Detailed information for compound 142860

Basic information

Technical information
  • TDR Targets ID: 142860
  • Name: [(5E,9E)-1-[hydroxy(hydroxymethyl)phosphoryl] -6,10,14-trimethylpentadeca-5,9,13-trienyl]ph osphonic acid
  • MW: 422.433 | Formula: C19H36O6P2
  • H donors: 4 H acceptors: 6 LogP: 3.03 Rotable bonds: 13
    Rule of 5 violations (Lipinski): 1
  • SMILES: OCP(=O)(C(P(=O)(O)O)CCC/C=C(/CC/C=C(/CCC=C(C)C)\C)\C)O
  • InChi: 1S/C19H36O6P2/c1-16(2)9-7-11-18(4)13-8-12-17(3)10-5-6-14-19(27(23,24)25)26(21,22)15-20/h9-10,13,19-20H,5-8,11-12,14-15H2,1-4H3,(H,21,22)(H2,23,24,25)/b17-10+,18-13+
  • InChiKey: WLNRYRXVHPIXBF-YAUBYZHOSA-N  

Network

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Synonyms

  • [(5E,9E)-1-[hydroxy(hydroxymethyl)phosphoryl]-6,10,14-trimethyl-pentadeca-5,9,13-trienyl]phosphonic acid
  • [(5E,9E)-1-[hydroxy(methylol)phosphoryl]-6,10,14-trimethyl-pentadeca-5,9,13-trienyl]phosphonic acid
  • [(5E,9E)-1-(hydroxy-(hydroxymethyl)phosphoryl)-6,10,14-trimethylpentadeca-5,9,13-trienyl]phosphonic acid
  • [(5E,9E)-1-(hydroxy-(hydroxymethyl)phosphoryl)-6,10,14-trimethyl-pentadeca-5,9,13-trienyl]phosphonic acid
  • [(5E,9E)-1-(hydroxy-methylol-phosphoryl)-6,10,14-trimethyl-pentadeca-5,9,13-trienyl]phosphonic acid

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Rattus norvegicus Squalene synthetase Starlite/ChEMBL References

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Trypanosoma congolense squalene synthase, putative Get druggable targets OG5_129470 All targets in OG5_129470
Trypanosoma congolense squalene synthase, putative Get druggable targets OG5_129470 All targets in OG5_129470
Trypanosoma brucei squalene synthase, putative Get druggable targets OG5_129470 All targets in OG5_129470
Trypanosoma cruzi squalene synthase, putative Get druggable targets OG5_129470 All targets in OG5_129470
Leishmania infantum squalene synthase, putative Get druggable targets OG5_129470 All targets in OG5_129470
Trypanosoma cruzi squalene synthase, putative Get druggable targets OG5_129470 All targets in OG5_129470
Trypanosoma brucei gambiense farnesyltransferase, putative,squalene synthase, putative Get druggable targets OG5_129470 All targets in OG5_129470
Candida albicans squalene synthase similar to S. cerevisiae ERG9 (YHR190W) involved in ergosterol biosynthesis Get druggable targets OG5_129470 All targets in OG5_129470
Leishmania mexicana farnesyltransferase, putative Get druggable targets OG5_129470 All targets in OG5_129470
Candida albicans squalene synthase similar to S. cerevisiae ERG9 (YHR190W) involved in ergosterol biosynthesis Get druggable targets OG5_129470 All targets in OG5_129470
Leishmania braziliensis squalene synthase, putative Get druggable targets OG5_129470 All targets in OG5_129470
Leishmania donovani farnesyltransferase, putative Get druggable targets OG5_129470 All targets in OG5_129470
Leishmania major squalene synthase, putative Get druggable targets OG5_129470 All targets in OG5_129470
Trypanosoma congolense squalene synthase, putative Get druggable targets OG5_129470 All targets in OG5_129470

By sequence similarity to non orthologous known druggable targets
No druggable targets predicted by sequence similarity

Obtained from network model

Ranking Plot


Putative Targets List


Species Potential target Raw Global Species
Trypanosoma cruzi hypothetical protein, conserved 0.0568 0.1967 0.5902
Mycobacterium ulcerans cytochrome P450 187A4 Cyp187A4 0.004 0.0088 0.0117
Mycobacterium ulcerans cytochrome P450 123A3 Cyp123A3 0.004 0.0088 0.0117
Plasmodium falciparum dihydrolipoyl dehydrogenase, apicoplast 0.0018 0.001 0.0005
Trichomonas vaginalis geranylgeranyl transferase type II beta subunit, putative 0.0195 0.0637 0.0811
Schistosoma mansoni geranylgeranyl transferase type I beta subunit 0.028 0.0941 0.0941
Echinococcus multilocularis dipeptidyl aminopeptidaseprotein 0.2826 1 1
Mycobacterium ulcerans protease II (oligopeptidase B), PtrB 0.0224 0.0742 0.1045
Mycobacterium tuberculosis Probable cytochrome P450 128 Cyp128 0.004 0.0088 0.0316
Entamoeba histolytica hypothetical protein, conserved 0.0224 0.0742 0.0927
Mycobacterium ulcerans long-chain fatty-acid CoA ligase 0.0023 0.0026 0.0029
Mycobacterium ulcerans cytochrome p450 150 cyp150 0.004 0.0088 0.0117
Plasmodium vivax protein prenyltransferase alpha subunit, putative 0.0568 0.1967 0.2534
Entamoeba histolytica protein farnesyltransferase beta subunit, putative 0.0195 0.0637 0.0792
Toxoplasma gondii hypothetical protein 0.0224 0.0742 0.104
Plasmodium falciparum geranylgeranyltransferase, putative 0.0079 0.0226 0.0285
Mycobacterium ulcerans long-chain-fatty-acid--CoA ligase 0.0023 0.0026 0.0029
Brugia malayi glutathione reductase 0.0053 0.0132 0.0132
Trichomonas vaginalis protein farnesyltransferase beta subunit, putative 0.0079 0.0226 0.028
Trypanosoma cruzi oligopeptidase B-like protein, putative 0.0224 0.0742 0.2208
Trichomonas vaginalis protein farnesyltransferase alpha subunit, putative 0.2192 0.7744 1
Plasmodium falciparum glutathione reductase 0.0053 0.0132 0.0163
Loa Loa (eye worm) cytochrome P450 family protein 0.008 0.0229 0.0229
Mycobacterium tuberculosis Probable cytochrome P450 144 Cyp144 0.004 0.0088 0.0316
Schistosoma mansoni protein farnesyltransferase alpha subunit 0.2192 0.7744 0.7744
Echinococcus multilocularis acylamino acid releasing enzyme 0.0224 0.0742 0.0742
Brugia malayi AMP-binding enzyme family protein 0.0023 0.0026 0.0026
Trypanosoma cruzi Lanosterol 14-alpha demethylase 0.004 0.0088 0.0236
Trypanosoma cruzi trypanothione reductase, putative 0.0053 0.0132 0.0369
Loa Loa (eye worm) glutathione reductase 0.0053 0.0132 0.0132
Mycobacterium ulcerans acyl-CoA synthetase 0.0023 0.0026 0.0029
Trichomonas vaginalis protein farnesyltransferase alpha subunit/RAB geranylgeranyl transferase alpha subunit, putative 0.2192 0.7744 1
Mycobacterium ulcerans UDP-N-acetylglucosamine 1-carboxyvinyltransferase 0.122 0.4285 0.6074
Trypanosoma brucei prolyl oligopeptidase, putative 0.0224 0.0742 0.2208
Mycobacterium tuberculosis Probable NADH dehydrogenase Ndh 0.012 0.0372 0.1364
Plasmodium falciparum thioredoxin reductase 0.0053 0.0132 0.0163
Leishmania major prolyl oligopeptidase, putative,serine peptidase clan SC, family S9A, putative 0.0224 0.0742 0.2208
Mycobacterium tuberculosis 3-phosphoshikimate 1-carboxyvinyltransferase AroA (5-enolpyruvylshikimate-3-phosphate synthase) (EPSP synthase) (EPSPS) 0.0777 0.2711 1
Entamoeba histolytica prolyl oligopeptidase family protein 0.0224 0.0742 0.0927
Mycobacterium ulcerans fatty-acid-CoA ligase 0.0023 0.0026 0.0029
Entamoeba histolytica hypothetical protein 0.0075 0.0213 0.0242
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.0166 0.0535 0.0535
Loa Loa (eye worm) hypothetical protein 0.0017 0.0006 0.0006
Mycobacterium ulcerans phytoene synthase, CrtB 0.0131 0.0409 0.0573
Plasmodium falciparum thioredoxin reductase 0.0018 0.001 0.0005
Leishmania major 4-coumarate:coa ligase-like protein 0.0023 0.0026 0.005
Mycobacterium tuberculosis Probable cytochrome P450 139 Cyp139 0.004 0.0088 0.0316
Trypanosoma cruzi dipeptidyl-peptidase 8-like serine peptidase 0.095 0.3326 1
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0075 0.0213 0.0213
Trypanosoma brucei Alpha/beta hydrolase domain-containing protein 0.0224 0.0742 0.2208
Mycobacterium ulcerans cytochrome P450 126A3 Cyp126A3 0.004 0.0088 0.0117
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0075 0.0213 0.0213
Giardia lamblia Rab geranylgeranyltransferase 0.0079 0.0226 0.028
Plasmodium falciparum protein farnesyltransferase subunit beta 0.0195 0.0637 0.0816
Plasmodium falciparum plasmepsin IV 0.0046 0.011 0.0134
Echinococcus multilocularis protein prenyltransferase alpha subunit 0.0568 0.1967 0.1967
Leishmania major 4-coumarate:coa ligase-like protein 0.0023 0.0026 0.005
Echinococcus multilocularis geranylgeranyl transferase type I beta subunit 0.028 0.0941 0.0941
Trypanosoma cruzi hypothetical protein, conserved 0.0079 0.0226 0.0652
Trypanosoma cruzi squalene synthase, putative 0.0419 0.1435 0.4298
Wolbachia endosymbiont of Brugia malayi UDP-N-acetylglucosamine 1-carboxyvinyltransferase 0.122 0.4285 1
Loa Loa (eye worm) hypothetical protein 0.0023 0.0026 0.0026
Leishmania major dipeptidyl-peptidase 8-like serine peptidase, putative,serine peptidase, Clan SC, Family S9B 0.095 0.3326 1
Loa Loa (eye worm) prolyl oligopeptidase 0.2826 1 1
Entamoeba histolytica hypothetical protein 0.0075 0.0213 0.0242
Mycobacterium tuberculosis Cytochrome P450 121 Cyp121 0.004 0.0088 0.0316
Mycobacterium ulcerans hypothetical protein 0.0023 0.0026 0.0029
Leishmania major farnesyltransferase beta subunit 0.0195 0.0637 0.1893
Trichomonas vaginalis Clan SC, family S33, methylesterase-like serine peptidase 0.0224 0.0742 0.0947
Entamoeba histolytica dipeptidyl-peptidase, putative 0.0224 0.0742 0.0927
Mycobacterium ulcerans cytochrome P450 188A3 Cyp188A3 0.004 0.0088 0.0117
Mycobacterium tuberculosis Probable phytoene synthase PhyA 0.0131 0.0409 0.1502
Loa Loa (eye worm) CYP4Cod1 0.0103 0.0313 0.0313
Trypanosoma brucei cytochrome P450, putative 0.0103 0.0313 0.0913
Loa Loa (eye worm) prenyltransferase alpha subunit repeat containing protein 0.0568 0.1967 0.1967
Trypanosoma brucei protein farnesyltransferase beta subunit 0.0195 0.0637 0.1893
Mycobacterium ulcerans dihydrolipoamide dehydrogenase, LpdB 0.0018 0.001 0.0006
Loa Loa (eye worm) prolyl oligopeptidase 0.0224 0.0742 0.0742
Loa Loa (eye worm) prenyltransferase and squalene oxidase repeat family protein 0.0195 0.0637 0.0637
Mycobacterium tuberculosis Fatty-acid-AMP ligase FadD30 (fatty-acid-AMP synthetase) (fatty-acid-AMP synthase) 0.0017 0.0006 0.0012
Onchocerca volvulus 0.0568 0.1967 0.1946
Toxoplasma gondii shikimate dehydrogenase substrate binding domain-containing protein 0.1997 0.705 1
Schistosoma mansoni 3-dehydroquinate synthase 0.0777 0.2711 0.2711
Trichomonas vaginalis protein farnesyltransferase beta subunit, putative 0.0079 0.0226 0.028
Mycobacterium ulcerans cytochrome P450 191A3 Cyp191A3 0.004 0.0088 0.0117
Leishmania major cytochrome p450-like protein 0.004 0.0088 0.0236
Entamoeba histolytica prolyl oligopeptidase family protein 0.0224 0.0742 0.0927
Loa Loa (eye worm) hypothetical protein 0.0224 0.0742 0.0742
Mycobacterium tuberculosis Probable protease II PtrBb [second part] (oligopeptidase B) 0.0224 0.0742 0.273
Echinococcus multilocularis geranylgeranyl transferase type 2 subunit alpha 0.0568 0.1967 0.1967
Entamoeba histolytica geranylgeranyl transferase beta subunit 0.028 0.0941 0.1185
Schistosoma mansoni cytochrome P450 0.004 0.0088 0.0088
Mycobacterium tuberculosis Probable cytochrome P450 130 Cyp130 0.004 0.0088 0.0316
Brugia malayi Thioredoxin reductase 0.0053 0.0132 0.0132
Echinococcus granulosus protein farnesyltransferase alpha subunit 0.2192 0.7744 0.7744
Mycobacterium ulcerans cytochrome P450 51B1 Cyp51B1 0.004 0.0088 0.0117
Trypanosoma cruzi phytoene synthase, putative 0.0131 0.0409 0.1205
Giardia lamblia Rab geranylgeranyltransferase 0.0568 0.1967 0.253
Plasmodium vivax conserved Plasmodium protein, unknown function 0.0116 0.0356 0.0453
Trypanosoma brucei trypanothione reductase 0.0053 0.0132 0.0369
Trypanosoma brucei hypothetical protein, conserved 0.0568 0.1967 0.5902
Plasmodium falciparum geranylgeranyl transferase type2 beta subunit, putative 0.0079 0.0226 0.0285
Leishmania major lanosterol 14-alpha-demethylase, putative 0.004 0.0088 0.0236
Brugia malayi Cytochrome P450 family protein 0.0103 0.0313 0.0313
Brugia malayi cytochrome P450 0.004 0.0088 0.0088
Schistosoma mansoni geranylgeranyl transferase type II beta subunit 0.0079 0.0226 0.0226
Plasmodium vivax farnesyltransferase beta subunit, putative 0.0195 0.0637 0.0816
Loa Loa (eye worm) hypothetical protein 0.0033 0.0064 0.0064
Brugia malayi prolyl oligopeptidase family protein 0.0224 0.0742 0.0742
Plasmodium falciparum dihydrolipoyl dehydrogenase, mitochondrial 0.0018 0.001 0.0005
Leishmania major 4-coumarate:coa ligase-like protein 0.0023 0.0026 0.005
Loa Loa (eye worm) hypothetical protein 0.0131 0.0409 0.0409
Mycobacterium ulcerans cytochrome P450 189A7 Cyp189A7 0.004 0.0088 0.0117
Mycobacterium tuberculosis Possible cytochrome P450 135A1 Cyp135A1 0.004 0.0088 0.0316
Schistosoma mansoni cathepsin D (A01 family) 0.0137 0.0431 0.0431
Echinococcus granulosus thioredoxin glutathione reductase 0.0053 0.0132 0.0132
Plasmodium falciparum geranylgeranyl transferase type-2 subunit alpha, putative 0.0568 0.1967 0.2534
Brugia malayi Cytochrome P450 family protein 0.008 0.0229 0.0229
Mycobacterium tuberculosis Probable cytochrome P450 137 Cyp137 0.004 0.0088 0.0316
Entamoeba histolytica Rab geranylgeranyltransferase alpha subunit, putative 0.0568 0.1967 0.2514
Mycobacterium ulcerans cytochrome P450 150A6 Cyp150A6 0.004 0.0088 0.0117
Schistosoma mansoni dihydrolipoamide dehydrogenase 0.0018 0.001 0.001
Loa Loa (eye worm) hypothetical protein 0.0063 0.017 0.017
Leishmania major squalene synthase, putative 0.0419 0.1435 0.4298
Brugia malayi Protein prenyltransferase alpha subunit repeat containing protein 0.2192 0.7744 0.7744
Echinococcus granulosus geranylgeranyl transferase type I beta subunit 0.028 0.0941 0.0941
Trypanosoma brucei prolyl endopeptidase 0.0224 0.0742 0.2208
Mycobacterium tuberculosis Probable membrane NADH dehydrogenase NdhA 0.012 0.0372 0.1364
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0049 0.0119 0.0119
Trypanosoma cruzi lanosterol synthase, putative 0.0079 0.0226 0.0652
Trichomonas vaginalis geranylgeranyl transferase type I beta subunit, putative 0.028 0.0941 0.1204
Schistosoma mansoni transcription factor LCR-F1 0.0075 0.0213 0.0213
Chlamydia trachomatis UDP-N-acetylglucosamine 1-carboxyvinyltransferase 0.122 0.4285 0.6074
Loa Loa (eye worm) hypothetical protein 0.2192 0.7744 0.7744
Mycobacterium ulcerans cytochrome P450 140A5 Cyp140A5 0.004 0.0088 0.0117
Mycobacterium tuberculosis Probable cytochrome P450 138 Cyp138 0.004 0.0088 0.0316
Loa Loa (eye worm) prenyltransferase and squalene oxidase repeat family protein 0.028 0.0941 0.0941
Toxoplasma gondii hypothetical protein 0.1624 0.5722 0.8113
Trypanosoma brucei lanosterol synthase 0.0079 0.0226 0.0652
Trypanosoma cruzi serine peptidase, clan SC, family S9A-like protein, putative 0.0224 0.0742 0.2208
Leishmania major oligopeptidase B-like protein,serine peptidase, clan SC, family S9A-like protein 0.0224 0.0742 0.2208
Plasmodium falciparum protein farnesyltransferase subunit alpha 0.2192 0.7744 1
Echinococcus multilocularis Rab geranylgeranyltransferase, beta subunit 0.0079 0.0226 0.0226
Plasmodium vivax hypothetical protein, conserved 0.0224 0.0742 0.0951
Mycobacterium leprae Conserved hypothetical protein 0.004 0.0088 0.0088
Loa Loa (eye worm) hypothetical protein 0.0017 0.0006 0.0006
Mycobacterium tuberculosis Probable cytochrome P450 141 Cyp141 0.004 0.0088 0.0316
Mycobacterium ulcerans cytochrome P450 143A4 Cyp143A4 0.004 0.0088 0.0117
Chlamydia trachomatis dihydrolipoyl dehydrogenase 0.0018 0.001 0.0006
Leishmania major protein farnesyltransferase alpha subunit, putative 0.0568 0.1967 0.5902
Echinococcus granulosus dipeptidyl aminopeptidaseprotein 0.2826 1 1
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.0166 0.0535 0.0535
Brugia malayi Calcitonin receptor-like protein seb-1 0.0049 0.0119 0.0119
Entamoeba histolytica Rab geranylgeranyltransferase beta subunit, putative 0.0079 0.0226 0.0259
Trichomonas vaginalis type I geranylgeranyltransferase beta subunit, putative 0.0195 0.0637 0.0811
Mycobacterium leprae DIHYDROLIPOAMIDE DEHYDROGENASE LPD (LIPOAMIDE REDUCTASE (NADH)) (LIPOYL DEHYDROGENASE) (DIHYDROLIPOYL DEHYDROGENASE) (DIAPHORASE 0.0133 0.042 0.056
Mycobacterium ulcerans acyl-CoA synthetase 0.0023 0.0026 0.0029
Schistosoma mansoni prolyl oligopeptidase (S09 family) 0.0224 0.0742 0.0742
Schistosoma mansoni dipeptidyl-peptidase 9 (S09 family) 0.095 0.3326 0.3326
Leishmania major cytochrome p450-like protein 0.004 0.0088 0.0236
Loa Loa (eye worm) hypothetical protein 0.0023 0.0026 0.0026
Loa Loa (eye worm) hypothetical protein 0.0017 0.0006 0.0006
Trypanosoma cruzi protein farnesyltransferase alpha subunit, putative 0.0568 0.1967 0.5902
Mycobacterium tuberculosis Probable soluble pyridine nucleotide transhydrogenase SthA (STH) (NAD(P)(+) transhydrogenase [B-specific]) (nicotinamide nucleot 0.0018 0.001 0.0027
Trypanosoma brucei Protein prenyltransferase alpha subunit repeat, putative 0.0568 0.1967 0.5902
Schistosoma mansoni hypothetical protein 0.0131 0.0409 0.0409
Toxoplasma gondii Rab geranylgeranyl transferase type II beta subunit, putative 0.0079 0.0226 0.0307
Mycobacterium tuberculosis Probable cytochrome P450 136 Cyp136 0.004 0.0088 0.0316
Mycobacterium ulcerans long-chain-fatty-acid-CoA ligase 0.0023 0.0026 0.0029
Mycobacterium tuberculosis Possible cytochrome P450 135B1 Cyp135B1 0.004 0.0088 0.0316
Echinococcus multilocularis thioredoxin glutathione reductase 0.0053 0.0132 0.0132
Echinococcus multilocularis protein farnesyltransferase subunit beta 0.0195 0.0637 0.0637
Mycobacterium ulcerans cytochrome P450 144A4 Cyp144A4 0.004 0.0088 0.0117
Mycobacterium tuberculosis Probable cytochrome P450 123 Cyp123 0.004 0.0088 0.0316
Plasmodium falciparum plasmepsin VI 0.0046 0.011 0.0134
Chlamydia trachomatis dehyroquinate synthase 0.0777 0.2711 0.384
Mycobacterium leprae PROBABLE PROTEASE II PTRBB (OLIGOPEPTIDASE B) 0.0224 0.0742 0.1019
Toxoplasma gondii prolyl endopeptidase 0.0224 0.0742 0.104
Brugia malayi Prenyltransferase and squalene oxidase repeat family protein 0.028 0.0941 0.0941
Echinococcus multilocularis prolyl endopeptidase 0.0224 0.0742 0.0742
Giardia lamblia Rab geranylgeranyltransferase 0.2192 0.7744 1
Loa Loa (eye worm) hypothetical protein 0.0017 0.0006 0.0006
Giardia lamblia Alanyl dipeptidyl peptidase 0.0224 0.0742 0.0947
Mycobacterium ulcerans cytochrome P450 124A1, Cyp124A1 0.004 0.0088 0.0117
Trypanosoma brucei Dipeptidyl-peptidase 8-like, putative 0.095 0.3326 1
Plasmodium falciparum plasmepsin I 0.0046 0.011 0.0134
Brugia malayi hypothetical protein 0.0726 0.2529 0.2529
Plasmodium falciparum peptidase, putative 0.0224 0.0742 0.0951
Trichomonas vaginalis geranylgeranyl transferase type I beta subunit, putative 0.0195 0.0637 0.0811
Mycobacterium tuberculosis Probable cytochrome P450 143 Cyp143 0.004 0.0088 0.0316
Leishmania major trypanothione reductase 0.0053 0.0132 0.0369
Loa Loa (eye worm) cytochrome P450 0.004 0.0088 0.0088
Mycobacterium tuberculosis Probable reductase 0.012 0.0372 0.1364
Trypanosoma cruzi protein farnesyltransferase alpha subunit, putative 0.0568 0.1967 0.5902
Mycobacterium tuberculosis Probable cytochrome P450 140 Cyp140 0.004 0.0088 0.0316
Mycobacterium leprae 3-dehydroquinate synthase AroB 0.0777 0.2711 0.3822
Plasmodium falciparum glutathione reductase 0.0018 0.001 0.0005
Loa Loa (eye worm) aspartic protease BmAsp-2 0.0046 0.011 0.011
Plasmodium vivax geranylgeranyltransferase, putative 0.0079 0.0226 0.0285
Giardia lamblia Alanyl dipeptidyl peptidase 0.0224 0.0742 0.0947
Schistosoma mansoni prolyl oligopeptidase (S09 family) 0.0224 0.0742 0.0742
Toxoplasma gondii dipeptidyl peptidase iv (dpp iv) n-terminal region domain-containing protein 0.095 0.3326 0.4709
Trypanosoma cruzi hypothetical protein, conserved 0.0224 0.0742 0.2208
Echinococcus granulosus Dipeptidyl peptidase 9 0.095 0.3326 0.3326
Echinococcus granulosus Squalene phytoene synthase 0.0131 0.0409 0.0409
Mycobacterium tuberculosis Probable dehydrogenase 0.012 0.0372 0.1364
Trypanosoma brucei protein farnesyltransferase alpha subunit, putative 0.0568 0.1967 0.5902
Plasmodium vivax dihydrolipoyl dehydrogenase, apicoplast, putative 0.0018 0.001 0.0005
Loa Loa (eye worm) prenyltransferase alpha subunit repeat containing protein 0.2192 0.7744 0.7744
Trypanosoma cruzi hypothetical protein, conserved 0.0079 0.0226 0.0652
Toxoplasma gondii aspartyl protease ASP1 0.0046 0.011 0.0142
Echinococcus multilocularis Squalene phytoene synthase 0.0131 0.0409 0.0409
Mycobacterium tuberculosis Probable cytochrome P450 124 Cyp124 0.004 0.0088 0.0316
Entamoeba histolytica hypothetical protein 0.0075 0.0213 0.0242
Plasmodium vivax plasmepsin IV, putative 0.0046 0.011 0.0134
Treponema pallidum UDP-N-acetylglucosamine 1-carboxyvinyltransferase 0.122 0.4285 1
Mycobacterium tuberculosis 3-dehydroquinate synthase AroB 0.0777 0.2711 1
Brugia malayi AMP-binding enzyme family protein 0.0023 0.0026 0.0026
Toxoplasma gondii acylaminoacyl-peptidase, putative 0.0224 0.0742 0.104
Trypanosoma brucei squalene synthase, putative 0.0419 0.1435 0.4298
Echinococcus multilocularis Dipeptidyl peptidase 9 0.095 0.3326 0.3326
Leishmania major cytochrome p450-like protein 0.0103 0.0313 0.0913
Echinococcus granulosus geranylgeranyl transferase type 2 subunit alpha 0.0568 0.1967 0.1967
Leishmania major hypothetical protein, conserved 0.0131 0.0409 0.1205
Trypanosoma brucei geranylgeranyl transferase type II beta subunit, putative 0.0079 0.0226 0.0652
Trypanosoma brucei oligopeptidase b 0.0224 0.0742 0.2208
Mycobacterium ulcerans cytochrome P450 143A3 Cyp143A3 0.004 0.0088 0.0117
Echinococcus multilocularis 0.004 0.0088 0.0088
Leishmania major oligopeptidase b 0.0224 0.0742 0.2208
Loa Loa (eye worm) hypothetical protein 0.0726 0.2529 0.2529
Trypanosoma cruzi cytochrome p450-like protein, putative 0.004 0.0088 0.0236
Trypanosoma brucei Lanosterol 14-alpha demethylase 0.004 0.0088 0.0236
Brugia malayi Prenyltransferase and squalene oxidase repeat family protein 0.0195 0.0637 0.0637
Plasmodium vivax prenyltransferase alpha subunit, putative 0.2192 0.7744 1
Leishmania major geranylgeranyltransferase, putative 0.0079 0.0226 0.0652
Echinococcus multilocularis dihydrolipoamide dehydrogenase 0.0018 0.001 0.001
Mycobacterium tuberculosis Dihydrolipoamide dehydrogenase LpdC (lipoamide reductase (NADH)) (lipoyl dehydrogenase) (dihydrolipoyl dehydrogenase) (diaphoras 0.0133 0.042 0.154
Plasmodium vivax dihydrolipoyl dehydrogenase, mitochondrial, putative 0.0018 0.001 0.0005
Echinococcus granulosus acylamino acid releasing enzyme 0.0224 0.0742 0.0742
Trypanosoma brucei serine peptidase, clan SC, family S9A-like protein 0.0224 0.0742 0.2208
Mycobacterium ulcerans 3-dehydroquinate synthase 0.0777 0.2711 0.384
Trichomonas vaginalis geranylgeranyl transferase type II beta subunit, putative 0.0195 0.0637 0.0811
Schistosoma mansoni geranylgeranyl transferase type I beta subunit 0.028 0.0941 0.0941
Schistosoma mansoni protein farnesyltransferase subunit beta 0.0195 0.0637 0.0637
Plasmodium vivax aspartyl proteinase, putative 0.0046 0.011 0.0134
Mycobacterium tuberculosis Putative ferredoxin reductase 0.012 0.0372 0.1364
Chlamydia trachomatis phosphoshikimate 1-carboxyl vinyltransferase 0.1997 0.705 1
Trypanosoma cruzi Lanosterol 14-alpha demethylase 0.004 0.0088 0.0236
Toxoplasma gondii aspartyl proteinase (eimepsin), putative 0.0046 0.011 0.0142
Trypanosoma cruzi hypothetical protein, conserved 0.0568 0.1967 0.5902
Mycobacterium tuberculosis Probable chain -fatty-acid-CoA ligase FadD13 (fatty-acyl-CoA synthetase) 0.0023 0.0026 0.0088
Brugia malayi Cytochrome P450 family protein 0.0103 0.0313 0.0313
Loa Loa (eye worm) hypothetical protein 0.0046 0.011 0.011
Trypanosoma cruzi geranylgeranyl transferase type II beta subunit, putative 0.0079 0.0226 0.0652
Mycobacterium ulcerans cytochrome P450 185A4 Cyp185A4 0.0103 0.0313 0.0436
Trichomonas vaginalis protein farnesyltransferase alpha subunit/RAB geranylgeranyl transferase alpha subunit, putative 0.1624 0.5722 0.7386
Mycobacterium tuberculosis Probable nitrite reductase [NAD(P)H] large subunit [FAD flavoprotein] NirB 0.012 0.0372 0.1364
Echinococcus granulosus cathepsin d lysosomal aspartyl protease 0.0046 0.011 0.011
Toxoplasma gondii thioredoxin reductase 0.0053 0.0132 0.0174
Mycobacterium ulcerans cytochrome P450 125A7 Cyp125A7 0.004 0.0088 0.0117
Brugia malayi hypothetical protein 0.0075 0.0213 0.0213
Trypanosoma cruzi hypothetical protein, conserved 0.0224 0.0742 0.2208
Trichomonas vaginalis protein farnesyltransferase alpha subunit, putative 0.0568 0.1967 0.253
Mycobacterium leprae probable 3-phosphoshikimate 1-carboxyvinyl transferase AroA (5-ENOLPYRUVYLSHIKIMATE-3-PHOSPHATE SYNTHASE) (EPSP SYNTHASE) (EPSPS 0.1997 0.705 1
Echinococcus granulosus prolyl endopeptidase 0.0224 0.0742 0.0742
Mycobacterium leprae putative cytochrome p450 0.004 0.0088 0.0088
Trypanosoma cruzi oligopeptidase b 0.0224 0.0742 0.2208
Brugia malayi prolyl oligopeptidase family protein 0.0224 0.0742 0.0742
Loa Loa (eye worm) hypothetical protein 0.0224 0.0742 0.0742
Trichomonas vaginalis Clan AA, family A1, cathepsin D-like aspartic peptidase 0.0046 0.011 0.0129
Mycobacterium tuberculosis Probable oxidoreductase 0.0133 0.042 0.154
Mycobacterium tuberculosis Probable cytochrome P450 125 Cyp125 0.004 0.0088 0.0316
Mycobacterium ulcerans cytochrome P450 105Q4 Cyp105Q4 0.004 0.0088 0.0117
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0199 0.0654 0.0654
Trichomonas vaginalis Clan SC, family S9, acylaminoacyl-peptidase-like serine peptidase 0.0224 0.0742 0.0947
Loa Loa (eye worm) hypothetical protein 0.0017 0.0006 0.0006
Loa Loa (eye worm) hypothetical protein 0.0199 0.0654 0.0654
Onchocerca volvulus NADH dehydrogenase (ubiquinone) complex I, assembly factor 6 homolog 0.0131 0.0409 0.0384
Entamoeba histolytica protein farnesyltransferase alpha subunit, putative 0.2192 0.7744 1
Mycobacterium tuberculosis Cytochrome P450 51 Cyp51 (CYPL1) (P450-L1A1) (sterol 14-alpha demethylase) (lanosterol 14-alpha demethylase) (P450-14DM) 0.004 0.0088 0.0316
Plasmodium vivax thioredoxin reductase, putative 0.0053 0.0132 0.0163
Schistosoma mansoni hypothetical protein 0.0033 0.0064 0.0064
Trichomonas vaginalis geranylgeranyl transferase type II beta subunit, putative 0.0195 0.0637 0.0811
Toxoplasma gondii prenyltransferase and squalene oxidase repeat-containing protein 0.0195 0.0637 0.0891
Trypanosoma cruzi prolyl endopeptidase 0.0224 0.0742 0.2208
Trypanosoma cruzi cytochrome P450, putative 0.0103 0.0313 0.0913
Loa Loa (eye worm) hypothetical protein 0.0079 0.0226 0.0226
Mycobacterium tuberculosis Probable peptidase 0.0224 0.0742 0.273
Schistosoma mansoni rab geranylgeranyl transferase alpha subunit 0.0568 0.1967 0.1967
Mycobacterium leprae PROBABLE NADH DEHYDROGENASE NDH 0.012 0.0372 0.0492
Echinococcus multilocularis protein farnesyltransferase alpha subunit 0.2192 0.7744 0.7744
Brugia malayi prolyl oligopeptidase family protein 0.0224 0.0742 0.0742
Trypanosoma cruzi oligopeptidase b 0.0224 0.0742 0.2208
Brugia malayi Probable protein farnesyltransferase beta subunit, putative 0.0079 0.0226 0.0226
Schistosoma mansoni hypothetical protein 0.0075 0.0213 0.0213
Schistosoma mansoni acylaminoacyl-peptidase (S09 family) 0.0224 0.0742 0.0742
Loa Loa (eye worm) thioredoxin reductase 0.0053 0.0132 0.0132
Toxoplasma gondii prenyltransferase and squalene oxidase repeat-containing protein 0.0079 0.0226 0.0307
Brugia malayi prolyl oligopeptidase family protein 0.095 0.3326 0.3326
Trichomonas vaginalis geranylgeranyl transferase type beta subunit, putative 0.0195 0.0637 0.0811
Echinococcus multilocularis cathepsin d (lysosomal aspartyl protease) 0.0046 0.011 0.011
Mycobacterium ulcerans cytochrome P450 108B4 Cyp108B4 0.004 0.0088 0.0117
Onchocerca volvulus Dipeptidyl peptidase family member 1 homolog 0.2826 1 1
Trypanosoma cruzi cytochrome P450, putative 0.0103 0.0313 0.0913
Schistosoma mansoni prolyl oligopeptidase (S09 family) 0.0224 0.0742 0.0742
Brugia malayi Protein prenyltransferase alpha subunit repeat containing protein 0.0568 0.1967 0.1967
Mycobacterium tuberculosis NADPH-dependent mycothiol reductase Mtr 0.0053 0.0132 0.0479
Trypanosoma cruzi Protein prenyltransferase alpha subunit repeat, putative 0.0568 0.1967 0.5902
Trypanosoma cruzi serine peptidase, Clan SC, Family S9B 0.095 0.3326 1
Giardia lamblia Prenyltransferase 0.0195 0.0637 0.0811
Mycobacterium tuberculosis Possible cytochrome P450 126 Cyp126 0.004 0.0088 0.0316
Loa Loa (eye worm) cytochrome P450 family protein 0.0103 0.0313 0.0313
Echinococcus granulosus protein prenyltransferase alpha subunit 0.0568 0.1967 0.1967
Loa Loa (eye worm) hypothetical protein 0.0079 0.0226 0.0226
Mycobacterium tuberculosis Halimadienyl diphosphate synthase 0.0079 0.0226 0.0825
Plasmodium falciparum plasmepsin II 0.0046 0.011 0.0134
Schistosoma mansoni cathepsin D (A01 family) 0.0137 0.0431 0.0431
Loa Loa (eye worm) hypothetical protein 0.0023 0.0026 0.0026
Loa Loa (eye worm) cytochrome P450 family protein 0.0103 0.0313 0.0313
Trypanosoma cruzi lanosterol synthase, putative 0.0079 0.0226 0.0652
Toxoplasma gondii hypothetical protein 0.0568 0.1967 0.278
Entamoeba histolytica hypothetical protein 0.0075 0.0213 0.0242
Schistosoma mansoni hypothetical protein 0.004 0.0088 0.0088
Brugia malayi Cytochrome P450 family protein 0.004 0.0088 0.0088
Mycobacterium ulcerans cytochrome P450 187A5 Cyp187A5 0.004 0.0088 0.0117
Mycobacterium tuberculosis NAD(P)H quinone reductase LpdA 0.0133 0.042 0.154
Onchocerca volvulus Prolyl endopeptidase homolog 0.0224 0.0742 0.0717
Schistosoma mansoni subfamily S9B unassigned peptidase (S09 family) 0.2826 1 1
Mycobacterium ulcerans 3-phosphoshikimate 1-carboxyvinyltransferase 0.1997 0.705 1
Entamoeba histolytica dipeptidyl-peptidase, putative 0.0224 0.0742 0.0927
Brugia malayi dihydrolipoyl dehydrogenase, mitochondrial precursor, putative 0.0018 0.001 0.001
Mycobacterium ulcerans cytochrome P450 142A3 Cyp142A3 0.004 0.0088 0.0117
Mycobacterium tuberculosis Probable cytochrome P450 monooxygenase 142 Cyp142 0.004 0.0088 0.0316
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD2 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0023 0.0026 0.0088
Trypanosoma cruzi squalene synthase, putative 0.0419 0.1435 0.4298
Trypanosoma brucei serine peptidase, Clan SC, Family S9B 0.095 0.3326 1
Trichomonas vaginalis conserved hypothetical protein 0.0224 0.0742 0.0947
Mycobacterium tuberculosis Probable cytochrome P450 132 Cyp132 0.004 0.0088 0.0316
Trypanosoma cruzi protein farnesyltransferase, putative 0.0195 0.0637 0.1893
Echinococcus granulosus protein farnesyltransferase subunit beta 0.0195 0.0637 0.0637
Trypanosoma cruzi protein farnesyltransferase, putative 0.0195 0.0637 0.1893
Schistosoma mansoni subfamily A1A unassigned peptidase (A01 family) 0.0046 0.011 0.011
Mycobacterium ulcerans cytochrome P450 136A2 Cyp136A2 0.004 0.0088 0.0117
Mycobacterium ulcerans acyl-CoA synthetase 0.0023 0.0026 0.0029
Toxoplasma gondii cytochrome p450 superfamily protein 0.004 0.0088 0.0111
Loa Loa (eye worm) hypothetical protein 0.0224 0.0742 0.0742
Brugia malayi latrophilin 2 splice variant baaae 0.0033 0.0064 0.0064
Mycobacterium ulcerans dihydrolipoamide dehydrogenase 0.0018 0.001 0.0006
Mycobacterium ulcerans flavoprotein disulfide reductase 0.0018 0.001 0.0006
Trypanosoma brucei Protein prenyltransferase alpha subunit repeat, putative 0.0568 0.1967 0.5902
Echinococcus granulosus cytochrome P450 2K1 0.004 0.0088 0.0088
Plasmodium vivax geranylgeranyl transferase type2 beta subunit, putative 0.0079 0.0226 0.0285
Echinococcus granulosus dihydrolipoamide dehydrogenase 0.0018 0.001 0.001
Plasmodium vivax glutathione reductase, putative 0.0053 0.0132 0.0163
Brugia malayi AMP-binding enzyme family protein 0.0023 0.0026 0.0026
Trichomonas vaginalis protein farnesyltransferase alpha subunit, putative 0.2192 0.7744 1
Entamoeba histolytica prolyl oligopeptidase family protein 0.0224 0.0742 0.0927

Activities

Activity type Activity value Assay description Source Reference
IC50 (binding) = 4.7 nM Inhibition rat liver microsomal squalene synthase ChEMBL. 7629799
IC50 (binding) = 4.7 nM Inhibition rat liver microsomal squalene synthase ChEMBL. 7629799

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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