Detailed information for compound 42046

Basic information

Technical information
  • TDR Targets ID: 42046
  • Name: 4-[4-(hexadecylamino)phenyl]-4-oxobutanoic ac id
  • MW: 417.625 | Formula: C26H43NO3
  • H donors: 2 H acceptors: 3 LogP: 8.77 Rotable bonds: 20
    Rule of 5 violations (Lipinski): 1
  • SMILES: CCCCCCCCCCCCCCCCNc1ccc(cc1)C(=O)CCC(=O)O
  • InChi: 1S/C26H43NO3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-22-27-24-18-16-23(17-19-24)25(28)20-21-26(29)30/h16-19,27H,2-15,20-22H2,1H3,(H,29,30)
  • InChiKey: MDNGVVLXKKWWOG-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • 4-[4-(hexadecylamino)phenyl]-4-oxo-butanoic acid
  • 4-[4-(cetylamino)phenyl]-4-keto-butyric 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
Leishmania major nucleoside phosphorylase-like protein 0.0194 0.121 0.1553
Toxoplasma gondii hypothetical protein 0.0039 0.0079 0.0277
Echinococcus granulosus histone lysine n methyltransferase setb1 0.0034 0.0045 0.0048
Loa Loa (eye worm) hypothetical protein 0.006 0.0236 0.0249
Plasmodium falciparum histone-lysine N-methyltransferase, putative 0.0084 0.0405 0.051
Loa Loa (eye worm) PHD-finger family protein 0.003 0.001 0.0003
Echinococcus multilocularis histone lysine N methyltransferase, H3 lysine 36 0.0051 0.0166 0.0204
Trypanosoma brucei methylthioadenosine phosphorylase, putative 0.1047 0.7444 0.96
Trypanosoma brucei S-adenosylmethionine decarboxylase 0.0668 0.4677 0.6028
Onchocerca volvulus 0.0367 0.2478 0.247
Echinococcus granulosus protein arginine methyltransferase 0.0031 0.0022 0.0018
Brugia malayi PHD-finger family protein 0.003 0.001 0.0003
Leishmania major methylthioadenosine phosphorylase, putative 0.1047 0.7444 0.96
Treponema pallidum uridine phosphorylase (udp) 0.0194 0.121 0.5
Echinococcus multilocularis protein arginine methyltransferase 0.0031 0.0022 0.0018
Echinococcus granulosus purine nucleoside phosphorylase 0.0194 0.121 0.1553
Plasmodium falciparum spermidine synthase 0.1089 0.7753 1
Echinococcus multilocularis histone lysine N methyltransferase SETMAR 0.0129 0.0738 0.0943
Treponema pallidum pfs protein (pfs) 0.0194 0.121 0.5
Loa Loa (eye worm) pre-SET domain-containing protein family protein 0.1279 0.9143 1
Loa Loa (eye worm) jmjC domain-containing protein 0.0061 0.0241 0.0255
Trypanosoma cruzi S-adenosylhomocysteine hydrolase, putative 0.0382 0.2584 0.3325
Echinococcus multilocularis histone lysine N methyltransferase E(z) 0.0202 0.1268 0.1627
Loa Loa (eye worm) hypothetical protein 0.0113 0.0617 0.0666
Trypanosoma cruzi hypothetical protein, conserved 0.0039 0.0079 0.0092
Mycobacterium ulcerans 5'-methylthioadenosine phosphorylase 0.1047 0.7444 1
Brugia malayi Bromodomain containing protein 0.003 0.001 0.0003
Brugia malayi Histone-lysine N-methyltransferase, H3 lysine-79 specific 0.0256 0.1664 0.1813
Mycobacterium leprae putative S-adenosyl-L-homocysteine hydrolase SahH 0.0382 0.2584 1
Loa Loa (eye worm) hypothetical protein 0.0367 0.2478 0.2703
Echinococcus granulosus 5'partial|histone lysine N methyltransferase SETDB2 0.0152 0.0902 0.1155
Trichomonas vaginalis conserved hypothetical protein 0.0194 0.121 0.1204
Trichomonas vaginalis adenosylhomocysteinase, putative 0.012 0.067 0.0662
Chlamydia trachomatis AMP nucleosidase 0.0194 0.121 0.5
Loa Loa (eye worm) PWWP domain-containing protein 0.0039 0.0079 0.0078
Leishmania major hypothetical protein, conserved 0.0032 0.0032 0.0031
Schistosoma mansoni enhancer of zeste ezh 0.0202 0.1268 0.1703
Giardia lamblia 5-methylthioadenosine nucleosidase, S-adenosylhomocysteine nucleosidase 0.0194 0.121 1
Schistosoma mansoni jumonji domain containing protein 0.0077 0.0357 0.0479
Onchocerca volvulus Purine nucleoside phosphorylase homolog 0.0194 0.121 0.1201
Entamoeba histolytica MTA/SAH nucleosidase, putative 0.0194 0.121 0.4669
Plasmodium vivax DNA (cytosine-5)-methyltransferase, putative 0.0201 0.1266 0.1622
Echinococcus granulosus peregrin 0.0069 0.0295 0.0371
Brugia malayi Adenosylhomocysteinase 0.0382 0.2584 0.282
Trichomonas vaginalis adenosylhomocysteinase, putative 0.0382 0.2584 0.2578
Echinococcus granulosus cpg binding protein 0.0167 0.1013 0.1297
Giardia lamblia UPL-1 0.0194 0.121 1
Echinococcus multilocularis histone h3 methyltransferase 0.0256 0.1664 0.2139
Plasmodium falciparum protein arginine N-methyltransferase 1 0.0031 0.0022 0.0015
Loa Loa (eye worm) jmjC domain-containing protein 0.0037 0.0068 0.0066
Trypanosoma cruzi histone-lysine N-methyltransferase, putative 0.0032 0.0032 0.0031
Trypanosoma brucei spermidine synthase 0.1089 0.7753 1
Trypanosoma cruzi S-adenosylmethionine decarboxylase proenzyme, putative 0.0668 0.4677 0.6028
Schistosoma mansoni DNA (cytosine-5)-methyltransferase 0.0201 0.1266 0.1701
Loa Loa (eye worm) hypothetical protein 0.0256 0.1664 0.1813
Echinococcus multilocularis S adenosylmethionine decarboxylase proenzyme 0.0668 0.4677 0.6028
Trypanosoma cruzi arginine N-methyltransferase, putative 0.006 0.0236 0.0294
Brugia malayi hypothetical protein 0.0367 0.2478 0.2703
Schistosoma mansoni hypothetical protein 0.0039 0.0079 0.0106
Schistosoma mansoni SET domain protein 0.0053 0.0178 0.0239
Onchocerca volvulus 0.0156 0.0935 0.0925
Schistosoma mansoni hypothetical protein 0.003 0.001 0.0014
Schistosoma mansoni protein arginine N-methyltransferase 1 0.0031 0.0022 0.0029
Entamoeba histolytica purine nucleoside phosphorylase, putative 0.0194 0.121 0.4669
Brugia malayi SET domain containing protein 0.0032 0.0025 0.0018
Echinococcus multilocularis histone arginine methyltransferase CARMER 0.0148 0.0873 0.1117
Plasmodium falciparum DNA (cytosine-5)-methyltransferase 0.0201 0.1266 0.1622
Brugia malayi Spermidine synthase 0.1089 0.7753 0.8479
Trypanosoma cruzi nucleoside phosphorylase, putative 0.0194 0.121 0.1553
Trypanosoma cruzi nucleoside phosphorylase, putative 0.0194 0.121 0.1553
Brugia malayi SET domain containing protein 0.0121 0.068 0.0736
Mycobacterium ulcerans S-adenosyl-L-homocysteine hydrolase 0.0382 0.2584 0.2203
Schistosoma mansoni jumonji/arid domain-containing protein 0.0037 0.0068 0.0092
Schistosoma mansoni methylthioadenosine phosphorylase 0.0194 0.121 0.1626
Echinococcus multilocularis purine nucleoside phosphorylase 0.0194 0.121 0.1553
Echinococcus multilocularis spermidine synthase 0.1089 0.7753 1
Schistosoma mansoni methylthioadenosine phosphorylase 0.1047 0.7444 1
Loa Loa (eye worm) spermidine synthase 0.1089 0.7753 0.8479
Brugia malayi purine nucleoside phosphorylase I, inosine and guanosine-specific family protein 0.0194 0.121 0.1317
Echinococcus multilocularis histone lysine n methyltransferase suv420h1 0.0137 0.0795 0.1016
Trypanosoma cruzi S-adenosylmethionine decarboxylase proenzyme, putative 0.0668 0.4677 0.6028
Onchocerca volvulus 0.0118 0.066 0.065
Loa Loa (eye worm) hypothetical protein 0.003 0.001 0.0003
Loa Loa (eye worm) hypothetical protein 0.007 0.0305 0.0325
Trichomonas vaginalis purine nucleoside phosphorylase I, putative 0.0194 0.121 0.1204
Toxoplasma gondii adenosylhomocysteinase, putative 0.0382 0.2584 1
Trypanosoma cruzi nucleoside phosphorylase, putative 0.0194 0.121 0.1553
Onchocerca volvulus 0.0039 0.0079 0.0069
Leishmania major arginine N-methyltransferase-like protein 0.0031 0.0022 0.0018
Loa Loa (eye worm) hypothetical protein 0.0367 0.2478 0.2703
Leishmania major S-adenosylmethionine decarboxylase 0.0668 0.4677 0.6028
Toxoplasma gondii hypothetical protein 0.0032 0.0032 0.0092
Trypanosoma cruzi methylthioadenosine phosphorylase, putative 0.1047 0.7444 0.96
Trypanosoma cruzi Histone methylation protein DOT1, putative 0.0032 0.0032 0.0031
Schistosoma mansoni hypothetical protein 0.0172 0.1051 0.1412
Schistosoma mansoni uridine phosphorylase 0.0194 0.121 0.1626
Toxoplasma gondii PHD-finger domain-containing protein 0.003 0.001 0.001
Schistosoma mansoni adenosylhomocysteinase 0.0236 0.152 0.2042
Echinococcus multilocularis PWWP domain containing protein 2A 0.0039 0.0079 0.0092
Echinococcus granulosus SET and MYND domain containing protein 3 0.0072 0.0318 0.0401
Plasmodium vivax adenosylhomocysteinase(S-adenosyl-L-homocystein e hydrolase), putative 0.0382 0.2584 0.3323
Schistosoma mansoni methylthioadenosine phosphorylase 0.1047 0.7444 1
Brugia malayi SET domain containing protein 0.0137 0.0795 0.0862
Schistosoma mansoni hypothetical protein 0.0039 0.0079 0.0106
Entamoeba histolytica purine nucleoside phosphorylase, putative 0.0194 0.121 0.4669
Loa Loa (eye worm) Carm1-pending protein 0.0148 0.0873 0.0947
Schistosoma mansoni protein arginine n-methyltransferase 0.0148 0.0873 0.1173
Mycobacterium ulcerans spermidine synthase 0.0858 0.6067 0.7791
Loa Loa (eye worm) hypothetical protein 0.0039 0.0079 0.0078
Schistosoma mansoni hypothetical protein 0.0172 0.1051 0.1412
Schistosoma mansoni jumonji/arid domain-containing protein 0.0037 0.0068 0.0092
Trypanosoma cruzi MIZ/SP-RING zinc finger, putative 0.0039 0.0079 0.0092
Echinococcus granulosus lysine specific demethylase 5A 0.0037 0.0068 0.0078
Entamoeba histolytica hypothetical protein 0.006 0.0236 0.0884
Schistosoma mansoni purine nucleoside phosphorylase 0.0194 0.121 0.1626
Loa Loa (eye worm) S-adenosylmethionine decarboxylase proenzyme 0.0668 0.4677 0.5111
Loa Loa (eye worm) hypothetical protein 0.0156 0.0935 0.1015
Giardia lamblia 5-methylthioadenosine nucleosidase, S-adenosylhomocysteine nucleosidase 0.0194 0.121 1
Echinococcus multilocularis PHD finger protein rhinoceros 0.003 0.001 0.0003
Echinococcus granulosus histone lysine N methyltransferase H3 lysine 36 0.0051 0.0166 0.0204
Echinococcus granulosus S adenosylmethionine decarboxylase proenzyme 0.0668 0.4677 0.6028
Loa Loa (eye worm) adenosylhomocysteinase 0.0382 0.2584 0.282
Schistosoma mansoni hypothetical protein 0.0053 0.018 0.0242
Trichomonas vaginalis conserved hypothetical protein 0.0194 0.121 0.1204
Loa Loa (eye worm) uridine phosphorylase 0.0194 0.121 0.1317
Echinococcus multilocularis protein arginine N methyltransferase 8 0.0031 0.0022 0.0018
Schistosoma mansoni hypothetical protein 0.0029 0.0008 0.0011
Brugia malayi hypothetical protein 0.0367 0.2478 0.2703
Loa Loa (eye worm) SET domain-containing protein 0.0202 0.1268 0.138
Toxoplasma gondii C-5 cytosine-specific DNA methylase superfamily protein 0.0201 0.1266 0.4886
Echinococcus multilocularis jumonji domain containing protein 0.0041 0.0095 0.0113
Toxoplasma gondii histone arginine methyltransferase PRMT1 0.0031 0.0022 0.0054
Echinococcus multilocularis uridine phosphorylase 1 0.0194 0.121 0.1553
Trichomonas vaginalis purine nucleoside phosphorylase, putative 0.0194 0.121 0.1204
Trypanosoma cruzi hypothetical protein, conserved 0.0039 0.0079 0.0092
Echinococcus multilocularis Transcription factor, JmjC domain containing protein 0.0097 0.0502 0.0639
Plasmodium falciparum adenosylhomocysteinase 0.0382 0.2584 0.3323
Loa Loa (eye worm) hypothetical protein 0.0051 0.0165 0.0172
Schistosoma mansoni suppressor of variegation 4-20-related 0.0137 0.0795 0.1068
Echinococcus granulosus uridine phosphorylase 1 0.0194 0.121 0.1553
Toxoplasma gondii Purine nucleoside phosphorylase 0.0194 0.121 0.4669
Echinococcus multilocularis peregrin 0.0069 0.0295 0.0371
Entamoeba histolytica adenosylhomocysteinase, putative 0.0382 0.2584 1
Leishmania major hypothetical protein, conserved 0.0039 0.0079 0.0092
Echinococcus granulosus purine nucleoside phosphorylase 0.0194 0.121 0.1553
Brugia malayi S-adenosylmethionine decarboxylase proenzyme 0.0668 0.4677 0.5111
Brugia malayi jmjC domain containing protein 0.0097 0.0502 0.0541
Echinococcus multilocularis histone lysine methyltransferase setb histone lysine methyltransferase eggless 0.019 0.118 0.1513
Trypanosoma cruzi methylthioadenosine phosphorylase, putative 0.1047 0.7444 0.96
Loa Loa (eye worm) hypothetical protein 0.0034 0.0045 0.0041
Trypanosoma cruzi S-adenosylhomocysteine hydrolase, putative 0.0382 0.2584 0.3325
Plasmodium vivax histone-lysine N-methyltransferase, putative 0.0084 0.0405 0.051
Schistosoma mansoni disco-interacting protein 2 (dip2) 0.0156 0.0935 0.1256
Plasmodium vivax S-adenosylmethionine decarboxylase-ornithine decarboxylase, putative 0.0325 0.2172 0.2792
Leishmania major spermidine synthase 0.1089 0.7753 1
Schistosoma mansoni adenosylhomocysteinase 0.0236 0.152 0.2042
Echinococcus multilocularis hepatoma derived growth factor protein 0.0039 0.0079 0.0092
Plasmodium vivax purine nucleoside phosphorylase, putative 0.0194 0.121 0.155
Loa Loa (eye worm) hypothetical protein 0.0109 0.0594 0.0641
Schistosoma mansoni adenosylhomocysteinase 0.0382 0.2584 0.3471
Brugia malayi uridine phosphorylase family protein 0.0194 0.121 0.1317
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.019 0.118 0.1585
Trichomonas vaginalis protein arginine N-methyltransferase, putative 0.0031 0.0022 0.0014
Echinococcus multilocularis lysine specific demethylase 5A 0.0036 0.0056 0.0062
Toxoplasma gondii S-Adenosyl homocysteine hydrolase 0.0382 0.2584 1
Loa Loa (eye worm) S-methyl-5'-thioadenosine phosphorylase MTAP 0.1047 0.7444 0.814
Plasmodium vivax spermidine synthase, putative 0.1089 0.7753 1
Echinococcus granulosus Transcription factor JmjC domain containing protein 0.0097 0.0502 0.0639
Echinococcus granulosus histone lysine methyltransferase setb 0.019 0.118 0.1513
Echinococcus granulosus histone lysine N methyltransferase Ez 0.0202 0.1268 0.1627
Trypanosoma cruzi Histone-lysine N-methyltransferase, H3 lysine-76 specific 0.0032 0.0032 0.0031
Plasmodium falciparum purine nucleoside phosphorylase 0.0194 0.121 0.155
Trypanosoma cruzi transcription elongation factor s-II, putative 0.0039 0.0079 0.0092
Trypanosoma brucei cytosine-specific DNA methylase, putative 0.0201 0.1266 0.1625
Brugia malayi Disco-interacting protein 2 homolog 0.0156 0.0935 0.1015
Echinococcus granulosus spermidine synthase 0.1089 0.7753 1
Echinococcus multilocularis purine nucleoside phosphorylase 0.0194 0.121 0.1553
Leishmania major histone-lysine N-methyltransferase, putative 0.0032 0.0032 0.0031
Loa Loa (eye worm) hypothetical protein 0.019 0.118 0.1283
Brugia malayi hypothetical protein 0.0039 0.0079 0.0078
Trypanosoma brucei S-adenosylhomocysteine hydrolase, putative 0.0382 0.2584 0.3325
Schistosoma mansoni cpg binding protein 0.0167 0.1013 0.1361
Onchocerca volvulus 0.0165 0.1001 0.0991
Trichomonas vaginalis purine nucleoside phosphorylase, putative 0.0194 0.121 0.1204
Echinococcus granulosus histone h3 methyltransferase 0.0256 0.1664 0.2139
Schistosoma mansoni purine nucleoside phosphorylase 0.0194 0.121 0.1626
Echinococcus granulosus purine nucleoside phosphorylase 0.0194 0.121 0.1553
Schistosoma mansoni adenosylhomocysteinase 0.0236 0.152 0.2042
Plasmodium vivax SET domain protein, putative 0.0129 0.0738 0.094
Schistosoma mansoni phd finger protein 0.0039 0.0079 0.0106
Trypanosoma brucei S-adenosylmethionine decarboxylase 0.0668 0.4677 0.6028
Entamoeba histolytica hypothetical protein 0.0194 0.121 0.4669
Echinococcus multilocularis PWWP domain containing protein 2A 0.0039 0.0079 0.0092
Echinococcus granulosus protein arginine N methyltransferase 8 0.0031 0.0022 0.0018
Leishmania major modification methylase-like protein 0.0201 0.1266 0.1625
Echinococcus granulosus microtubule associated protein 2 0.0705 0.4945 0.6374
Trypanosoma cruzi arginine N-methyltransferase, putative 0.006 0.0236 0.0294
Echinococcus multilocularis SET and MYND domain containing protein 3 0.0072 0.0318 0.0401
Trypanosoma cruzi spermidine synthase, putative 0.1089 0.7753 1
Echinococcus granulosus jumonji domain containing protein 0.0041 0.0095 0.0113
Brugia malayi F/Y-rich N-terminus family protein 0.003 0.0012 0.0005
Brugia malayi SET domain containing protein 0.0202 0.1268 0.138
Schistosoma mansoni hypothetical protein 0.0039 0.0079 0.0106
Schistosoma mansoni adenosylhomocysteinase 0.0236 0.152 0.2042
Toxoplasma gondii DNA methyltransferase 2, putative 0.0201 0.1266 0.4886
Entamoeba histolytica hypothetical protein 0.0039 0.0079 0.0277
Trypanosoma brucei S-adenosylmethionine decarboxylase proenzyme, putative 0.0668 0.4677 0.6028
Leishmania major S-adenosylhomocysteine hydrolase 0.0382 0.2584 0.3325
Trypanosoma brucei transcription elongation factor s-II, putative 0.0039 0.0079 0.0092
Echinococcus multilocularis purine nucleoside phosphorylase 0.0194 0.121 0.1553
Loa Loa (eye worm) hypothetical protein 0.0913 0.6464 0.7068
Leishmania major hypothetical protein, conserved 0.0032 0.0032 0.0031
Echinococcus granulosus adenosylhomocysteinase 0.0382 0.2584 0.3325
Echinococcus multilocularis purine nucleoside phosphorylase 0.0194 0.121 0.1553
Trypanosoma brucei Histone methylation protein DOT1, putative 0.0032 0.0032 0.0031
Mycobacterium tuberculosis Probable adenosylhomocysteinase SahH (S-adenosyl-L-homocysteine hydrolase) (adohcyase) 0.0382 0.2584 0.2827
Echinococcus multilocularis histone lysine n methyltransferase setb1 0.0034 0.0045 0.0048
Schistosoma mansoni histone-lysine n-methyltransferase suv9 0.0239 0.1538 0.2066
Onchocerca volvulus 0.0239 0.1538 0.1529
Loa Loa (eye worm) hypothetical protein 0.0913 0.6464 0.7068
Toxoplasma gondii PHD-finger domain-containing protein 0.003 0.001 0.001
Trichomonas vaginalis purine nucleoside phosphorylase, putative 0.0194 0.121 0.1204
Entamoeba histolytica purine nucleoside phosphorylase, putative 0.0194 0.121 0.4669
Echinococcus multilocularis microtubule associated protein 2 0.0705 0.4945 0.6374
Mycobacterium tuberculosis Probable 5'-methylthioadenosine phosphorylase Pnp (MTA phosphorylase) 0.0853 0.6028 0.9919
Giardia lamblia Purine nucleoside phosphorylase lateral transfer candidate 0.0194 0.121 1
Treponema pallidum purine nucleoside phosphorylase (deoD) 0.0194 0.121 0.5
Toxoplasma gondii histone lysine methyltransferase SET1 0.0067 0.0282 0.1065
Echinococcus granulosus PWWP domain containing protein 2A 0.0039 0.0079 0.0092
Schistosoma mansoni histone J3 methyltransferase 0.0256 0.1664 0.2236
Trypanosoma brucei Histone-lysine N-methyltransferase, H3 lysine-76 specific 0.0032 0.0032 0.0031
Entamoeba histolytica DNA (cytosine-5)-methyltransferase, putative 0.0201 0.1266 0.4886
Loa Loa (eye worm) hypothetical protein 0.0367 0.2478 0.2703
Brugia malayi CXXC zinc finger family protein 0.0165 0.1001 0.1087
Echinococcus granulosus geminin 0.0172 0.1051 0.1347
Brugia malayi Pre-SET motif family protein 0.1279 0.9143 1
Schistosoma mansoni cpg binding protein 0.0167 0.1013 0.1361
Trichomonas vaginalis purine nucleoside phosphorylase, putative 0.0194 0.121 0.1204
Echinococcus granulosus histone arginine methyltransferase CARMER 0.0148 0.0873 0.1117
Schistosoma mansoni cpg binding protein 0.0165 0.1001 0.1344
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.019 0.118 0.1585
Trichomonas vaginalis protein arginine N-methyltransferase, putative 0.0031 0.0022 0.0014
Loa Loa (eye worm) CXXC zinc finger family protein 0.0165 0.1001 0.1087
Trypanosoma cruzi spermidine synthase, putative 0.1089 0.7753 1
Brugia malayi Carm1-pending protein 0.0148 0.0873 0.0947
Entamoeba histolytica arginine N-methyltransferase protein, putative 0.006 0.0236 0.0884
Trypanosoma cruzi spermidine synthase, putative 0.1089 0.7753 1
Toxoplasma gondii hypothetical protein 0.0343 0.23 0.8898
Toxoplasma gondii histone arginine methyltransferase PRMT4/CARM1 0.0148 0.0873 0.336
Echinococcus multilocularis purine nucleoside phosphorylase 0.0194 0.121 0.1553
Trichomonas vaginalis adenosylhomocysteinase, putative 0.0382 0.2584 0.2578
Toxoplasma gondii histone lysine methyltransferase SET/SUV39 0.0129 0.0738 0.2834
Trypanosoma brucei Protein arginine N-methyltransferase 1 catalytic subunit 0.006 0.0236 0.0294
Echinococcus granulosus methylthioadenosine phosphorylase 0.1047 0.7444 0.96
Toxoplasma gondii phosphorylase family protein 0.0194 0.121 0.4669
Toxoplasma gondii phosphorylase family protein 0.0194 0.121 0.4669
Echinococcus granulosus histone lysine n methyltransferase suv420h1 0.0137 0.0795 0.1016
Plasmodium falciparum S-adenosylmethionine decarboxylase/ornithine decarboxylase 0.0325 0.2172 0.2792
Loa Loa (eye worm) NNMT/PNMT/TEMT family protein 0.0913 0.6464 0.7068
Trypanosoma cruzi spermidine synthase, putative 0.1089 0.7753 1
Schistosoma mansoni uridine phosphorylase 0.0194 0.121 0.1626
Trypanosoma brucei uridine phosphorylase 0.0194 0.121 0.1553
Brugia malayi PWWP domain containing protein 0.0039 0.0079 0.0078
Echinococcus multilocularis DNA methyltransferase 2, putative 0.0201 0.1266 0.1625
Echinococcus granulosus purine nucleoside phosphorylase 0.0194 0.121 0.1553
Echinococcus granulosus DNA methyltransferase 2, putative 0.0201 0.1266 0.1625
Trypanosoma brucei histone-lysine n-methyltransferase 0.0032 0.0032 0.0031
Schistosoma mansoni hepatoma derived growth factor 0.0039 0.0079 0.0106
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0073 0.0331 0.0444
Trypanosoma cruzi Histone methylation protein DOT1, putative 0.0032 0.0032 0.0031
Trichomonas vaginalis purine nucleoside phosphorylase, putative 0.0194 0.121 0.1204
Echinococcus granulosus purine nucleoside phosphorylase 0.0194 0.121 0.1553
Trichomonas vaginalis purine nucleoside phosphorylase, putative 0.0194 0.121 0.1204
Mycobacterium tuberculosis Probable spermidine synthase SpeE (putrescine aminopropyltransferase) (aminopropyltransferase) (SPDSY) 0.0858 0.6067 1
Plasmodium vivax protein arginine N-methyltransferase 1, putative 0.0031 0.0022 0.0015
Loa Loa (eye worm) SET domain-containing protein 0.0137 0.0795 0.0862
Brugia malayi MTAP 0.1047 0.7444 0.814
Trypanosoma cruzi transcription elongation factor-like protein, putative 0.0039 0.0079 0.0092
Echinococcus granulosus purine nucleoside phosphorylase 0.0194 0.121 0.1553
Echinococcus granulosus hepatoma derived growth factor protein 0.0039 0.0079 0.0092
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0129 0.0738 0.0991
Trichomonas vaginalis set domain proteins, putative 0.1396 1 1
Echinococcus multilocularis methylthioadenosine phosphorylase 0.1047 0.7444 0.96
Onchocerca volvulus 0.0039 0.0079 0.0069
Echinococcus granulosus purine nucleoside phosphorylase 0.0194 0.121 0.1553
Echinococcus multilocularis disco interacting protein 2 0.0156 0.0935 0.1197
Entamoeba histolytica purine nucleoside phosphorylase, putative 0.0194 0.121 0.4669
Trichomonas vaginalis protein arginine N-methyltransferase, putative 0.0031 0.0022 0.0014
Entamoeba histolytica purine nucleoside phosphorylase, putative 0.0194 0.121 0.4669
Schistosoma mansoni protein arginine N-methyltransferase 1 0.0031 0.0022 0.0029
Echinococcus granulosus PWWP domain containing protein 2A 0.0039 0.0079 0.0092
Trichomonas vaginalis purine nucleoside phosphorylase, putative 0.0194 0.121 0.1204
Schistosoma mansoni microtubule-associated protein tau 0.0705 0.4945 0.6643
Echinococcus multilocularis cpg binding protein 0.0167 0.1013 0.1297
Echinococcus granulosus PHD finger protein rhinoceros 0.003 0.001 0.0003
Brugia malayi hypothetical protein 0.006 0.0236 0.0249
Brugia malayi jmjC domain containing protein 0.0037 0.0068 0.0066
Brugia malayi Pre-SET motif family protein 0.0163 0.0989 0.1074
Brugia malayi hypothetical protein 0.0039 0.0079 0.0078
Brugia malayi NNMT/PNMT/TEMT family protein 0.0913 0.6464 0.7068
Echinococcus granulosus disco interacting protein 2 0.0156 0.0935 0.1197
Echinococcus multilocularis purine nucleoside phosphorylase 0.0194 0.121 0.1553
Schistosoma mansoni protein arginine N-methyltransferase 1 0.0031 0.0022 0.0029
Echinococcus multilocularis adenosylhomocysteinase 0.0382 0.2584 0.3325
Plasmodium falciparum conserved Plasmodium protein, unknown function 0.0343 0.23 0.2957
Echinococcus granulosus purine nucleoside phosphorylase 0.0194 0.121 0.1553
Schistosoma mansoni hepatoma derived growth factor 0.0039 0.0079 0.0106
Echinococcus multilocularis geminin 0.0172 0.1051 0.1347
Schistosoma mansoni bromodomain-containing nuclear protein 1 brd1 0.003 0.001 0.0014

Activities

Activity type Activity value Assay description Source Reference
Diet (functional) < 66 % In vivo triglyceride lowering activity dosed at 0.10 % of the diet. ChEMBL. 6604817
Diet (functional) < 72 % In vivo triglyceride lowering activity when dosed at 0.03 % of the diet ChEMBL. 6604817
Diet (functional) < 82 % In vivo triglyceride lowering activity when dosed as 0.01 % of the diet ChEMBL. 6604817
Diet (functional) = 100 % In vivo sterol lowering activity when dosed as 0.03 % of the diet ChEMBL. 6604817
Diet (functional) = 109 % In vivo sterol lowering activity at dose of 0.10 % of the diet ChEMBL. 6604817
Diet (functional) = 116 % In vivo sterol lowering activity when dosed as 0.01 % of the diet ChEMBL. 6604817
Inhibition (binding) = 16 % In vitro inhibition of acyl coenzyme A:cholesterol acyltransferase ChEMBL. 6604817
Inhibition (binding) = 16 % In vitro inhibition of acyl coenzyme A:cholesterol acyltransferase ChEMBL. 6604817

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.
 
In any case, if you have information about papers containing relevant validation data for this target, please log in using your TDR Targets username and password and send them to us using the corresponding form in this page (only visible to registered users) or contact us.

External resources for this compound

Bibliographic References

1 literature reference was collected for this gene.

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