerase IV 0.0043 0.0696 0.0592
Echinococcus granulosus disks large 1 0.002 0.0106 0.0106
Plasmodium falciparum holo-[acyl-carrier-protein] synthase, putative 0.0024 0.0226 0.0117
Mycobacterium ulcerans 4'-phosphopantetheinyl transferase 0.0024 0.0226 0.0117
Brugia malayi PDZ domain containing protein 0.002 0.0106 0.0106
Schistosoma mansoni sap-97 0.002 0.0106 0.0106
Trypanosoma brucei unspecified product 0.0036 0.0521 0.0477
Loa Loa (eye worm) hypothetical protein 0.0086 0.1813 0.1813
Brugia malayi interleukin-16 0.002 0.0106 0.0106
Leishmania major oxidoreductase-like protein 0.0046 0.0787 0.0684
Echinococcus granulosus L aminoadipate semialdehyde 0.0086 0.1813 0.1813
Loa Loa (eye worm) hypothetical protein 0.002 0.0106 0.0106
Echinococcus multilocularis MAGUK p55 subfamily 0.002 0.0106 0.0106
Brugia malayi gamma-syntrophin-like protein SYN2 0.002 0.0106 0.0106
Echinococcus granulosus Na:H exchange regulatory cofactor NHE RF2 0.002 0.0106 0.0106
Toxoplasma gondii flavodoxin domain-containing protein 0.0201 0.4763 1
Leishmania major NADH-dependent fumarate reductase, putative 0.0046 0.0787 0.0684
Trypanosoma brucei apurinic/apyrimidinic endonuclease, putative 0.002 0.011 0.0065
Echinococcus granulosus disks large 3 0.002 0.0106 0.0106
Brugia malayi DIX domain containing protein 0.002 0.0106 0.0106
Echinococcus granulosus SH3 and multiple ankyrin repeat domains protein 0.002 0.0106 0.0106
Trypanosoma cruzi NADH-cytochrome b5 reductase, putative 0.0046 0.0787 0.0684
Onchocerca volvulus 0.002 0.0106 0.0587
Schistosoma mansoni hypothetical protein 0.002 0.0106 0.0106
Trypanosoma cruzi DNA polymerase kappa, putative 0.0043 0.0696 0.0592
Onchocerca volvulus 0.002 0.0106 0.0587
Loa Loa (eye worm) guanylate kinase 0.002 0.0106 0.0106
Brugia malayi Shank2E 0.002 0.0106 0.0106
Brugia malayi Cytochrome b5-like Heme/Steroid binding domain containing protein 0.0046 0.0787 0.0787
Loa Loa (eye worm) 9ORF binding protein 1 0.002 0.0106 0.0106
Schistosoma mansoni cell polarity protein 0.002 0.0106 0.0106
Echinococcus granulosus PDZ and LIM domain protein Zasp 0.002 0.0106 0.0106
Brugia malayi protein kinase C-binding protein PICK1 0.002 0.0106 0.0106
Schistosoma mansoni dihydroceramide desaturase 0.0018 0.0073 0.0073
Schistosoma mansoni multiple pdz domain protein 0.002 0.0106 0.0106
Leishmania major cytochrome P450 reductase, putative 0.036 0.8818 0.8805
Echinococcus multilocularis glutamate receptor interacting protein 1 0.002 0.0106 0.0106
Echinococcus multilocularis C2 calcium dependent membrane targeting 0.002 0.0106 0.0106
Trypanosoma brucei DNA polymerase IV, putative 0.0043 0.0696 0.0653
Loa Loa (eye worm) exodeoxyribonuclease III family protein 0.002 0.011 0.011
Echinococcus granulosus disintegrin and metalloproteinase 0.0018 0.0073 0.0073
Trypanosoma brucei NADH-cytochrome b5 reductase-like protein 0.0046 0.0787 0.0745
Trypanosoma brucei NADH-cytochrome b5 reductase, putative 0.0046 0.0787 0.0745
Brugia malayi microtubule-associated serine/threonine protein kinase 2 (MAST2) 0.002 0.0106 0.0106
Trichomonas vaginalis DNA polymerase eta, putative 0.0043 0.0696 0.0592
Schistosoma mansoni aminoadipate-semialdehyde dehydrogenase 0.0086 0.1813 0.1813
Plasmodium falciparum ferredoxin--NADP reductase 0.0046 0.0787 0.0684
Echinococcus granulosus NADPH dependent diflavin oxidoreductase 1 0.0406 1 1
Echinococcus multilocularis disks large 3 0.002 0.0106 0.0106
Trypanosoma brucei DNA polymerase kappa, putative 0.0043 0.0696 0.0653
Echinococcus multilocularis Rho GTPase activating protein 21 0.002 0.0106 0.0106
Echinococcus multilocularis methionine synthase reductase 0.0251 0.6024 0.6024
Trypanosoma brucei DNA polymerase kappa, putative 0.0043 0.0696 0.0653
Echinococcus multilocularis cell polarity protein leucine rich repeat 0.002 0.0106 0.0106
Mycobacterium ulcerans formate dehydrogenase H FdhF 0.0406 1 1
Trypanosoma brucei DNA polymerase kappa, putative 0.0032 0.0431 0.0387
Trypanosoma cruzi p450 reductase, putative 0.0046 0.0787 0.0684
Echinococcus multilocularis syndecan binding protein (syntenin) 0.002 0.0106 0.0106
Echinococcus granulosus Microtubule-associated serine/threonine-protein kinase 0.002 0.0106 0.0106
Echinococcus granulosus pdz domain containing protein 0.002 0.0106 0.0106
Onchocerca volvulus 0.002 0.0106 0.0587
Echinococcus multilocularis partitioning defective 3 0.002 0.0106 0.0106
Echinococcus granulosus pdz domain containing protein 0.002 0.0106 0.0106
Schistosoma mansoni membrane associated guanylate kinase inverted related 0.002 0.0106 0.0106
Trypanosoma cruzi cytochrome P450 reductase, putative 0.0406 1 1
Trichomonas vaginalis DNA polymerase IV / kappa, putative 0.0043 0.0696 0.0592
Plasmodium falciparum S-adenosyl-L-methionine-dependent tRNA 4-demethylwyosine synthase, putative 0.0155 0.3581 0.351
Loa Loa (eye worm) cell junction protein LIN-7 0.002 0.0106 0.0106
Loa Loa (eye worm) hypothetical protein 0.002 0.0106 0.0106
Brugia malayi Protein-tyrosine phosphatase 1 0.002 0.0106 0.0106
Onchocerca volvulus 0.002 0.0106 0.0587
Leishmania major NADH-cytochrome b5 reductase, putative 0.0046 0.0787 0.0684
Schistosoma mansoni hypothetical protein 0.002 0.0106 0.0106
Mycobacterium leprae conserved hypothetical protein 0.0024 0.0226 0.5
Leishmania major hypothetical protein, conserved 0.0155 0.3581 0.351
Trichomonas vaginalis NADPH cytochrome P450, putative 0.0155 0.3581 0.351
Trypanosoma cruzi NADH-dependent fumarate reductase, putative 0.0046 0.0787 0.0684
Echinococcus multilocularis dna polymerase kappa 0.0043 0.0696 0.0696
Mycobacterium ulcerans phosphopantetheinyl transferase, PptII 0.0024 0.0226 0.0117
Trypanosoma brucei DNA polymerase kappa, putative 0.0043 0.0696 0.0653
Trypanosoma brucei NADH-cytochrome b5 reductase, putative 0.0046 0.0787 0.0745
Brugia malayi Peripheral plasma membrane protein CASK 0.002 0.0106 0.0106
Schistosoma mansoni pdz and lim domain protein 0.002 0.0106 0.0106
Schistosoma mansoni hypothetical protein 0.002 0.0106 0.0106
Loa Loa (eye worm) hypothetical protein 0.0018 0.0073 0.0073
Trypanosoma brucei NADPH-dependent diflavin oxidoreductase 1 0.0406 1 1
Trypanosoma cruzi oxidoreductase-like protein, putative 0.0046 0.0787 0.0684
Echinococcus multilocularis PDZ and LIM domain protein Zasp 0.002 0.0106 0.0106
Entamoeba histolytica type A flavoprotein, putative 0.0155 0.3581 1
Echinococcus granulosus pdz domain containing protein 0.002 0.0106 0.0106
Trypanosoma cruzi NADH-cytochrome b5 reductase, putative 0.0046 0.0787 0.0684
Plasmodium vivax hypothetical protein, conserved 0.0155 0.3581 0.351
Echinococcus granulosus myeloid:lymphoid or mixed lineage leukemia 0.002 0.0106 0.0106
Brugia malayi Ferm domain 0.002 0.0106 0.0106
Echinococcus granulosus PDZ and LIM domain protein Zasp 0.002 0.0106 0.0106
Echinococcus granulosus Blood coagulation inhibitor Disintegrin 0.0018 0.0073 0.0073
Brugia malayi RasGEF domain containing protein 0.002 0.0106 0.0106
Toxoplasma gondii 4'-phosphopantetheinyl transferase domain-containing protein 0.0024 0.0226 0.025
Schistosoma mansoni subfamily M12B unassigned peptidase (M12 family) 0.0044 0.0734 0.0734
Loa Loa (eye worm) hypothetical protein 0.002 0.0106 0.0106
Plasmodium vivax NADPH-cytochrome p450 reductase, putative 0.0406 1 1
Schistosoma mansoni lim domain 0.002 0.0106 0.0106
Schistosoma mansoni discs large 0.002 0.0106 0.0106
Treponema pallidum 4'-phosphopantetheinyl transferase 0.0024 0.0226 0.0335
Echinococcus granulosus tight junction protein ZO 3 0.002 0.0106 0.0106
Echinococcus multilocularis microtubule associated serine:threonine protein 0.002 0.0106 0.0106
Brugia malayi PDZ-domain protein scribble 0.002 0.0106 0.0106
Trypanosoma cruzi cytochrome-b5 reductase, putative 0.0046 0.0787 0.0684
Trypanosoma brucei S-adenosyl-L-methionine-dependent tRNA 4-demethylwyosine synthase, putative 0.0155 0.3581 0.3552
Trypanosoma brucei NADPH-cytochrome p450 reductase, putative 0.0406 1 1
Echinococcus multilocularis adam 0.0058 0.1082 0.1082
Echinococcus granulosus ligand of numb protein x 2 0.002 0.0106 0.0106
Echinococcus multilocularis disks large 1 0.002 0.0106 0.0106
Trypanosoma cruzi NADPH--cytochrome P450 reductase, putative 0.0155 0.3581 0.351
Echinococcus multilocularis PRKCA binding protein 0.002 0.0106 0.0106
Toxoplasma gondii ferredoxin NADP+ oxidoreductase FNR 0.0046 0.0787 0.1455
Trypanosoma cruzi NADH-dependent fumarate reductase, putative 0.0046 0.0787 0.0684
Loa Loa (eye worm) hypothetical protein 0.002 0.0106 0.0106
Echinococcus granulosus C2 calcium dependent membrane targeting 0.002 0.0106 0.0106
Schistosoma mansoni ATP-dependent RNA Helicase 0.002 0.0106 0.0106
Trypanosoma cruzi cytochrome-b5 reductase, putative 0.0046 0.0787 0.0684
Loa Loa (eye worm) diaphorase 0.0046 0.0787 0.0787
Echinococcus multilocularis 0.002 0.0106 0.0106
Mycobacterium ulcerans oxidoreductase 0.0046 0.0787 0.0684
Treponema pallidum ferredoxin-NADP(+) reductase subunit alpha 0.0046 0.0787 0.195
Loa Loa (eye worm) FAD binding domain-containing protein 0.0406 1 1
Trypanosoma cruzi NADH-dependent fumarate reductase, putative 0.0046 0.0787 0.0684
Mycobacterium ulcerans monooxygenase 0.0046 0.0787 0.0684
Schistosoma mansoni multiple pdz domain protein 0.002 0.0106 0.0106
Echinococcus multilocularis PDZ domain containing protein GIPC3 0.002 0.0106 0.0106
Brugia malayi C2 domain containing protein 0.002 0.0106 0.0106
Echinococcus granulosus membrane associated guanylate kinase ww and pdz 0.002 0.0106 0.0106
Echinococcus multilocularis neurabin 1 0.002 0.0106 0.0106
Loa Loa (eye worm) hypothetical protein 0.0032 0.0431 0.0431
Loa Loa (eye worm) hypothetical protein 0.0044 0.0734 0.0734
Schistosoma mansoni diflavin oxidoreductase 0.0201 0.4763 0.4763
Onchocerca volvulus 0.0086 0.1813 1
Echinococcus granulosus SH3 and multiple ankyrin repeat domains protein 0.002 0.0106 0.0106
Trypanosoma cruzi oxidoreductase-protein, putative 0.0046 0.0787 0.0684
Schistosoma mansoni hypothetical protein 0.002 0.0106 0.0106
Treponema pallidum flavodoxin 0.0155 0.3581 1
Echinococcus multilocularis pdz domain containing protein 0.002 0.0106 0.0106
Echinococcus multilocularis Blood coagulation inhibitor, Disintegrin 0.0018 0.0073 0.0073
Echinococcus multilocularis pdz domain containing protein 0.002 0.0106 0.0106
Leishmania major reductase, putative 0.0046 0.0787 0.0684
Brugia malayi angiogenesis inhibito 0.0026 0.0265 0.0265
Plasmodium falciparum NADH-cytochrome b5 reductase, putative 0.0046 0.0787 0.0684
Echinococcus granulosus multiple pdz domain protein 0.002 0.0106 0.0106
Trypanosoma brucei nitrate reductase, putative 0.0046 0.0787 0.0745
Schistosoma mansoni tight junction protein 0.002 0.0106 0.0106
Loa Loa (eye worm) hypothetical protein 0.002 0.0106 0.0106
Echinococcus granulosus methionine synthase reductase 0.0251 0.6024 0.6024
Echinococcus multilocularis multiple pdz domain protein 0.002 0.0106 0.0106
Echinococcus granulosus partitioning defective 3 0.002 0.0106 0.0106
Echinococcus granulosus cytochrome b5 reductase 4 0.0046 0.0787 0.0787
Trypanosoma brucei NADPH--cytochrome P450 reductase, putative 0.0406 1 1
Echinococcus multilocularis multiple pdz domain protein 0.002 0.0106 0.0106
Schistosoma mansoni pdz domain containing protein 0.002 0.0106 0.0106
Schistosoma mansoni PDZ domain protein 0.002 0.0106 0.0106
Loa Loa (eye worm) hypothetical protein 0.002 0.0106 0.0106
Schistosoma mansoni maguk P55 subfamily member 35 0.002 0.0106 0.0106
Plasmodium vivax oxidoreductase NAD-binding domain containing protein 0.0046 0.0787 0.0684
Brugia malayi Synapse defective protein 1 0.002 0.0106 0.0106
Schistosoma mansoni hypothetical protein 0.002 0.0106 0.0106
Trypanosoma brucei NADH-dependent fumarate reductase 0.0046 0.0787 0.0745
Trypanosoma brucei DNA polymerase kappa, putative 0.0043 0.0696 0.0653
Echinococcus granulosus protein lin 7 B 0.002 0.0106 0.0106
Loa Loa (eye worm) hypothetical protein 0.002 0.0106 0.0106
Loa Loa (eye worm) hypothetical protein 0.002 0.0106 0.0106
Brugia malayi Guanylate kinase family protein 0.002 0.0106 0.0106
Echinococcus multilocularis SH3 and multiple ankyrin repeat domains protein 0.002 0.0106 0.0106
Schistosoma mansoni cell polarity protein 0.002 0.0106 0.0106
Echinococcus multilocularis subfamily M12B unassigned peptidase 0.0044 0.0734 0.0734
Trypanosoma cruzi NADH-dependent fumarate reductase, putative 0.0046 0.0787 0.0684
Echinococcus multilocularis partitioning defective protein 6 0.002 0.0106 0.0106
Brugia malayi PDZ domain containing protein 0.002 0.0106 0.0106
Mycobacterium ulcerans oxygenase 0.0046 0.0787 0.0684
Trypanosoma brucei NADH-dependent fumarate reductase, putative 0.0046 0.0787 0.0745
Trypanosoma brucei DNA polymerase kappa, putative 0.0032 0.0431 0.0387
Loa Loa (eye worm) peripheral plasma membrane protein CASK 0.002 0.0106 0.0106
Entamoeba histolytica type A flavoprotein, putative 0.0155 0.3581 1
Trypanosoma brucei NADH-cytochrome b5 reductase, putative 0.0046 0.0787 0.0745
Echinococcus granulosus pdz domain containing protein 0.002 0.0106 0.0106
Trypanosoma cruzi Flavodoxin/Radical SAM superfamily/Wyosine base formation, putative 0.0155 0.3581 0.351
Mycobacterium tuberculosis Probable oxidoreductase 0.0046 0.0787 1
Echinococcus granulosus neurabin 1 0.002 0.0106 0.0106
Brugia malayi gopc protein 0.002 0.0106 0.0106
Brugia malayi hypothetical protein 0.002 0.0106 0.0106
Schistosoma mansoni cytochrome P450 reductase 0.0406 1 1
Loa Loa (eye worm) DIX domain-containing protein 0.002 0.0106 0.0106
Echinococcus multilocularis peripheral plasma membrane protein CASK 0.002 0.0106 0.0106
Brugia malayi Abnormal embryonic partitioning of cytoplasm protein 3 0.002 0.0106 0.0106
Trypanosoma cruzi NADH-cytochrome b5 reductase, putative 0.0046 0.0787 0.0684
Schistosoma mansoni ap endonuclease 0.002 0.011 0.011
Trichomonas vaginalis NADPH cytochrome P450, putative 0.0155 0.3581 0.351
Echinococcus multilocularis beta 1 syntrophin 0.002 0.0106 0.0106
Echinococcus granulosus partitioning defective 3 0.002 0.0106 0.0106
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0048 0.0833 0.0833
Echinococcus multilocularis tight junction protein ZO 3 0.002 0.0106 0.0106
Loa Loa (eye worm) hypothetical protein 0.0026 0.0265 0.0265
Trypanosoma cruzi NADH-dependent fumarate reductase, putative 0.0046 0.0787 0.0684
Schistosoma mansoni membrane associated guanylate kinase inverted related 0.002 0.0106 0.0106
Trypanosoma cruzi NADH-dependent fumarate reductase, putative 0.0046 0.0787 0.0684
Trichomonas vaginalis NADPH fad oxidoreductase, putative 0.036 0.8818 0.8805
Echinococcus granulosus NADPH cytochrome P450 reductase 0.0406 1 1
Echinococcus granulosus multiple pdz domain protein 0.002 0.0106 0.0106
Echinococcus granulosus segment polarity protein dishevelled 0.002 0.0106 0.0106
Schistosoma mansoni 5-methyl tetrahydrofolate-homocysteine methyltransferase reductase 0.0251 0.6024 0.6024
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0048 0.0833 0.0833
Giardia lamblia Nitric oxide synthase, inducible 0.036 0.8818 1
Brugia malayi Patj homolog 0.002 0.0106 0.0106
Loa Loa (eye worm) RasGEF domain-containing protein 0.002 0.0106 0.0106
Schistosoma mansoni hypothetical protein 0.002 0.0106 0.0106
Mycobacterium tuberculosis Possible oxygenase 0.0046 0.0787 1
Loa Loa (eye worm) cytochrome b5 reductase 4 0.0046 0.0787 0.0787
Schistosoma mansoni regulator of G protein signaling 3 rgs3 0.002 0.0106 0.0106
Echinococcus granulosus multiple pdz domain protein 0.002 0.0106 0.0106
Loa Loa (eye worm) hypothetical protein 0.0026 0.0265 0.0265
Echinococcus granulosus cell polarity protein 0.002 0.0106 0.0106
Trypanosoma brucei DNA polymerase kappa, putative 0.0022 0.0165 0.012
Entamoeba histolytica type A flavoprotein, putative 0.0155 0.3581 1
Loa Loa (eye worm) hypothetical protein 0.002 0.0106 0.0106
Loa Loa (eye worm) hypothetical protein 0.002 0.0106 0.0106
Brugia malayi Hypothetical 13.5 kDa protein C45G9.7 in chromosome III 0.002 0.0106 0.0106
Onchocerca volvulus 0.0046 0.0787 0.4339
Echinococcus granulosus 3'partial|membrane associated guanylate kinase ww and pdz 0.002 0.0106 0.0106
Schistosoma mansoni cell polarity protein 0.002 0.0106 0.0106
Brugia malayi Domain found in Dishevelled, Egl-10, and Pleckstrin family protein 0.002 0.0106 0.0106
Trypanosoma cruzi DNA polymerase kappa, putative 0.0043 0.0696 0.0592
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0048 0.0833 0.0833
Echinococcus multilocularis NADH cytochrome b5 reductase 3 0.0046 0.0787 0.0787
Echinococcus multilocularis multiple pdz domain protein 0.002 0.0106 0.0106
Schistosoma mansoni hypothetical protein 0.002 0.0106 0.0106
Schistosoma mansoni pdz domain containing protein 0.002 0.0106 0.0106
Trypanosoma brucei DNA polymerase kappa, putative 0.0043 0.0696 0.0653
Brugia malayi ADAMTS-like protease 0.0026 0.0265 0.0265
Trichomonas vaginalis sulfite reductase, putative 0.0406 1 1
Echinococcus multilocularis Na(+):H(+) exchange regulatory cofactor NHE RF2 0.002 0.0106 0.0106
Echinococcus multilocularis disintegrin and metalloproteinase 0.0018 0.0073 0.0073
Schistosoma mansoni cell polarity protein 0.002 0.0106 0.0106
Plasmodium vivax flavodoxin domain containing protein 0.036 0.8818 0.8805
Mycobacterium ulcerans electron transfer protein FdxB 0.0046 0.0787 0.0684
Leishmania major DNA polymerase kappa, putative 0.0022 0.0165 0.0055
Trypanosoma cruzi NADH-cytochrome b5 reductase, putative 0.0046 0.0787 0.0684
Onchocerca volvulus 0.002 0.0106 0.0587
Echinococcus granulosus PDZ and LIM domain protein Zasp 0.002 0.0106 0.0106
Mycobacterium tuberculosis Probable monooxygenase 0.0046 0.0787 1
Brugia malayi PDZ domain 0.002 0.0106 0.0106
Echinococcus multilocularis NADPH dependent diflavin oxidoreductase 1 0.0406 1 1
Trypanosoma cruzi DNA polymerase kappa, putative 0.0043 0.0696 0.0592
Echinococcus multilocularis 55 kDa erythrocyte membrane protein 0.002 0.0106 0.0106
Loa Loa (eye worm) AGC/MAST/MAST protein kinase 0.002 0.0106 0.0106
Brugia malayi hypothetical protein 0.0058 0.1082 0.1082
Schistosoma mansoni dishevelled 0.002 0.0106 0.0106
Loa Loa (eye worm) hypothetical protein 0.002 0.0106 0.0106
Entamoeba histolytica type A flavoprotein, putative 0.0155 0.3581 1
Loa Loa (eye worm) hypothetical protein 0.002 0.0106 0.0106
Schistosoma mansoni multiple pdz domain protein 0.002 0.0106 0.0106
Mycobacterium tuberculosis holo-[acyl-carrier protein] synthase AcpS (holo-ACP synthase) (CoA:APO-[ACP]pantetheinephosphotransferase) (CoA:APO-[acyl-carrie 0.0024 0.0226 0.1717
Loa Loa (eye worm) hypothetical protein 0.002 0.0106 0.0106
Brugia malayi PDZ domain 0.002 0.0106 0.0106
Schistosoma mansoni lin-7-like proteins 0.002 0.0106 0.0106
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0048 0.0833 0.0833
Leishmania major NADH-cytochrome b5 reductase, putative 0.0046 0.0787 0.0684
Echinococcus multilocularis ligand of numb protein x 2 0.002 0.0106 0.0106
Trypanosoma brucei DNA polymerase kappa, putative 0.0043 0.0696 0.0653
Loa Loa (eye worm) PDZ domain-containing protein 0.002 0.0106 0.0106
Echinococcus granulosus dna polymerase kappa 0.0043 0.0696 0.0696
Echinococcus multilocularis SH3 and multiple ankyrin repeat domains protein 0.002 0.0106 0.0106
Echinococcus multilocularis membrane associated guanylate kinase ww and pdz 0.002 0.0106 0.0106
Brugia malayi aminoadipate-semialdehyde dehydrogenase-phosphopantetheinyl transferase 0.0086 0.1813 0.1813
Giardia lamblia Flavohemoprotein lateral transfer candidate 0.0046 0.0787 0.0777
Loa Loa (eye worm) hypothetical protein 0.002 0.0106 0.0106
Schistosoma mansoni discs lost-related 0.002 0.0106 0.0106
Loa Loa (eye worm) hypothetical protein 0.002 0.0106 0.0106
Loa Loa (eye worm) hypothetical protein 0.002 0.0106 0.0106
Loa Loa (eye worm) hypothetical protein 0.0406 1 1
Echinococcus multilocularis NADPH cytochrome P450 reductase 0.0406 1 1
Loa Loa (eye worm) hypothetical protein 0.002 0.0106 0.0106
Loa Loa (eye worm) hypothetical protein 0.002 0.0106 0.0106
Trypanosoma brucei NADH-dependent fumarate reductase, putative 0.0046 0.0787 0.0745
Onchocerca volvulus 0.002 0.0106 0.0587
Brugia malayi ADAM-TS Spacer 1 family protein 0.0026 0.0265 0.0265
Leishmania major cytochrome-b5 reductase, putative 0.0046 0.0787 0.0684
Entamoeba histolytica exodeoxyribonuclease III, putative 0.002 0.011 0.0307
Trypanosoma brucei NADH-cytochrome b5 reductase, putative 0.0046 0.0787 0.0745
Echinococcus granulosus PRKCA binding protein 0.002 0.0106 0.0106
Loa Loa (eye worm) reprolysin 0.0044 0.0734 0.0734
Loa Loa (eye worm) flavodoxin family protein 0.0155 0.3581 0.3581
Mycobacterium tuberculosis Possible electron transfer protein FdxB 0.0046 0.0787 1
Schistosoma mansoni MAGUK homolog 0.002 0.0106 0.0106
Leishmania major NADPH-cytochrome p450 reductase-like protein 0.0406 1 1
Brugia malayi PX domain containing protein 0.002 0.0106 0.0106
Trypanosoma cruzi NADPH-dependent FMN/FAD containing oxidoreductase, putative 0.0406 1 1
Entamoeba histolytica type A flavoprotein, putative 0.0155 0.3581 1
Loa Loa (eye worm) protein-tyrosine phosphatase 1 0.002 0.0106 0.0106
Chlamydia trachomatis Na(+)-translocating NADH-quinone reductase subunit F 0.0046 0.0787 0.115
Loa Loa (eye worm) hypothetical protein 0.002 0.0106 0.0106
Schistosoma mansoni rab3 interacting molecule (rim)-related 0.002 0.0106 0.0106
Echinococcus granulosus Partitioning defective 3 protein B 0.002 0.0106 0.0106
Mycobacterium ulcerans flavodoxin reductase Hmp 0.0046 0.0787 0.0684
Schistosoma mansoni NADH-cytochrome B5 reductase 0.0046 0.0787 0.0787
Echinococcus granulosus SH3 and multiple ankyrin repeat domains protein 0.002 0.0106 0.0106
Echinococcus granulosus cytochrome b5 reductase 4 0.0046 0.0787 0.0787
Loa Loa (eye worm) hypothetical protein 0.002 0.0106 0.0106
Loa Loa (eye worm) hypothetical protein 0.002 0.0106 0.0106
Trichomonas vaginalis NADPH cytochrome P450, putative 0.0155 0.3581 0.351
Trypanosoma cruzi NADH-cytochrome b5 reductase, putative 0.0046 0.0787 0.0684
Echinococcus granulosus amyloid beta A4 protein 0.002 0.0106 0.0106
Loa Loa (eye worm) guanylate kinase 0.002 0.0106 0.0106
Trypanosoma brucei oxidoreductase-protein, putative 0.0046 0.0787 0.0745
Trypanosoma cruzi nitrate reductase, putative 0.0046 0.0787 0.0684
Brugia malayi polk-prov protein 0.0032 0.0431 0.0431
Onchocerca volvulus Big bang homolog 0.002 0.0106 0.0587
Echinococcus multilocularis tyrosine protein phosphatase non receptor type 0.002 0.0106 0.0106
Echinococcus multilocularis pdz domain containing protein 0.002 0.0106 0.0106
Echinococcus multilocularis glutamate receptor interacting protein 1 0.002 0.0106 0.0106
Schistosoma mansoni adam (A disintegrin and metalloprotease 0.0058 0.1082 0.1082
Leishmania major p450 reductase, putative 0.0406 1 1
Schistosoma mansoni hypothetical protein 0.002 0.0106 0.0106
Schistosoma mansoni subfamily M12B unassigned peptidase (M12 family) 0.0044 0.0734 0.0734
Loa Loa (eye worm) hypothetical protein 0.002 0.0106 0.0106
Plasmodium vivax ferredoxin--NADP reductase, putative 0.0046 0.0787 0.0684
Brugia malayi Neurabin protein 1 0.002 0.0106 0.0106
Onchocerca volvulus 0.002 0.0106 0.0587
Trypanosoma brucei NADPH--cytochrome P450 reductase, putative 0.0406 1 1
Brugia malayi PDZ domain containing protein 0.002 0.0106 0.0106
Brugia malayi hypothetical protein 0.002 0.0106 0.0106
Brugia malayi exodeoxyribonuclease III family protein 0.002 0.011 0.011
Schistosoma mansoni maguk P55 subfamily member 26 0.002 0.0106 0.0106
Brugia malayi cell junction protein LIN-7 0.002 0.0106 0.0106
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0048 0.0833 0.0833
Schistosoma mansoni afadin (af-6 protein) 0.002 0.0106 0.0106
Schistosoma mansoni sh3 and multiple ankyrin repeat domains protein 12 (shank12) 0.002 0.0106 0.0106
Schistosoma mansoni hypothetical protein 0.002 0.0106 0.0106
Onchocerca volvulus Segment polarity protein dishevelled homolog 0.002 0.0106 0.0587
Brugia malayi Disintegrin family protein 0.0018 0.0073 0.0073
Brugia malayi Partitioning defective-6 homolog alpha 0.002 0.0106 0.0106
Echinococcus granulosus MAGUK p55 subfamily 0.002 0.0106 0.0106
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0048 0.0833 0.0833
Onchocerca volvulus 0.002 0.0106 0.0587
Echinococcus multilocularis rho guanine nucleotide exchange factor 12 0.002 0.0106 0.0106
Schistosoma mansoni leucine-rich repeat protein 0.002 0.0106 0.0106
Trypanosoma cruzi DNA polymerase kappa, putative 0.0043 0.0696 0.0592
Schistosoma mansoni NADPH flavin oxidoreductase 0.0204 0.4842 0.4842
Loa Loa (eye worm) PX domain-containing protein 0.002 0.0106 0.0106
Mycobacterium tuberculosis Possible DNA-damage-inducible protein P DinP (DNA polymerase V) (pol IV 2) (DNA nucleotidyltransferase (DNA-directed)) 0.0022 0.0165 0.0809
Schistosoma mansoni MAGUK homolog 0.002 0.0106 0.0106
Loa Loa (eye worm) FAD binding domain-containing protein 0.0251 0.6024 0.6024
Echinococcus granulosus rho guanine nucleotide exchange factor 12 0.002 0.0106 0.0106
Trypanosoma cruzi cytochrome P450 reductase, putative 0.0406 1 1
Trypanosoma brucei NADH-cytochrome b5 reductase, putative 0.0046 0.0787 0.0745
Echinococcus multilocularis segment polarity protein dishevelled 0.002 0.0106 0.0106
Trypanosoma brucei DNA polymerase IV, putative 0.0036 0.0521 0.0477
Loa Loa (eye worm) hypothetical protein 0.002 0.0106 0.0106
Mycobacterium ulcerans flavodoxin oxidoreductase 0.0046 0.0787 0.0684
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0048 0.0833 0.0833
Schistosoma mansoni leucine-rich repeat protein 0.002 0.0106 0.0106
Echinococcus multilocularis DNA (apurinic or apyrimidinic site) lyase 0.002 0.011 0.011
Schistosoma mansoni protein kinase C alpha binding protein 0.002 0.0106 0.0106
Trypanosoma cruzi reductase, putative 0.0046 0.0787 0.0684
Echinococcus multilocularis L aminoadipate semialdehyde 0.0086 0.1813 0.1813
Echinococcus granulosus peripheral plasma membrane protein CASK 0.002 0.0106 0.0106
Brugia malayi 9ORF binding protein 1 0.002 0.0106 0.0106
Leishmania major NADH-cytochrome b5 reductase, putative 0.0046 0.0787 0.0684
Onchocerca volvulus 0.002 0.0106 0.0587
Loa Loa (eye worm) hypothetical protein 0.002 0.0106 0.0106
Schistosoma mansoni hypothetical protein 0.002 0.0106 0.0106
Schistosoma mansoni hypothetical protein 0.002 0.0106 0.0106
Schistosoma mansoni Patj homolog 0.002 0.0106 0.0106
Echinococcus multilocularis MAGUK p55 subfamily 0.002 0.0106 0.0106
Echinococcus multilocularis MAGUK p55 subfamily 0.002 0.0106 0.0106
Leishmania major phosphopantetheinyl transferase-like protein 0.0024 0.0226 0.0117
Echinococcus granulosus MAGUK p55 subfamily 0.002 0.0106 0.0106
Trypanosoma cruzi NADH-cytochrome b5 reductase, putative 0.0046 0.0787 0.0684
Onchocerca volvulus Arc homolog 0.002 0.0106 0.0587
Echinococcus multilocularis myeloid:lymphoid or mixed lineage leukemia 0.002 0.0106 0.0106
Echinococcus granulosus Rho GTPase activating protein 21 0.002 0.0106 0.0106
Schistosoma mansoni dishevelled 0.002 0.0106 0.0106
Mycobacterium ulcerans DNA polymerase IV 0.0043 0.0696 0.0592
Toxoplasma gondii 4'-phosphopantetheinyl transferase superfamily protein 0.0024 0.0226 0.025
Loa Loa (eye worm) hypothetical protein 0.002 0.0106 0.0106
Echinococcus multilocularis protein lin 7 B 0.002 0.0106 0.0106
Leishmania major NADH-dependent fumarate reductase-like protein 0.0046 0.0787 0.0684
Echinococcus multilocularis amyloid beta A4 protein 0.002 0.0106 0.0106
Giardia lamblia Hypothetical protein 0.036 0.8818 1
Toxoplasma gondii NADH-cytochrome b5 reductase 1, putative 0.0046 0.0787 0.1455
Trypanosoma brucei DNA polymerase IV, putative 0.0043 0.0696 0.0653
Echinococcus granulosus NADH cytochrome b5 reductase 3 0.0046 0.0787 0.0787
Chlamydia trachomatis holo [acyl-carrier protein] synthase 0.0024 0.0226 0.0202
Schistosoma mansoni membrane associated guanylate kinase inverted related 0.002 0.0106 0.0106
Trichomonas vaginalis NADPH cytochrome P450, putative 0.0155 0.3581 0.351
Echinococcus multilocularis cytochrome b5 reductase 4 0.0046 0.0787 0.0787
Echinococcus granulosus segment polarity protein dishevelled 0.002 0.0106 0.0106
Loa Loa (eye worm) syntrophin-1 0.002 0.0106 0.0106
Echinococcus multilocularis PDZ and LIM domain protein Zasp 0.002 0.0106 0.0106
Trypanosoma brucei DNA polymerase kappa, putative 0.0043 0.0696 0.0653
Schistosoma mansoni multiple pdz domain protein 0.002 0.0106 0.0106
Toxoplasma gondii flavodoxin domain-containing protein 0.0201 0.4763 1
Trypanosoma brucei NADH-dependent fumarate reductase 0.0046 0.0787 0.0745
Brugia malayi hypothetical protein 0.002 0.0106 0.0106
Echinococcus granulosus glutamate receptor interacting protein 1 0.002 0.0106 0.0106
Leishmania major cytochrome-b5 reductase, putative 0.0046 0.0787 0.0684
Trypanosoma brucei DNA polymerase kappa, putative 0.0043 0.0696 0.0653
Brugia malayi FAD binding domain containing protein 0.0251 0.6024 0.6024
Echinococcus multilocularis protein piccolo 0.002 0.0106 0.0106
Echinococcus granulosus MAGUK p55 subfamily 0.002 0.0106 0.0106
Schistosoma mansoni syntrophin 0.002 0.0106 0.0106
Brugia malayi hypothetical protein 0.002 0.0106 0.0106
Trypanosoma cruzi Flavodoxin/Radical SAM superfamily/Wyosine base formation, putative 0.0155 0.3581 0.351
Leishmania major nitrate reductase, putative 0.0046 0.0787 0.0684
Onchocerca volvulus 0.002 0.0106 0.0587
Loa Loa (eye worm) PDZ-domain-containing protein scribble 0.002 0.0106 0.0106
Brugia malayi Guanylate kinase family protein 0.002 0.0106 0.0106
Loa Loa (eye worm) hypothetical protein 0.002 0.0106 0.0106
Echinococcus granulosus subfamily M12B unassigned peptidase 0.0044 0.0734 0.0734
Schistosoma mansoni hypothetical protein 0.002 0.0106 0.0106
Brugia malayi Syntrophin-1 0.002 0.0106 0.0106
Brugia malayi diaphorase 0.0046 0.0787 0.0787
Schistosoma mansoni cytochrome B5 0.0046 0.0787 0.0787
Loa Loa (eye worm) hypothetical protein 0.002 0.0106 0.0106
Schistosoma mansoni multiple pdz domain protein 0.002 0.0106 0.0106
Echinococcus granulosus adam 0.0058 0.1082 0.1082
Loa Loa (eye worm) hypothetical protein 0.002 0.0106 0.0106
Brugia malayi flavodoxin family protein 0.0155 0.3581 0.3581
Leishmania major DNA polymerase kappa, putative,DNA polymerase IV, putative 0.0022 0.0165 0.0055
Schistosoma mansoni regulator of G protein signaling 0.002 0.0106 0.0106
Plasmodium vivax holo-[acyl-carrier-protein] synthase, putative 0.0024 0.0226 0.0117
Plasmodium falciparum nitric oxide synthase, putative 0.0406 1 1
Entamoeba histolytica hypothetical protein 0.0024 0.0226 0.0631
Loa Loa (eye worm) PAR-6 protein 0.002 0.0106 0.0106
Echinococcus multilocularis Partitioning defective 3 protein B 0.002 0.0106 0.0106
Trypanosoma brucei DNA polymerase kappa, putative 0.0043 0.0696 0.0653
Echinococcus multilocularis partitioning defective 3 0.002 0.0106 0.0106
Echinococcus granulosus membrane associated guanylate kinase, WW and PDZ 0.002 0.0106 0.0106
Trypanosoma brucei hypothetical protein, conserved 0.0024 0.0226 0.0182
Echinococcus granulosus membrane associated guanylate kinase ww and pdz 0.002 0.0106 0.0106
Trypanosoma cruzi p450 reductase, putative 0.0406 1 1
Trypanosoma brucei NADH-cytochrome b5 reductase, putative 0.0046 0.0787 0.0745
Loa Loa (eye worm) hypothetical protein 0.002 0.0106 0.0106
Echinococcus multilocularis membrane associated guanylate kinase, WW and PDZ 0.002 0.0106 0.0106
Echinococcus granulosus adam 17 protease 0.0018 0.0073 0.0073
Echinococcus granulosus beta 1 syntrophin 0.002 0.0106 0.0106
Echinococcus granulosus tyrosine protein phosphatase non receptor type 0.002 0.0106 0.0106
Brugia malayi abnormal cell lineage protein 10 (Protein lin-10), putative 0.002 0.0106 0.0106
Brugia malayi hypothetical protein 0.002 0.0106 0.0106
Brugia malayi PDZ domain containing protein 0.002 0.0106 0.0106
Echinococcus granulosus 55 kDa erythrocyte membrane protein 0.002 0.0106 0.0106
Plasmodium falciparum NADPH--cytochrome P450 reductase, putative 0.0155 0.3581 0.351
Brugia malayi hypothetical protein 0.002 0.0106 0.0106
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0048 0.0833 0.0833
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0048 0.0833 0.0833
Mycobacterium tuberculosis Hypothetical oxidoreductase 0.0046 0.0787 1
Schistosoma mansoni syntenin 0.002 0.0106 0.0106
Schistosoma mansoni ap endonuclease 0.002 0.011 0.011
Brugia malayi rho guanine nucleotide exchange factor 12 0.002 0.0106 0.0106
Loa Loa (eye worm) hypothetical protein 0.002 0.0106 0.0106
Onchocerca volvulus 0.002 0.0106 0.0587
Brugia malayi syntenin 0.002 0.0106 0.0106
Loa Loa (eye worm) gopc protein 0.002 0.0106 0.0106
Echinococcus multilocularis SH3 and multiple ankyrin repeat domains protein 0.002 0.0106 0.0106
Loa Loa (eye worm) X11 protein 0.002 0.0106 0.0106
Chlamydia trachomatis sulfite reductase 0.0251 0.6024 1
Echinococcus granulosus syndecan binding protein syntenin 0.002 0.0106 0.0106
Brugia malayi FAD binding domain containing protein 0.0406 1 1

Activities

Activity type Activity value Assay description Source Reference
IC50 (binding) = 109 uM Inhibition of endothelin converting enzyme in an RIA assay using ET-1 as substrate ChEMBL. 8421284

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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