Detailed information for compound 1529614

Basic information

Technical information
  • TDR Targets ID: 1529614
  • Name: N-(6-amino-2,4-dioxo-1-propylpyrimidin-5-yl)- N-butyl-2-[(3,5-dimethyl-1,2-oxazol-4-yl)meth ylsulfanyl]acetamide
  • MW: 423.53 | Formula: C19H29N5O4S
  • H donors: 2 H acceptors: 4 LogP: 1.87 Rotable bonds: 11
    Rule of 5 violations (Lipinski): 1
  • SMILES: CCCCN(c1c(=O)[nH]c(=O)n(c1N)CCC)C(=O)CSCc1c(C)noc1C
  • InChi: 1S/C19H29N5O4S/c1-5-7-9-23(15(25)11-29-10-14-12(3)22-28-13(14)4)16-17(20)24(8-6-2)19(27)21-18(16)26/h5-11,20H2,1-4H3,(H,21,26,27)
  • InChiKey: ZIRJKNHIXMFNDQ-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • N-(6-amino-2,4-dioxo-1-propyl-pyrimidin-5-yl)-N-butyl-2-[(3,5-dimethylisoxazol-4-yl)methylsulfanyl]acetamide
  • N-(6-amino-2,4-dioxo-1-propyl-5-pyrimidinyl)-N-butyl-2-[(3,5-dimethyl-4-isoxazolyl)methylthio]acetamide
  • N-(6-amino-2,4-diketo-1-propyl-pyrimidin-5-yl)-N-butyl-2-[(3,5-dimethylisoxazol-4-yl)methylthio]acetamide
  • N-(6-amino-2,4-dioxo-1-propyl-pyrimidin-5-yl)-N-butyl-2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]ethanamide

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 granulosus 5'partial|histone lysine N methyltransferase SETDB2 0.0202 0.0842 0.0818
Echinococcus multilocularis COUP TF:Svp nuclear hormone receptor 0.0071 0.0154 0.0129
Schistosoma mansoni tar DNA-binding protein 0.0063 0.0111 0.0106
Echinococcus multilocularis cadherin EGF LAG seven pass G type receptor 0.0049 0.0035 0.0009
Echinococcus granulosus potassium:sodium hyperpolarization activated 0.0054 0.0064 0.0038
Echinococcus multilocularis potassium voltage gated channel subfamily H 0.0274 0.1222 0.1199
Echinococcus granulosus histone lysine methyltransferase setb 0.021 0.0883 0.0859
Schistosoma mansoni tar DNA-binding protein 0.0063 0.0111 0.0106
Echinococcus granulosus GPCR family 2 0.0049 0.0035 0.0009
Brugia malayi jmjC domain containing protein 0.0047 0.0026 0.0026
Mycobacterium tuberculosis NAD(P)H quinone reductase LpdA 0.01 0.0302 0.2238
Leishmania major pyruvate kinase 0.02 0.0832 0.0808
Loa Loa (eye worm) jmjC domain-containing protein 0.0177 0.0708 0.0708
Loa Loa (eye worm) cyclic-nucleotide gated cation channel 0.0054 0.0064 0.0064
Loa Loa (eye worm) jmjC domain-containing protein 0.0047 0.0026 0.0026
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0071 0.0154 0.0154
Echinococcus multilocularis potassium voltage gated channel subfamily H 0.0079 0.0196 0.0171
Schistosoma mansoni hypothetical protein 0.0372 0.1735 0.173
Mycobacterium ulcerans citrate (pro-3S)-lyase subunit beta 0.0197 0.0816 0.637
Mycobacterium tuberculosis Probable citrate (pro-3S)-lyase (beta subunit) CitE (citrase) (citratase) (citritase) (citridesmolase) (citrase aldolase) 0.0197 0.0816 0.8316
Brugia malayi Nuclear hormone receptor family member nhr-1 0.0071 0.0154 0.0154
Brugia malayi nuclear receptor NHR-88 0.0071 0.0154 0.0154
Echinococcus granulosus cyclic nucleotide gated cation channel alpha 3 0.0054 0.0064 0.0038
Onchocerca volvulus Alhambra homolog 0.0146 0.0546 0.0398
Schistosoma mansoni hypothetical protein 0.0105 0.0333 0.0327
Onchocerca volvulus 0.1218 0.6191 0.6131
Schistosoma mansoni retinoid-x-receptor (RXR) 0.0071 0.0154 0.0149
Schistosoma mansoni hyperpolarization activated cyclic nucleotide-gated potassium channel 0.0054 0.0064 0.0058
Brugia malayi Latrophilin receptor protein 2 0.0049 0.0035 0.0035
Mycobacterium ulcerans pyruvate kinase 0.02 0.0832 0.6515
Brugia malayi jmjC domain containing protein 0.0478 0.2294 0.2294
Brugia malayi photoreceptor-specific nuclear receptor 0.0071 0.0154 0.0154
Echinococcus multilocularis pyruvate kinase 0.02 0.0832 0.0808
Echinococcus multilocularis thyroid hormone receptor alpha 0.0071 0.0154 0.0129
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0047 0.0028 0.0028
Toxoplasma gondii WD domain, G-beta repeat-containing protein 0.0048 0.0029 0.0003
Brugia malayi Pre-SET motif family protein 0.1463 0.7481 0.7481
Brugia malayi Pyruvate kinase, M2 isozyme 0.02 0.0832 0.0832
Echinococcus multilocularis hyperpolarization activated cyclic 0.0054 0.0064 0.0038
Brugia malayi Nuclear hormone receptor family member nhr-41 0.0071 0.0154 0.0154
Schistosoma mansoni pyruvate kinase 0.02 0.0832 0.0827
Brugia malayi Cyclic-nucleotide gated cation channel 0.0054 0.0064 0.0064
Loa Loa (eye worm) hypothetical protein 0.0047 0.0026 0.0026
Onchocerca volvulus 0.1942 1 1
Brugia malayi RNA, U transporter 1 0.0099 0.0299 0.0299
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.021 0.0883 0.0878
Schistosoma mansoni phosphatidylserine receptor 0.0047 0.0026 0.002
Echinococcus multilocularis FTZ F1 nuclear receptor protein 0.0071 0.0154 0.0129
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0071 0.0154 0.0154
Echinococcus multilocularis survival motor neuron protein 1 0.0474 0.2273 0.2253
Brugia malayi jmjC domain containing protein 0.0177 0.0708 0.0708
Plasmodium vivax hypothetical protein, conserved 0.0048 0.0029 0.0003
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0055 0.007 0.0064
Brugia malayi Bromodomain containing protein 0.0146 0.0546 0.0546
Schistosoma mansoni steroid hormone receptor ad4bp 0.0071 0.0154 0.0149
Schistosoma mansoni thyroid hormone receptor 0.0071 0.0154 0.0149
Schistosoma mansoni Tr4/Tr2 (homologue) 0.0071 0.0154 0.0149
Trypanosoma brucei PHD-zinc-finger like domain containing protein, putative 0.0048 0.0029 0.0003
Trypanosoma cruzi hypothetical protein, conserved 0.1712 0.879 0.8787
Echinococcus multilocularis pyruvate kinase 0.0103 0.0319 0.0294
Brugia malayi jmjC domain containing protein 0.0047 0.0026 0.0026
Plasmodium falciparum pyruvate kinase 2 0.0103 0.0319 0.0294
Brugia malayi Pyruvate kinase, alpha/beta domain containing protein 0.0061 0.0097 0.0097
Loa Loa (eye worm) hypothetical protein 0.0048 0.0029 0.0029
Loa Loa (eye worm) nuclear hormone receptor family member nhr-1 0.0071 0.0154 0.0154
Loa Loa (eye worm) hexokinase type II 0.1942 1 1
Echinococcus granulosus hexokinase 0.1942 1 1
Echinococcus multilocularis PHD finger protein rhinoceros 0.0146 0.0546 0.0522
Brugia malayi Hexokinase family protein 0.1218 0.6191 0.6191
Echinococcus multilocularis hexokinase 0.1942 1 1
Onchocerca volvulus 0.0097 0.0287 0.0135
Mycobacterium tuberculosis Probable membrane NADH dehydrogenase NdhA 0.009 0.025 0.1616
Schistosoma mansoni jumonji/arid domain-containing protein 0.0177 0.0708 0.0703
Loa Loa (eye worm) hypothetical protein 0.02 0.0832 0.0832
Schistosoma mansoni jumonji domain containing protein 0.038 0.1777 0.1772
Schistosoma mansoni nuclear hormone receptor nor-1/nor-2 0.0071 0.0154 0.0149
Echinococcus granulosus hepatocyte nuclear factor 4 alpha 0.0071 0.0154 0.0129
Entamoeba histolytica hexokinase 1 0.1942 1 1
Loa Loa (eye worm) hypothetical protein 0.0071 0.0154 0.0154
Brugia malayi PHD-finger family protein 0.0146 0.0546 0.0546
Loa Loa (eye worm) hexokinase 0.1218 0.6191 0.6191
Echinococcus multilocularis peregrin 0.0146 0.0546 0.0522
Brugia malayi TAR-binding protein 0.0063 0.0111 0.0111
Echinococcus multilocularis hepatocyte nuclear factor 4 alpha 0.0071 0.0154 0.0129
Schistosoma mansoni voltage-gated potassium channel 0.03 0.1355 0.135
Trichomonas vaginalis pyruvate kinase, putative 0.02 0.0832 0.0906
Echinococcus multilocularis neuropeptide s receptor 0.0462 0.2211 0.2191
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0047 0.0028 0.0002
Echinococcus multilocularis ecdysone induced protein 78C 0.0071 0.0154 0.0129
Brugia malayi nuclear hormone receptor 0.0071 0.0154 0.0154
Echinococcus granulosus jumonji domain containing protein 0.0203 0.0847 0.0823
Loa Loa (eye worm) glutaminase 0.0273 0.1216 0.1216
Schistosoma mansoni hypothetical protein 0.0343 0.1582 0.1578
Loa Loa (eye worm) hypothetical protein 0.0617 0.3028 0.3028
Brugia malayi Nuclear hormone receptor family member nhr-40 0.0071 0.0154 0.0154
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0047 0.0028 0.0022
Loa Loa (eye worm) jmjC domain-containing protein 0.0047 0.0026 0.0026
Schistosoma mansoni hexokinase 0.1942 1 1
Loa Loa (eye worm) hypothetical protein 0.0617 0.3028 0.3028
Schistosoma mansoni FTZ-F1 nuclear receptor-like protein 0.0071 0.0154 0.0149
Loa Loa (eye worm) hypothetical protein 0.0071 0.0154 0.0154
Mycobacterium tuberculosis Probable dehydrogenase 0.009 0.025 0.1616
Echinococcus granulosus cyclic nucleotide gated cation channel 0.0054 0.0064 0.0038
Brugia malayi Pre-SET motif family protein 0.021 0.0883 0.0883
Brugia malayi PHD-finger family protein 0.0048 0.0029 0.0029
Toxoplasma gondii hexokinase 0.1942 1 1
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0154 0.059 0.059
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0154 0.059 0.059
Echinococcus multilocularis GPCR, family 2 0.0049 0.0035 0.0009
Trichomonas vaginalis Citrate lyase beta chain, putative 0.0197 0.0816 0.0887
Echinococcus multilocularis pyruvate kinase 0.0103 0.0319 0.0294
Schistosoma mansoni nuclear receptor 2DBD-gamma 0.0071 0.0154 0.0149
Loa Loa (eye worm) cyclic-nucleotide gated cation channel 0.0054 0.0064 0.0064
Echinococcus granulosus pyruvate kinase 0.0103 0.0319 0.0294
Echinococcus multilocularis tar DNA binding protein 0.0063 0.0111 0.0086
Trypanosoma cruzi 2,4-dihydroxyhept-2-ene-1,7-dioic acid aldolase, putative 0.0197 0.0816 0.0792
Echinococcus multilocularis hyperpolarization activated cyclic 0.0054 0.0064 0.0038
Loa Loa (eye worm) nuclear hormone receptor family member nhr-31 0.0071 0.0154 0.0154
Echinococcus granulosus pyruvate kinase 0.02 0.0832 0.0808
Loa Loa (eye worm) pyruvate kinase 0.02 0.0832 0.0832
Schistosoma mansoni voltage-gated potassium channel 0.0079 0.0196 0.0191
Giardia lamblia Pyruvate kinase 0.02 0.0832 1
Loa Loa (eye worm) hypothetical protein 0.0071 0.0154 0.0154
Schistosoma mansoni histone-lysine n-methyltransferase suv9 0.021 0.0883 0.0878
Schistosoma mansoni jumonji domain containing protein 0.0047 0.0026 0.002
Leishmania major pyruvate kinase 0.02 0.0832 0.0808
Loa Loa (eye worm) hypothetical protein 0.0071 0.0154 0.0154
Plasmodium vivax pyruvate kinase, putative 0.02 0.0832 0.0808
Trichomonas vaginalis glutaminase, putative 0.0273 0.1216 0.1359
Toxoplasma gondii aldehyde dehydrogenase 0.0064 0.0113 0.0087
Loa Loa (eye worm) hypothetical protein 0.0474 0.2273 0.2273
Echinococcus granulosus neuropeptide s receptor 0.0462 0.2211 0.2191
Loa Loa (eye worm) hypothetical protein 0.014 0.0513 0.0513
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0047 0.0028 0.0002
Loa Loa (eye worm) jmjC domain-containing protein 0.0047 0.0026 0.0026
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.021 0.0883 0.0878
Mycobacterium tuberculosis Probable nitrite reductase [NAD(P)H] large subunit [FAD flavoprotein] NirB 0.009 0.025 0.1616
Loa Loa (eye worm) nuclear hormone receptor family member nhr-49 0.0071 0.0154 0.0154
Echinococcus multilocularis neuropeptide receptor A26 0.0462 0.2211 0.2191
Onchocerca volvulus 0.1942 1 1
Brugia malayi Hexokinase family protein 0.0601 0.2941 0.2941
Echinococcus multilocularis geminin 0.0343 0.1582 0.1561
Echinococcus granulosus pyruvate kinase 0.0103 0.0319 0.0294
Mycobacterium tuberculosis Probable reductase 0.009 0.025 0.1616
Leishmania major 2,4-dihydroxyhept-2-ene-1,7-dioic acid aldolase, putative 0.0197 0.0816 0.0792
Brugia malayi F/Y-rich N-terminus family protein 0.0055 0.007 0.007
Trypanosoma brucei PHD-zinc-finger like domain containing protein, putative 0.0048 0.0029 0.0003
Brugia malayi glutaminase DH11.1 0.0273 0.1216 0.1216
Brugia malayi Nuclear hormone receptor family member nhr-31 0.0071 0.0154 0.0154
Entamoeba histolytica hexokinase 2 0.1942 1 1
Loa Loa (eye worm) hypothetical protein 0.0047 0.0026 0.0026
Plasmodium falciparum conserved Plasmodium membrane protein, unknown function 0.0048 0.0029 0.0003
Brugia malayi Nuclear hormone receptor family member nhr-3 0.0071 0.0154 0.0154
Loa Loa (eye worm) hexokinase 0.1942 1 1
Schistosoma mansoni hypothetical protein 0.0049 0.0035 0.0029
Echinococcus granulosus voltage gated potassium channel 0.0079 0.0196 0.0171
Echinococcus multilocularis potassium:sodium hyperpolarization activated 0.0054 0.0064 0.0038
Loa Loa (eye worm) hypothetical protein 0.0154 0.059 0.059
Echinococcus multilocularis FTZ F1 alpha 0.0071 0.0154 0.0129
Loa Loa (eye worm) nuclear hormone receptor family member nhr-41 0.0071 0.0154 0.0154
Echinococcus granulosus cadherin EGF LAG seven pass G type receptor 0.0049 0.0035 0.0009
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0071 0.0154 0.0129
Echinococcus multilocularis hexokinase 0.1942 1 1
Brugia malayi Iron-sulfur cluster assembly accessory protein 0.0097 0.0287 0.0287
Echinococcus multilocularis citrate lyase subunit beta protein 0.0197 0.0816 0.0792
Plasmodium vivax hexokinase, putative 0.1942 1 1
Brugia malayi RNA recognition motif domain containing protein 0.0063 0.0111 0.0111
Echinococcus multilocularis pyruvate kinase 0.02 0.0832 0.0808
Chlamydia trachomatis pyruvate kinase 0.02 0.0832 0.5
Brugia malayi RNA binding protein 0.0063 0.0111 0.0111
Loa Loa (eye worm) TAR-binding protein 0.0063 0.0111 0.0111
Loa Loa (eye worm) hypothetical protein 0.1324 0.675 0.675
Schistosoma mansoni voltage-gated potassium channel 0.03 0.1355 0.135
Schistosoma mansoni hyperpolarization activated cyclic nucleotide-gated potassium channel 0.0054 0.0064 0.0058
Loa Loa (eye worm) hypothetical protein 0.0105 0.0333 0.0333
Toxoplasma gondii pyruvate kinase PyKII 0.0103 0.0319 0.0294
Loa Loa (eye worm) nuclear Hormone Receptor family member 0.0071 0.0154 0.0154
Echinococcus granulosus hexokinase type 2 0.1942 1 1
Echinococcus multilocularis cyclic nucleotide gated cation channel 0.0054 0.0064 0.0038
Brugia malayi Steroid receptor seven-up type 2 0.0071 0.0154 0.0154
Schistosoma mansoni RAR-like nuclear receptor 0.0071 0.0154 0.0149
Trichomonas vaginalis set domain proteins, putative 0.1665 0.8545 1
Onchocerca volvulus Huntingtin homolog 0.0125 0.0434 0.0284
Brugia malayi Pyruvate kinase, muscle isozyme 0.02 0.0832 0.0832
Toxoplasma gondii PHD-finger domain-containing protein 0.0146 0.0546 0.0522
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.0063 0.0111 0.0111
Schistosoma mansoni pyruvate kinase 0.02 0.0832 0.0827
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0071 0.0154 0.0129
Echinococcus granulosus tar DNA binding protein 0.0063 0.0111 0.0086
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0047 0.0028 0.0022
Echinococcus granulosus geminin 0.0343 0.1582 0.1561
Echinococcus granulosus potassium voltage gated channel subfamily H 0.0274 0.1222 0.1199
Trypanosoma cruzi 2,4-dihydroxyhept-2-ene-1,7-dioic acid aldolase, putative 0.0197 0.0816 0.0792
Schistosoma mansoni tar DNA-binding protein 0.0063 0.0111 0.0106
Mycobacterium tuberculosis Dihydrolipoamide dehydrogenase LpdC (lipoamide reductase (NADH)) (lipoyl dehydrogenase) (dihydrolipoyl dehydrogenase) (diaphoras 0.01 0.0302 0.2238
Trypanosoma brucei hexokinase 0.1942 1 1
Mycobacterium tuberculosis Probable pyruvate kinase PykA 0.02 0.0832 0.8505
Echinococcus granulosus pyruvate kinase 0.02 0.0832 0.0808
Trypanosoma brucei hypothetical protein, conserved 0.1712 0.879 0.8787
Onchocerca volvulus Pyruvate kinase homolog 0.02 0.0832 0.0688
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0071 0.0154 0.0129
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.0049 0.0035 0.0009
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0071 0.0154 0.0154
Loa Loa (eye worm) hypothetical protein 0.0079 0.0196 0.0196
Mycobacterium ulcerans citrate (pro-3S)-lyase subunit beta 0.0197 0.0816 0.637
Schistosoma mansoni tar DNA-binding protein 0.0063 0.0111 0.0106
Brugia malayi Nuclear hormone receptor family member nhr-14 0.0071 0.0154 0.0154
Trypanosoma brucei pyruvate kinase 1 0.02 0.0832 0.0808
Schistosoma mansoni cyclic-nucleotide-gated cation channel 0.0054 0.0064 0.0058
Plasmodium vivax pyruvate kinase 2, putative 0.0103 0.0319 0.0294
Leishmania major aldehyde dehydrogenase, mitochondrial precursor 0.0064 0.0113 0.0087
Echinococcus granulosus citrate lyase subunit beta protein 0.0197 0.0816 0.0792
Trypanosoma brucei hexokinase, putative 0.1942 1 1
Echinococcus granulosus cyclic nucleotide gated cation channel 0.0054 0.0064 0.0038
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0071 0.0154 0.0154
Brugia malayi steroid hormone receptor 0.0071 0.0154 0.0154
Schistosoma mansoni hypothetical protein 0.0049 0.0035 0.0029
Brugia malayi ecdysteroid receptor 0.0071 0.0154 0.0154
Trypanosoma cruzi pyruvate kinase 2, putative 0.02 0.0832 0.0808
Treponema pallidum hexokinase (hxk) 0.1942 1 0.5
Mycobacterium tuberculosis Probable NADH dehydrogenase Ndh 0.009 0.025 0.1616
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0047 0.0028 0.0002
Giardia lamblia PHD finger protein 15 0.0146 0.0546 0.4431
Mycobacterium tuberculosis Probable oxidoreductase 0.01 0.0302 0.2238
Loa Loa (eye worm) glutaminase 2 0.0273 0.1216 0.1216
Leishmania major hexokinase, putative 0.1942 1 1
Echinococcus multilocularis hexokinase 0.1942 1 1
Loa Loa (eye worm) hypothetical protein 0.0071 0.0154 0.0154
Onchocerca volvulus 0.1942 1 1
Loa Loa (eye worm) hypothetical protein 0.0146 0.0546 0.0546
Loa Loa (eye worm) nuclear hormone receptor family member nhr-40 0.0071 0.0154 0.0154
Loa Loa (eye worm) voltage and ligand gated potassium channel 0.0274 0.1222 0.1222
Trypanosoma cruzi hexokinase, putative 0.1942 1 1
Mycobacterium leprae DIHYDROLIPOAMIDE DEHYDROGENASE LPD (LIPOAMIDE REDUCTASE (NADH)) (LIPOYL DEHYDROGENASE) (DIHYDROLIPOYL DEHYDROGENASE) (DIAPHORASE 0.01 0.0302 0.0904
Mycobacterium tuberculosis Conserved protein 0.0197 0.0816 0.8316
Echinococcus granulosus survival motor neuron protein 1 0.0474 0.2273 0.2253
Schistosoma mansoni survival motor neuron protein 0.0097 0.0287 0.0281
Brugia malayi Hexokinase family protein 0.1942 1 1
Schistosoma mansoni voltage-gated potassium channel 0.0054 0.0064 0.0058
Schistosoma mansoni pyruvate kinase 0.0103 0.0319 0.0313
Echinococcus multilocularis cyclic nucleotide gated cation channel alpha 3 0.0054 0.0064 0.0038
Schistosoma mansoni aldehyde dehydrogenase 0.0064 0.0113 0.0107
Toxoplasma gondii histone lysine methyltransferase SET/SUV39 0.021 0.0883 0.0859
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.021 0.0883 0.0878
Onchocerca volvulus Pyruvate kinase homolog 0.02 0.0832 0.0688
Schistosoma mansoni cyclic-nucleotide-gated cation channel 0.0054 0.0064 0.0058
Schistosoma mansoni jumonji/arid domain-containing protein 0.0177 0.0708 0.0703
Echinococcus granulosus peregrin 0.0146 0.0546 0.0522
Echinococcus granulosus Nuclear hormone receptor family member nhr 41 0.0071 0.0154 0.0129
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.0049 0.0035 0.0035
Mycobacterium ulcerans glutaminase 0.0273 0.1216 1
Schistosoma mansoni thyroid hormone receptor 0.0071 0.0154 0.0149
Brugia malayi AF-10 protein 0.0048 0.0029 0.0029
Loa Loa (eye worm) pre-SET domain-containing protein family protein 0.1463 0.7481 0.7481
Leishmania major hypothetical protein, conserved 0.1712 0.879 0.8787
Plasmodium falciparum pyruvate kinase 0.02 0.0832 0.0808
Loa Loa (eye worm) hypothetical protein 0.0071 0.0154 0.0154
Trichomonas vaginalis pyruvate kinase, putative 0.02 0.0832 0.0906
Echinococcus multilocularis Nuclear hormone receptor family member nhr 41 0.0071 0.0154 0.0129
Toxoplasma gondii PHD-finger domain-containing protein 0.0048 0.0029 0.0003
Trypanosoma brucei hexokinase 0.1942 1 1
Loa Loa (eye worm) RNA binding protein 0.0063 0.0111 0.0111
Toxoplasma gondii pyruvate kinase PyK1 0.02 0.0832 0.0808
Mycobacterium leprae Probable pyruvate kinase PykA 0.02 0.0832 1
Loa Loa (eye worm) pyruvate kinase 0.02 0.0832 0.0832
Echinococcus granulosus COUP TF:Svp nuclear hormone receptor 0.0071 0.0154 0.0129
Loa Loa (eye worm) nucleolar RNA-associated protein alpha 0.0372 0.1735 0.1735
Trichomonas vaginalis voltage and ligand gated potassium channel, putative 0.0256 0.1127 0.1254
Echinococcus granulosus FTZ F1 alpha 0.0071 0.0154 0.0129
Trichomonas vaginalis voltage and ligand gated potassium channel, putative 0.0256 0.1127 0.1254
Loa Loa (eye worm) PHD-finger family protein 0.0146 0.0546 0.0546
Brugia malayi hypothetical protein 0.0125 0.0434 0.0434
Echinococcus granulosus aldehyde dehydrogenase mitochondrial 0.0064 0.0113 0.0087
Loa Loa (eye worm) hypothetical protein 0.0125 0.0434 0.0434
Echinococcus multilocularis pyruvate kinase 0.0103 0.0319 0.0294
Onchocerca volvulus Huntingtin homolog 0.0125 0.0434 0.0284
Loa Loa (eye worm) jmjC domain-containing protein 0.0301 0.1364 0.1364
Plasmodium vivax hypothetical protein, conserved 0.0146 0.0546 0.0522
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0047 0.0028 0.0002
Loa Loa (eye worm) latrophilin receptor protein 2 0.0049 0.0035 0.0035
Loa Loa (eye worm) pyruvate kinase 0.02 0.0832 0.0832
Loa Loa (eye worm) pyruvate kinase-PB 0.014 0.0513 0.0513
Leishmania major hexokinase, putative 0.1942 1 1
Echinococcus multilocularis histone lysine N methyltransferase SETMAR 0.021 0.0883 0.0859
Loa Loa (eye worm) hypothetical protein 0.021 0.0883 0.0883
Echinococcus granulosus retinoic acid receptor rxr beta a 0.0071 0.0154 0.0129
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0047 0.0028 0.0028
Brugia malayi hexokinase type II 0.0617 0.3028 0.3028
Schistosoma mansoni hypothetical protein 0.0343 0.1582 0.1578
Echinococcus granulosus ecdysone induced protein 78C 0.0071 0.0154 0.0129
Loa Loa (eye worm) hypothetical protein 0.0238 0.1031 0.1031
Echinococcus granulosus potassium voltage gated channel subfamily H 0.0079 0.0196 0.0171
Trypanosoma cruzi hexokinase, putative 0.1942 1 1
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0071 0.0154 0.0154
Schistosoma mansoni cyclic-nucleotide-gated cation channel 0.0054 0.0064 0.0058
Onchocerca volvulus 0.021 0.0883 0.074
Echinococcus multilocularis aldehyde dehydrogenase, mitochondrial 0.0064 0.0113 0.0087
Echinococcus multilocularis Transcription factor, JmjC domain containing protein 0.0478 0.2294 0.2274
Echinococcus granulosus hyperpolarization activated cyclic 0.0054 0.0064 0.0038
Schistosoma mansoni protein phosphatase 2C 0.0047 0.0026 0.002
Loa Loa (eye worm) hypothetical protein 0.0054 0.0064 0.0064
Onchocerca volvulus Pyruvate kinase homolog 0.02 0.0832 0.0688
Trypanosoma cruzi hypothetical protein, conserved 0.1712 0.879 0.8787
Schistosoma mansoni nuclear hormone receptor 0.0071 0.0154 0.0149
Mycobacterium ulcerans hypothetical protein 0.0197 0.0816 0.637
Schistosoma mansoni glutaminase 0.0273 0.1216 0.1211
Loa Loa (eye worm) hypothetical protein 0.0125 0.0434 0.0434
Echinococcus granulosus hyperpolarization activated cyclic 0.0054 0.0064 0.0038
Echinococcus multilocularis snurportin 1 0.0372 0.1735 0.1714
Plasmodium falciparum phd finger protein, putative 0.0146 0.0546 0.0522
Schistosoma mansoni hypothetical protein 0.0146 0.0546 0.0541
Loa Loa (eye worm) steroid hormone receptor 0.0071 0.0154 0.0154
Loa Loa (eye worm) hypothetical protein 0.0071 0.0154 0.0154
Schistosoma mansoni tar DNA-binding protein 0.0063 0.0111 0.0106
Echinococcus multilocularis histone lysine methyltransferase setb histone lysine methyltransferase eggless 0.021 0.0883 0.0859
Onchocerca volvulus 0.1665 0.8545 0.8522
Brugia malayi Nuclear hormone receptor family member nhr-49 0.0071 0.0154 0.0154
Onchocerca volvulus Hexokinase homolog 0.1218 0.6191 0.6131
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0071 0.0154 0.0129
Mycobacterium ulcerans hypothetical protein 0.0197 0.0816 0.637
Schistosoma mansoni phd/f-box containing protein 0.0047 0.0026 0.002
Schistosoma mansoni hypothetical protein 0.0097 0.0287 0.0281
Loa Loa (eye worm) nuclear hormone receptor family member nhr-14 0.0071 0.0154 0.0154
Echinococcus multilocularis pyruvate kinase 0.0158 0.061 0.0585
Schistosoma mansoni hypothetical protein 0.0049 0.0035 0.0029
Mycobacterium tuberculosis Possible penicillin-binding protein 0.0224 0.0958 1
Trypanosoma brucei pyruvate kinase 1, putative 0.02 0.0832 0.0808
Echinococcus granulosus hexokinase 0.1942 1 1
Echinococcus granulosus hexokinase 0.1942 1 1
Schistosoma mansoni retinoic acid receptor RXR 0.0071 0.0154 0.0149
Echinococcus granulosus neuropeptide receptor A26 0.0462 0.2211 0.2191
Echinococcus granulosus Transcription factor JmjC domain containing protein 0.0478 0.2294 0.2274
Echinococcus multilocularis lysine specific demethylase 5A 0.0177 0.0708 0.0684
Echinococcus granulosus PHD finger protein rhinoceros 0.0146 0.0546 0.0522
Schistosoma mansoni aldehyde dehydrogenase 0.0064 0.0113 0.0107
Schistosoma mansoni hypothetical protein 0.0049 0.0035 0.0029
Mycobacterium tuberculosis Putative ferredoxin reductase 0.009 0.025 0.1616
Echinococcus multilocularis jumonji domain containing protein 0.0203 0.0847 0.0823
Brugia malayi latrophilin 2 splice variant baaae 0.0105 0.0333 0.0333
Echinococcus multilocularis hexokinase type 2 0.1942 1 1
Mycobacterium ulcerans citrate lyase beta subunit, CitE_2 0.0197 0.0816 0.637
Echinococcus granulosus lysine specific demethylase 5A 0.0177 0.0708 0.0684
Brugia malayi jmjC domain containing protein 0.0047 0.0026 0.0026
Brugia malayi Nuclear hormone receptor-like 1 0.0071 0.0154 0.0154
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0047 0.0028 0.0022
Plasmodium vivax SET domain protein, putative 0.021 0.0883 0.0859
Schistosoma mansoni coup transcription factor 0.0071 0.0154 0.0149
Schistosoma mansoni bromodomain-containing nuclear protein 1 brd1 0.0146 0.0546 0.0541
Brugia malayi Voltage-gated potassium channel, EAG (KCNH1)-related. C. elegans egl-2 ortholog 0.0079 0.0196 0.0196
Schistosoma mansoni photoreceptor-specific nuclear receptor related 0.0071 0.0154 0.0149
Plasmodium falciparum hexokinase 0.1942 1 1
Schistosoma mansoni ubiquitously transcribed sex (X/Y) chromosome tetratricopeptide repeat protein-related 0.0047 0.0026 0.002
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.0049 0.0035 0.0009
Toxoplasma gondii PHD-finger domain-containing protein 0.0146 0.0546 0.0522
Schistosoma mansoni hypothetical protein 0.0048 0.0029 0.0023
Echinococcus granulosus FTZ F1 nuclear receptor protein 0.0071 0.0154 0.0129
Loa Loa (eye worm) hexokinase 0.0601 0.2941 0.2941
Trypanosoma cruzi pyruvate kinase 2, putative 0.02 0.0832 0.0808
Echinococcus multilocularis voltage gated potassium channel 0.0079 0.0196 0.0171
Brugia malayi hypothetical protein 0.0474 0.2273 0.2273
Loa Loa (eye worm) hypothetical protein 0.0071 0.0154 0.0154
Brugia malayi jmjC domain containing protein 0.0047 0.0026 0.0026
Brugia malayi Calcitonin receptor-like protein seb-1 0.0154 0.059 0.059
Loa Loa (eye worm) hypothetical protein 0.025 0.1095 0.1095
Loa Loa (eye worm) hypothetical protein 0.0049 0.0035 0.0035
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0071 0.0154 0.0154
Echinococcus granulosus pyruvate kinase 0.0103 0.0319 0.0294
Brugia malayi Voltage-gated potassium channel, HERG (KCNH2)-related. C. elegans unc-103 ortholog 0.0274 0.1222 0.1222
Loa Loa (eye worm) hexokinase 0.1942 1 1
Echinococcus granulosus snurportin 1 0.0372 0.1735 0.1714
Schistosoma mansoni voltage-gated potassium channel 0.0079 0.0196 0.0191

Activities

Activity type Activity value Assay description Source Reference
Potency (functional) 79.4328 uM PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Histone Lysine Methyltransferase G9a. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID504404] ChEMBL. No reference
Potency (functional) 89.1251 uM PUBCHEM_BIOASSAY: qHTS for Inhibitors of Polymerase Iota. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID588623] ChEMBL. No reference

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

No literature references available for this target.

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