Detailed information for compound 1385734

Basic information

Technical information
  • TDR Targets ID: 1385734
  • Name: N-[3-[[2-(2-methylphenoxy)acetyl]amino]propyl ]furan-2-carboxamide
  • MW: 316.352 | Formula: C17H20N2O4
  • H donors: 2 H acceptors: 2 LogP: 2.33 Rotable bonds: 10
    Rule of 5 violations (Lipinski): 1
  • SMILES: O=C(COc1ccccc1C)NCCCNC(=O)c1ccco1
  • InChi: 1S/C17H20N2O4/c1-13-6-2-3-7-14(13)23-12-16(20)18-9-5-10-19-17(21)15-8-4-11-22-15/h2-4,6-8,11H,5,9-10,12H2,1H3,(H,18,20)(H,19,21)
  • InChiKey: PJBZIRWSJWKHBZ-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • N-[3-[[2-(2-methylphenoxy)-1-oxoethyl]amino]propyl]-2-furancarboxamide
  • N-[3-[[2-(2-methylphenoxy)acetyl]amino]propyl]-2-furamide
  • N-[3-[2-(2-methylphenoxy)ethanoylamino]propyl]furan-2-carboxamide
  • ASN 11412586
  • Furan-2-carboxylic acid [3-(2-o-tolyloxy-acetylamino)-propyl]-amide
  • AO-365/43264333
  • ZINC05015357

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Mus musculus RAR-related orphan receptor gamma Starlite/ChEMBL No references

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
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0053 0.0424 0.1493
Trichomonas vaginalis plasma membrane calcium-transporting ATPase, putative 0.0059 0.0484 0.3692
Echinococcus granulosus calcium transporting atpase 0.004 0.0264 0.0995
Toxoplasma gondii plasma membrane-type Ca(2+)-ATPase A1 PMCAA1 0.0054 0.0431 0.3254
Loa Loa (eye worm) hypothetical protein 0.0019 0.0018 0.0065
Loa Loa (eye worm) calcium-transporting ATPase sarcoplasmic/endoplasmic reticulum type 0.0025 0.0088 0.032
Mycobacterium ulcerans glucose-6-phosphate 1-dehydrogenase 0.0081 0.0747 0.2849
Echinococcus multilocularis nervana 2 0.0064 0.0543 0.2123
Trichomonas vaginalis plasma membrane calcium-transporting ATPase, putative 0.0059 0.0484 0.3692
Loa Loa (eye worm) nuclear Hormone Receptor family member 0.0035 0.0212 0.0776
Brugia malayi calcium ATPase 0.0033 0.0191 0.0635
Trichomonas vaginalis glucosamine-6-phosphate isomerase, putative 0.0124 0.125 1
Brugia malayi Calcitonin receptor-like protein seb-1 0.0053 0.0424 0.1493
Trypanosoma cruzi calcium-transporting ATPase, putative 0.0025 0.0088 0.07
Onchocerca volvulus 0.0044 0.0317 0.0414
Schistosoma mansoni nuclear receptor 2DBD-gamma 0.0035 0.0212 0.0195
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0035 0.0212 0.0716
Loa Loa (eye worm) hypothetical protein 0.0035 0.0212 0.0776
Echinococcus multilocularis sodium:potassium transporting ATPase subunit 0.0064 0.0543 0.2123
Brugia malayi Steroid receptor seven-up type 2 0.0035 0.0212 0.0716
Echinococcus multilocularis geminin 0.0183 0.1934 0.7747
Mycobacterium leprae PROBABLE ATP SYNTHASE A CHAIN ATPB (PROTEIN 6) 0.0234 0.2534 1
Schistosoma mansoni retinoic acid receptor RXR 0.0035 0.0212 0.0195
Echinococcus multilocularis Nuclear hormone receptor family member nhr 41 0.0035 0.0212 0.0787
Schistosoma mansoni ap endonuclease 0.002 0.0035 0.0017
Echinococcus multilocularis sarco:endoplasmic reticulum calcium ATPase 0.0044 0.0317 0.121
Loa Loa (eye worm) hypothetical protein 0.0231 0.2491 0.9101
Schistosoma mansoni calcium-transporting atpase sarcoplasmic/endoplasmic reticulum type (calcium pump) 0.004 0.0264 0.0246
Trypanosoma brucei P-type H+-ATPase, putative 0.0027 0.0117 0.0673
Echinococcus multilocularis ecdysone induced protein 78C 0.0035 0.0212 0.0787
Trichomonas vaginalis cation-transporting ATPase, putative 0.0044 0.0317 0.2319
Trypanosoma brucei vacuolar-type Ca2+-ATPase 2 0.0059 0.0484 0.3692
Plasmodium falciparum non-SERCA-type Ca2+ -transporting P-ATPase 0.0045 0.033 0.2429
Schistosoma mansoni glucose-6-phosphate 1-dehydrogenase 0.0124 0.125 0.1234
Echinococcus multilocularis plasma membrane calcium transporting ATPase 0.0054 0.0431 0.1669
Trypanosoma cruzi Glucose-6-phosphate dehydrogenase, putative 0.004 0.0267 0.2133
Leishmania major vacuolar-type Ca2 -ATPase, putative 0.0059 0.0484 0.3692
Loa Loa (eye worm) nuclear hormone receptor family member nhr-41 0.0035 0.0212 0.0776
Echinococcus granulosus cytoplasmic intermediate filament protein 0.0026 0.01 0.0332
Echinococcus granulosus FTZ F1 alpha 0.0035 0.0212 0.0787
Mycobacterium tuberculosis Probable glucose-6-phosphate 1-dehydrogenase Zwf2 (G6PD) 0.0043 0.0303 0.1071
Schistosoma mansoni FTZ-F1 nuclear receptor-like protein 0.0035 0.0212 0.0195
Entamoeba histolytica Plasma membrane calcium-transporting ATPase, putative 0.0059 0.0484 1
Leishmania major P-type ATPase, putative 0.0054 0.0431 0.3254
Brugia malayi cytoplasmic intermediate filament protein 0.0029 0.0133 0.0423
Schistosoma mansoni plasma membrane calcium-transporting atpase 0.0054 0.0431 0.0413
Entamoeba histolytica calcium-transporting P-type ATPase, putative 0.0045 0.033 0.6617
Schistosoma mansoni nuclear hormone receptor nor-1/nor-2 0.0035 0.0212 0.0195
Schistosoma mansoni lamin 0.0053 0.0421 0.0404
Echinococcus granulosus Nuclear hormone receptor family member nhr 41 0.0035 0.0212 0.0787
Trypanosoma cruzi plasma membrane Ca2+ ATPase 0.0059 0.0484 0.387
Echinococcus granulosus sodium:potassium transporting ATPase subunit 0.0064 0.0543 0.2123
Schistosoma mansoni plasma membrane calcium-transporting atpase 0.0054 0.0431 0.0413
Brugia malayi Nuclear hormone receptor-like 1 0.0035 0.0212 0.0716
Trypanosoma cruzi plasma membrane Ca2+ ATPase 0.0059 0.0484 0.387
Treponema pallidum glucose-6-phosphate 1-dehydrogenase 0.0124 0.125 1
Schistosoma mansoni calcium-transporting atpase sarcoplasmic/endoplasmic reticulum type (calcium pump) 0.004 0.0264 0.0246
Schistosoma mansoni ATPase 0.0044 0.0317 0.03
Loa Loa (eye worm) hypothetical protein 0.0053 0.0421 0.154
Echinococcus granulosus calcium transporting ATPase type 2C member 0.0045 0.033 0.1264
Loa Loa (eye worm) nuclear hormone receptor family member nhr-40 0.0035 0.0212 0.0776
Plasmodium falciparum calcium-transporting ATPase 0.0039 0.0254 0.1796
Echinococcus granulosus FTZ F1 nuclear receptor protein 0.0035 0.0212 0.0787
Loa Loa (eye worm) hypothetical protein 0.0025 0.0089 0.0324
Trichomonas vaginalis 6-phosphogluconolactonase, putative 0.0124 0.125 1
Trypanosoma cruzi P-type H+-ATPase, putative 0.0027 0.0117 0.0937
Giardia lamblia Plasma membrane calcium-transporting ATPase 2 0.0059 0.0484 0.3692
Echinococcus multilocularis Ca2+ transporting ATPase plasma membrane 0.0054 0.0431 0.1669
Leishmania major calcium-transporting ATPase, putative 0.004 0.0264 0.1881
Schistosoma mansoni Na+/K+ transporting ATPase subunit alpha 0.0045 0.033 0.0313
Brugia malayi Iron-sulfur cluster assembly accessory protein 0.0047 0.0349 0.1217
Entamoeba histolytica plasma membrane calcium ion-transporting ATPase, putative 0.0036 0.022 0.4187
Brugia malayi photoreceptor-specific nuclear receptor 0.0035 0.0212 0.0716
Trypanosoma brucei calcium-transporting ATPase, putative 0.0025 0.0088 0.0429
Loa Loa (eye worm) nuclear hormone receptor-like 1 0.0019 0.0018 0.0065
Loa Loa (eye worm) sodium potassium adenosine triphosphatase 0.0021 0.004 0.0147
Loa Loa (eye worm) cytoplasmic intermediate filament protein 0.0029 0.0133 0.0486
Echinococcus granulosus retinoic acid receptor rxr beta a 0.0035 0.0212 0.0787
Brugia malayi Nuclear hormone receptor family member nhr-40 0.0035 0.0212 0.0716
Toxoplasma gondii P-type ATPase PMA1 0.0027 0.0117 0.0673
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0035 0.0212 0.0787
Echinococcus granulosus Na:K ATPase alpha subunit 0.0039 0.0254 0.0953
Schistosoma mansoni hypothetical protein 0.0183 0.1934 0.1919
Trichomonas vaginalis cation-transporting ATPase, putative 0.0044 0.0317 0.2319
Mycobacterium tuberculosis Possible metal cation transporting P-type ATPase CtpH 0.0029 0.0141 0.0421
Mycobacterium ulcerans F0F1 ATP synthase subunit A 0.0234 0.2534 1
Trichomonas vaginalis plasma membrane calcium-transporting ATPase, putative 0.0053 0.042 0.3169
Mycobacterium ulcerans cation-transporter ATPase I CtpI 0.0029 0.0141 0.0421
Schistosoma mansoni RAR-like nuclear receptor 0.0035 0.0212 0.0195
Trypanosoma cruzi P-type H+-ATPase, putative 0.0021 0.004 0.0321
Onchocerca volvulus Huntingtin homolog 0.0252 0.2737 1
Trichomonas vaginalis cation-transporting ATPase, putative 0.0027 0.0117 0.0673
Wolbachia endosymbiont of Brugia malayi ATP synthase F0F1 subunit A 0.0234 0.2534 1
Loa Loa (eye worm) hypothetical protein 0.0252 0.2737 1
Echinococcus multilocularis nervana 2 0.0064 0.0543 0.2123
Brugia malayi Probable calcium-transporting ATPase KIAA0703 0.0024 0.0077 0.0218
Echinococcus multilocularis glucose 6 phosphate 1 dehydrogenase 0.0124 0.125 0.4983
Trypanosoma brucei glucose-6-phosphate 1-dehydrogenase 0.0124 0.125 1
Onchocerca volvulus Huntingtin homolog 0.0252 0.2737 1
Echinococcus granulosus sodium:potassium dependent atpase beta subunit 0.0064 0.0543 0.2123
Schistosoma mansoni na+/k+ atpase alpha subunit 0.0039 0.0254 0.0236
Plasmodium falciparum glucose-6-phosphate dehydrogenase-6-phosphogluconolactonase 0.0124 0.125 1
Echinococcus granulosus COUP TF:Svp nuclear hormone receptor 0.0035 0.0212 0.0787
Loa Loa (eye worm) hypothetical protein 0.0252 0.2737 1
Chlamydia trachomatis glucose-6-phosphate 1-dehydrogenase 0.0124 0.125 0.5
Echinococcus granulosus sodium:potassium dependent atpase beta subunit 0.0064 0.0543 0.2123
Brugia malayi Membrane calcium atpase protein 3 0.0054 0.0431 0.1518
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0053 0.0424 0.1549
Echinococcus multilocularis FTZ F1 alpha 0.0035 0.0212 0.0787
Echinococcus multilocularis hepatocyte nuclear factor 4 alpha 0.0035 0.0212 0.0787
Trichomonas vaginalis glucosamine-6-phosphate isomerase, putative 0.0124 0.125 1
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0035 0.0212 0.0716
Toxoplasma gondii glucose-6-phosphate 1-dehydrogenase 0.0124 0.125 1
Echinococcus multilocularis cytoplasmic intermediate filament protein 0.0026 0.01 0.0332
Schistosoma mansoni intermediate filament proteins 0.0053 0.0421 0.0404
Loa Loa (eye worm) exodeoxyribonuclease III family protein 0.002 0.0035 0.0129
Loa Loa (eye worm) E1-E2 ATPase 0.0027 0.0117 0.0428
Brugia malayi Nuclear hormone receptor family member nhr-14 0.0035 0.0212 0.0716
Echinococcus granulosus sodium:potassium dependent atpase beta subunit 0.0064 0.0543 0.2123
Echinococcus granulosus plasma membrane calcium transporting ATPase 2 0.006 0.0497 0.1938
Echinococcus granulosus nervana 2 0.0064 0.0543 0.2123
Brugia malayi Na,K-ATPase alpha subunit 0.0045 0.033 0.115
Loa Loa (eye worm) sodium/potassium-transporting ATPase subunit alpha 0.003 0.0154 0.0563
Schistosoma mansoni ATPase 0.0044 0.0317 0.03
Loa Loa (eye worm) hypothetical protein 0.0019 0.0018 0.0065
Brugia malayi hypothetical protein 0.0252 0.2737 1
Schistosoma mansoni photoreceptor-specific nuclear receptor related 0.0035 0.0212 0.0195
Trichomonas vaginalis plasma membrane calcium-transporting ATPase, putative 0.006 0.0497 0.3802
Toxoplasma gondii glucose-6-phosphate 1-dehydrogenase 0.0081 0.0747 0.5859
Mycobacterium ulcerans metal cation transporter p-type ATPase a 0.0044 0.0317 0.1127
Trypanosoma cruzi glucose-6-phosphate 1-dehydrogenase, putative 0.0124 0.125 1
Brugia malayi Nuclear hormone receptor family member nhr-41 0.0035 0.0212 0.0716
Echinococcus multilocularis nervana 2 0.0064 0.0543 0.2123
Onchocerca volvulus 0.0064 0.0543 0.1309
Echinococcus granulosus DNA apurinic or apyrimidinic site lyase 0.002 0.0035 0.0071
Trypanosoma brucei calcium motive p-type ATPase, putative 0.004 0.0264 0.1881
Brugia malayi nuclear hormone receptor 0.0035 0.0212 0.0716
Echinococcus granulosus geminin 0.0183 0.1934 0.7747
Brugia malayi calcium ATPase 0.0021 0.004 0.0082
Echinococcus multilocularis sodium:potassium dependent atpase beta subunit 0.0064 0.0543 0.2123
Brugia malayi latrophilin 2 splice variant baaae 0.0037 0.0226 0.0767
Echinococcus multilocularis Tetracycline resistance leader peptide, TetL 0.006 0.0497 0.1938
Echinococcus multilocularis Na+:K+ ATPase alpha subunit 0.0039 0.0254 0.0953
Loa Loa (eye worm) hypothetical protein 0.0044 0.0317 0.1158
Echinococcus multilocularis FTZ F1 nuclear receptor protein 0.0035 0.0212 0.0787
Trichomonas vaginalis cation-transporting ATPase, putative 0.0059 0.0484 0.3692
Echinococcus granulosus nervana 2 0.0064 0.0543 0.2123
Loa Loa (eye worm) hypothetical protein 0.0035 0.0212 0.0776
Schistosoma mansoni retinoid-x-receptor (RXR) 0.0035 0.0212 0.0195
Entamoeba histolytica Plasma membrane calcium-transporting ATPase, putative 0.0059 0.0484 1
Brugia malayi Nuclear hormone receptor family member nhr-31 0.0035 0.0212 0.0716
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0035 0.0212 0.0716
Trypanosoma cruzi calcium motive p-type ATPase, putative 0.004 0.0264 0.2111
Trypanosoma cruzi glucose-6-phosphate 1-dehydrogenase, putative 0.0041 0.0281 0.2244
Echinococcus granulosus intermediate filament protein 0.0053 0.0421 0.1632
Echinococcus granulosus ecdysone induced protein 78C 0.0035 0.0212 0.0787
Toxoplasma gondii E1-E2 ATPase subfamily protein 0.0021 0.004 0.0039
Echinococcus granulosus lamin 0.0053 0.0421 0.1632
Onchocerca volvulus 0.0053 0.0421 0.0828
Schistosoma mansoni hypothetical protein 0.0037 0.0226 0.0209
Schistosoma mansoni nuclear hormone receptor 0.0035 0.0212 0.0195
Plasmodium vivax glucose-6-phosphate 1-dehydrogenase, putative 0.0124 0.125 1
Loa Loa (eye worm) intermediate filament protein 0.0053 0.0421 0.154
Schistosoma mansoni sodium/potassium-dependent atpase beta subunit 0.0064 0.0543 0.0526
Echinococcus multilocularis COUP TF:Svp nuclear hormone receptor 0.0035 0.0212 0.0787
Trypanosoma cruzi P-type H+-ATPase, putative 0.0027 0.0117 0.0937
Leishmania major vacuolar-type Ca2 -ATPase, putative 0.0059 0.0484 0.3692
Onchocerca volvulus 0.0064 0.0543 0.1309
Brugia malayi Nuclear hormone receptor family member nhr-3 0.0035 0.0212 0.0716
Brugia malayi Intermediate filament tail domain containing protein 0.0053 0.0421 0.1484
Leishmania major P-type H -ATPase, putative 0.0027 0.0117 0.0673
Trypanosoma brucei vacuolar-type Ca2+-ATPase, putative 0.0059 0.0484 0.3692
Leishmania major calcium-translocating P-type ATPase 0.0044 0.0317 0.2319
Brugia malayi haloacid dehalogenase-like hydrolase family protein 0.0025 0.009 0.0266
Loa Loa (eye worm) nuclear hormone receptor family member nhr-49 0.0035 0.0212 0.0776
Giardia lamblia Potassium-transporting ATPase alpha chain 1 0.0039 0.0254 0.1796
Loa Loa (eye worm) hypothetical protein 0.0035 0.0207 0.0756
Schistosoma mansoni steroid hormone receptor ad4bp 0.0035 0.0212 0.0195
Loa Loa (eye worm) hypothetical protein 0.0035 0.0212 0.0776
Echinococcus multilocularis sodium:potassium dependent atpase beta subunit 0.0064 0.0543 0.2123
Loa Loa (eye worm) hypothetical protein 0.0019 0.0018 0.0065
Brugia malayi E1-E2 ATPase family protein 0.0028 0.0131 0.0414
Brugia malayi intermediate filament protein 0.0053 0.0421 0.1484
Loa Loa (eye worm) steroid hormone receptor 0.0035 0.0212 0.0776
Echinococcus multilocularis nervana 2 0.0064 0.0543 0.2123
Loa Loa (eye worm) hypothetical protein 0.0026 0.01 0.0365
Loa Loa (eye worm) hypothetical protein 0.0035 0.0212 0.0776
Loa Loa (eye worm) nuclear hormone receptor family member nhr-1 0.0035 0.0212 0.0776
Echinococcus granulosus survival motor neuron protein 1 0.0231 0.2491 1
Brugia malayi glucose-6-phosphate dehydrogenase 0.0124 0.125 0.4532
Loa Loa (eye worm) hypothetical protein 0.0053 0.0424 0.1549
Echinococcus multilocularis survival motor neuron protein 1 0.0231 0.2491 1
Loa Loa (eye worm) intermediate filament tail domain-containing protein 0.0053 0.0421 0.154
Mycobacterium ulcerans glucose-6-phosphate 1-dehydrogenase 0.0124 0.125 0.4862
Echinococcus multilocularis musashi 0.0053 0.0421 0.1632
Entamoeba histolytica plasma membrane calcium-transporting ATPase 1, putative 0.0038 0.0244 0.4703
Echinococcus granulosus nervana 2 0.0064 0.0543 0.2123
Echinococcus multilocularis thyroid hormone receptor alpha 0.0035 0.0212 0.0787
Loa Loa (eye worm) hypothetical protein 0.0035 0.0212 0.0776
Brugia malayi hypothetical protein 0.0231 0.2491 0.9095
Plasmodium vivax P-type ATPase4, putative 0.0045 0.033 0.2429
Echinococcus multilocularis lamin 0.0053 0.0421 0.1632
Schistosoma mansoni ap endonuclease 0.002 0.0035 0.0017
Brugia malayi Calcium-transporting ATPase sarcoplasmic/endoplasmic reticulum type 0.004 0.0264 0.0905
Schistosoma mansoni calcium-transporting atpase 2 (atpase 2) 0.0039 0.0254 0.0236
Leishmania major glucose-6-phosphate 1-dehydrogenase, putative 0.0124 0.125 1
Echinococcus multilocularis lamin dm0 0.0053 0.0421 0.1632
Loa Loa (eye worm) hypothetical protein 0.0045 0.033 0.1208
Loa Loa (eye worm) hypothetical protein 0.0025 0.0089 0.0324
Toxoplasma gondii sarco/endoplasmic reticulum Ca2+-ATPase 0.0045 0.033 0.2429
Schistosoma mansoni ATP synthase F0 subunit 6 0.0234 0.2534 0.252
Leishmania major calcium motive p-type ATPase, putative 0.004 0.0264 0.1881
Brugia malayi Sodium/potassium-transporting ATPase alpha chain, putative 0.003 0.0154 0.0501
Onchocerca volvulus 0.0053 0.0421 0.0828
Loa Loa (eye worm) hypothetical protein 0.0035 0.0212 0.0776
Schistosoma mansoni hypothetical protein 0.0183 0.1934 0.1919
Brugia malayi steroid hormone receptor 0.0035 0.0212 0.0716
Trypanosoma cruzi Calcium ATPase SERCA-like 0.0044 0.0317 0.2536
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0035 0.0212 0.0787
Mycobacterium tuberculosis Probable ATP synthase a chain AtpB (protein 6) 0.0234 0.2534 1
Loa Loa (eye worm) Na,K-ATPase alpha subunit 0.0045 0.033 0.1208
Echinococcus multilocularis sodium:potassium dependent atpase beta subunit 0.0064 0.0543 0.2123
Schistosoma mansoni hypothetical protein 0.0158 0.1643 0.1628
Trypanosoma cruzi plasma-membrane proton-efflux P-type ATPase, putative 0.0021 0.004 0.0321
Loa Loa (eye worm) nuclear hormone receptor family member nhr-31 0.0035 0.0212 0.0776
Brugia malayi Nuclear hormone receptor family member nhr-1 0.0035 0.0212 0.0716
Brugia malayi ecdysteroid receptor 0.0035 0.0212 0.0716
Brugia malayi Sodium/potassium-transporting ATPase alpha-3 chain, putative 0.0021 0.004 0.0082
Echinococcus granulosus lamin dm0 0.0053 0.0421 0.1632
Loa Loa (eye worm) hypothetical protein 0.0039 0.0254 0.0929
Loa Loa (eye worm) calcium ATPase 0.0039 0.0257 0.094
Schistosoma mansoni transmemberane protein 0.0064 0.0543 0.0526
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0035 0.0212 0.0716
Loa Loa (eye worm) glucose-6-phosphate dehydrogenase 0.0124 0.125 0.4568
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0035 0.0212 0.0787
Echinococcus multilocularis DNA (apurinic or apyrimidinic site) lyase 0.002 0.0035 0.0071
Brugia malayi nuclear receptor NHR-88 0.0035 0.0212 0.0716
Trypanosoma cruzi apurinic/apyrimidinic endonuclease, putative 0.002 0.0035 0.0283
Loa Loa (eye worm) hypothetical protein 0.0019 0.0018 0.0065
Schistosoma mansoni survival motor neuron protein 0.0047 0.0349 0.0332
Trypanosoma cruzi calcium motive p-type ATPase, putative 0.004 0.0264 0.2111
Onchocerca volvulus 0.0047 0.0349 0.054
Schistosoma mansoni Tr4/Tr2 (homologue) 0.0035 0.0212 0.0195
Giardia lamblia Plasma membrane calcium-transporting ATPase 2 0.0038 0.024 0.1685
Loa Loa (eye worm) hypothetical protein 0.0019 0.0018 0.0065
Echinococcus granulosus plasma membrane calcium transporting ATPase 0.0054 0.0431 0.1669
Trypanosoma brucei P-type H+-ATPase, putative 0.0027 0.0117 0.0673
Loa Loa (eye worm) hypothetical protein 0.0064 0.0543 0.1984
Echinococcus granulosus Ca2 transporting ATPase plasma membrane 0.0054 0.0431 0.1669
Loa Loa (eye worm) hypothetical protein 0.0037 0.0226 0.0827
Loa Loa (eye worm) hypothetical protein 0.0035 0.0212 0.0776
Echinococcus granulosus nervana 2 0.0064 0.0543 0.2123
Schistosoma mansoni lamin 0.0053 0.0421 0.0404
Loa Loa (eye worm) nuclear hormone receptor family member nhr-14 0.0035 0.0212 0.0776
Trypanosoma brucei vacuolar-type Ca2+-ATPase 1 0.0059 0.0484 0.3692
Schistosoma mansoni sodium/potassium-dependent atpase beta subunit 0.0064 0.0543 0.0526
Loa Loa (eye worm) hypothetical protein 0.0052 0.041 0.1498
Entamoeba histolytica Plasma membrane calcium-transporting ATPase, putative 0.0059 0.0484 1
Schistosoma mansoni hypothetical protein 0.0047 0.0349 0.0332
Schistosoma mansoni coup transcription factor 0.0035 0.0212 0.0195
Trypanosoma cruzi apurinic/apyrimidinic endonuclease 0.002 0.0035 0.0283
Echinococcus multilocularis calcium transporting ATPase type 2C member 0.0045 0.033 0.1264
Plasmodium vivax calcium-transporting ATPase, putative 0.0045 0.033 0.2429
Brugia malayi Nuclear hormone receptor family member nhr-49 0.0035 0.0212 0.0716
Schistosoma mansoni thyroid hormone receptor 0.0035 0.0212 0.0195
Schistosoma mansoni thyroid hormone receptor 0.0035 0.0212 0.0195
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0035 0.0212 0.0787
Trichomonas vaginalis cation-transporting ATPase fungi, putative 0.0059 0.0484 0.3692
Trichomonas vaginalis plasma membrane calcium-transporting ATPase, putative 0.0059 0.0484 0.3692
Entamoeba histolytica plasma membrane calcium ion-transporting ATPase, putative 0.0039 0.0257 0.4999
Mycobacterium ulcerans metal cation-transporting p-type ATPase F, CtpF 0.0045 0.033 0.1181
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0035 0.0212 0.0716
Toxoplasma gondii calcium-translocating P-type ATPase, PMCA-type protein 0.006 0.0494 0.3777
Trypanosoma brucei calcium-translocating P-type ATPase 0.004 0.0264 0.1881
Loa Loa (eye worm) hypothetical protein 0.0035 0.0212 0.0776
Entamoeba histolytica exodeoxyribonuclease III, putative 0.002 0.0035 0.0106
Loa Loa (eye worm) calcium ATPase 0.002 0.0031 0.0112
Toxoplasma gondii P-type ATPase4, putative 0.0045 0.033 0.2429
Echinococcus granulosus sarco:endoplasmic reticulum calcium ATPase 0.0044 0.0317 0.121
Trypanosoma cruzi calcium-translocating P-type ATPase, putative 0.0021 0.004 0.0321
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0035 0.0212 0.0716
Giardia lamblia Glucose-6-phosphate 1-dehydrogenase 0.0124 0.125 1
Leishmania major P-type H -ATPase, putative 0.0027 0.0117 0.0673
Schistosoma mansoni sodium / potassium ATPase beta chain 0.0875 1 1
Echinococcus multilocularis calcium transporting atpase 0.004 0.0264 0.0995
Trichomonas vaginalis plasma membrane calcium-transporting ATPase, putative 0.0059 0.0484 0.3692
Loa Loa (eye worm) hypothetical protein 0.0064 0.0543 0.1984
Echinococcus granulosus glucose 6 phosphate 1 dehydrogenase 0.0124 0.125 0.4983
Echinococcus granulosus hepatocyte nuclear factor 4 alpha 0.0035 0.0212 0.0787
Brugia malayi exodeoxyribonuclease III family protein 0.002 0.0035 0.0064

Activities

Activity type Activity value Assay description Source Reference
Potency (functional) = 2.8184 um PUBCHEM_BIOASSAY: VP16 counterscreen qHTS for inhibitors of ROR gamma transcriptional activity. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 2.9362 uM PUBCHEM_BIOASSAY: Primary qHTS for delayed death inhibitors of the malarial parasite plastid, 96 hour incubation. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488745, AID488752, AID488774, AID504848, AID504850] ChEMBL. No reference
Potency (functional) = 100 um PUBCHEM_BIOASSAY: qHTS Inhibitors of AmpC Beta-Lactamase (assay with detergent). (Class of assay: confirmatory) [Related pubchem assays: 1002 (Confirmation Concentration-Response Assay for Inhibitors of AmpC Beta-Lactamase (assay with detergent)), 585 (Promiscuous and Specific Inhibitors of AmpC Beta-Lactamase (assay without detergent) - a screen old NIH MLSMR collection), 584 (Promiscuous and Specific Inhibitors of AmpC Beta-Lactamase (assay with detergent) - a screen of the old NIH MLSMR collection), 1003 (Confirmation Cuvette-Based Assay for Inhibitors of AmpC Beta-Lactamase (assay with detergent))] ChEMBL. No reference

Phenotypes

Whole-cell/tissue/organism interactions

Species name Source Reference Is orphan
Plasmodium falciparum ChEMBL23

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

No literature references available for this target.

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