Detailed information for compound 1315747

Basic information

Technical information
  • TDR Targets ID: 1315747
  • Name: 2-(2-fluorophenyl)-5-[4-(furan-2-carbonyl)pip erazin-1-yl]-1,3-oxazole-4-carbonitrile
  • MW: 366.346 | Formula: C19H15FN4O3
  • H donors: 0 H acceptors: 3 LogP: 2.94 Rotable bonds: 4
    Rule of 5 violations (Lipinski): 1
  • SMILES: N#Cc1nc(oc1N1CCN(CC1)C(=O)c1ccco1)c1ccccc1F
  • InChi: 1S/C19H15FN4O3/c20-14-5-2-1-4-13(14)17-22-15(12-21)19(27-17)24-9-7-23(8-10-24)18(25)16-6-3-11-26-16/h1-6,11H,7-10H2
  • InChiKey: HFWHCSWCUNUQMC-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • 2-(2-fluorophenyl)-5-[4-(furan-2-carbonyl)piperazin-1-yl]oxazole-4-carbonitrile
  • 2-(2-fluorophenyl)-5-[4-(2-furyl-oxomethyl)-1-piperazinyl]-4-oxazolecarbonitrile
  • 2-(2-fluorophenyl)-5-(4-furan-2-ylcarbonylpiperazin-1-yl)-1,3-oxazole-4-carbonitrile
  • ZINC06698091
  • STOCK6S-11587

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens lysine (K)-specific methyltransferase 2A Starlite/ChEMBL No references
Homo sapiens multiple endocrine neoplasia I No references
Homo sapiens SMAD family member 2 Starlite/ChEMBL No references

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Brugia malayi MH2 domain containing protein Get druggable targets OG5_131716 All targets in OG5_131716
Echinococcus granulosus dnaJ subfamily B Get druggable targets OG5_133913 All targets in OG5_133913
Schistosoma mansoni hypothetical protein Get druggable targets OG5_133913 All targets in OG5_133913
Echinococcus multilocularis dnaJ subfamily B Get druggable targets OG5_133913 All targets in OG5_133913
Schistosoma mansoni mixed-lineage leukemia protein mll Get druggable targets OG5_130642 All targets in OG5_130642
Neospora caninum Multidomain chromatinic protein with the following architecture: 3x PHD-bromo-3xPHD-SET domain and associated cysteine cluster a Get druggable targets OG5_130642 All targets in OG5_130642
Loa Loa (eye worm) MH2 domain-containing protein Get druggable targets OG5_131716 All targets in OG5_131716
Loa Loa (eye worm) transcription factor SMAD2 Get druggable targets OG5_131716 All targets in OG5_131716
Schistosoma japonicum ko:K09188 myeloid/lymphoid or mixed-lineage leukemia protein 3, putative Get druggable targets OG5_130642 All targets in OG5_130642
Toxoplasma gondii histone lysine methyltransferase SET1 Get druggable targets OG5_130642 All targets in OG5_130642
Schistosoma japonicum Menin, putative Get druggable targets OG5_133913 All targets in OG5_133913
By sequence similarity to non orthologous known druggable targets
Species Potential target Known druggable target Length Alignment span Identity
Brugia malayi MH2 domain containing protein SMAD family member 2 467 aa 405 aa 31.6 %
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD2 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0023 0.0314 1
Loa Loa (eye worm) hypothetical protein 0.0016 0.0154 0.0325
Entamoeba histolytica T-complex protein 1 beta subunit, putative 0.0028 0.0402 1
Brugia malayi PHD-finger family protein 0.0013 0.0098 0.0208
Loa Loa (eye worm) hypothetical protein 0.0034 0.0524 0.1109
Echinococcus granulosus Smad4 0.001 0.0036 0.0036
Leishmania major 4-coumarate:coa ligase-like protein 0.0023 0.0314 0.7479
Brugia malayi AMP-binding enzyme family protein 0.0023 0.0314 0.0665
Schistosoma mansoni phosphatidylserine receptor 0.0011 0.0055 0.0055
Brugia malayi Bromodomain containing protein 0.0033 0.0518 0.1095
Entamoeba histolytica acyl-CoA synthetase, putative 0.0023 0.0314 0.5316
Schistosoma mansoni TGF-beta signal transducer Smad2 0.001 0.0036 0.0036
Plasmodium falciparum acyl-CoA synthetase 0.0017 0.0193 0.2983
Mycobacterium ulcerans exodeoxyribonuclease III protein XthA 0.0019 0.0215 0.1822
Schistosoma mansoni chaperonin containing t-complex protein 1 beta subunit tcpb 0.0028 0.0402 0.0402
Leishmania major 4-coumarate:coa ligase-like protein 0.0023 0.0314 0.7479
Plasmodium vivax acyl-CoA synthetase, putative 0.0017 0.0193 0.2791
Loa Loa (eye worm) CXXC zinc finger family protein 0.0035 0.0548 0.1159
Echinococcus granulosus histone lysine N methyltransferase MLL3 0.0012 0.0081 0.0081
Brugia malayi jmjC domain containing protein 0.0011 0.0055 0.0116
Onchocerca volvulus 0.0035 0.0548 0.1014
Echinococcus granulosus 5'partial|histone lysine N methyltransferase SETDB2 0.0033 0.0508 0.0508
Trypanosoma brucei apurinic/apyrimidinic endonuclease, putative 0.0019 0.0215 0.4618
Brugia malayi exodeoxyribonuclease III family protein 0.0019 0.0215 0.0455
Echinococcus multilocularis lysine specific demethylase 5A 0.004 0.0662 0.0662
Schistosoma mansoni jumonji/arid domain-containing protein 0.0042 0.0702 0.0702
Schistosoma mansoni smad1 5 8 and 0.001 0.0036 0.0036
Brugia malayi T-complex protein 1, beta subunit 0.0028 0.0402 0.085
Toxoplasma gondii t-complex protein beta subunit 0.0028 0.0402 0.2998
Loa Loa (eye worm) transcription factor SMAD2 0.0144 0.2801 0.5923
Loa Loa (eye worm) MH2 domain-containing protein 0.001 0.0036 0.0077
Toxoplasma gondii histone lysine methyltransferase SET/SUV39 0.0035 0.055 0.4276
Loa Loa (eye worm) pre-SET domain-containing protein family protein 0.0238 0.473 1
Echinococcus multilocularis cpg binding protein 0.0037 0.0589 0.0589
Echinococcus multilocularis PHD finger protein rhinoceros 0.0033 0.0518 0.0518
Echinococcus multilocularis Smad4 0.001 0.0036 0.0036
Echinococcus multilocularis chaperonin containing TCP1, subunit 2 (beta) 0.0028 0.0402 0.0402
Plasmodium vivax hypothetical protein, conserved 0.0033 0.0518 0.9354
Trypanosoma brucei T-complex protein 1, beta subunit, putative 0.0028 0.0402 1
Schistosoma mansoni cpg binding protein 0.0037 0.0589 0.0589
Schistosoma mansoni smad 0.001 0.0036 0.0036
Schistosoma mansoni bromodomain-containing nuclear protein 1 brd1 0.0033 0.0518 0.0518
Loa Loa (eye worm) T-complex protein 1 0.0028 0.0402 0.085
Echinococcus multilocularis phd:f box containing protein 0.0011 0.0055 0.0055
Loa Loa (eye worm) hypothetical protein 0.0017 0.0193 0.0408
Loa Loa (eye worm) jmjC domain-containing protein 0.0011 0.0055 0.0116
Echinococcus granulosus GPCR family 2 0.0016 0.0154 0.0154
Loa Loa (eye worm) hypothetical protein 0.0023 0.0314 0.0665
Schistosoma mansoni hypothetical protein 0.0016 0.0154 0.0154
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0045 0.0761 0.1608
Leishmania major T-complex protein 1, beta subunit, putative 0.0028 0.0402 1
Echinococcus multilocularis geminin 0.0174 0.341 0.341
Schistosoma mansoni histone-lysine n-methyltransferase suv9 0.0035 0.055 0.055
Loa Loa (eye worm) hypothetical protein 0.0011 0.0055 0.0116
Schistosoma mansoni hypothetical protein 0.0016 0.0154 0.0154
Echinococcus multilocularis histone lysine methyltransferase setb histone lysine methyltransferase eggless 0.0035 0.055 0.055
Brugia malayi MH2 domain containing protein 0.001 0.0036 0.0077
Echinococcus multilocularis mothers against decapentaplegic 5 0.001 0.0036 0.0036
Brugia malayi MH1 domain containing protein 0.001 0.0036 0.0077
Echinococcus multilocularis mixed lineage leukemia protein mll 0.001 0.0037 0.0037
Echinococcus granulosus histone lysine methyltransferase setb 0.0035 0.055 0.055
Mycobacterium ulcerans fatty-acid-CoA ligase 0.0023 0.0314 1
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.0016 0.0154 0.0154
Echinococcus granulosus jumonji domain containing protein 0.0046 0.0786 0.0786
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0045 0.0761 0.0761
Echinococcus granulosus peregrin 0.0033 0.0518 0.0518
Loa Loa (eye worm) MH1 domain-containing protein 0.001 0.0036 0.0077
Echinococcus granulosus lysine specific demethylase 5A 0.0042 0.0702 0.0702
Brugia malayi CXXC zinc finger family protein 0.0035 0.0548 0.1159
Toxoplasma gondii PHD-finger domain-containing protein 0.0033 0.0518 0.4
Loa Loa (eye worm) MH2 domain-containing protein 0.0144 0.2801 0.5923
Echinococcus multilocularis JmjC domain containing protein 4 0.0011 0.0055 0.0055
Loa Loa (eye worm) hypothetical protein 0.0023 0.0314 0.0665
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0049 0.0844 0.1784
Schistosoma mansoni chaperonin containing t-complex protein 1 beta subunit tcpb 0.0028 0.0402 0.0402
Mycobacterium ulcerans long-chain fatty-acid CoA ligase 0.0023 0.0314 1
Echinococcus granulosus cadherin EGF LAG seven pass G type receptor 0.0016 0.0154 0.0154
Echinococcus multilocularis Transcription factor, JmjC domain containing protein 0.0109 0.2073 0.2073
Schistosoma mansoni phd/f-box containing protein 0.0011 0.0055 0.0055
Schistosoma mansoni ap endonuclease 0.0019 0.0215 0.0215
Brugia malayi Smad1 0.001 0.0036 0.0077
Brugia malayi Pre-SET motif family protein 0.0035 0.055 0.1162
Trichomonas vaginalis set domain proteins, putative 0.0271 0.5404 1
Schistosoma mansoni smad1 5 8 and 0.001 0.0036 0.0036
Brugia malayi Latrophilin receptor protein 2 0.0016 0.0154 0.0325
Echinococcus granulosus mothers against decapentaplegic 5 0.001 0.0036 0.0036
Plasmodium vivax SET domain protein, putative 0.0035 0.055 1
Brugia malayi T-complex protein 1, beta subunit 0.0028 0.0402 0.085
Loa Loa (eye worm) hypothetical protein 0.0017 0.0193 0.0408
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0035 0.055 0.055
Brugia malayi Calcitonin receptor-like protein seb-1 0.0049 0.0844 0.1784
Schistosoma mansoni hypothetical protein 0.0174 0.341 0.341
Echinococcus multilocularis TGF beta signal transducer SmadC 0.001 0.0036 0.0036
Echinococcus granulosus Jumonji AT rich interactive domain 1B 0.0013 0.0096 0.0096
Loa Loa (eye worm) jmjC domain-containing protein 0.0069 0.1246 0.2634
Echinococcus granulosus PHD finger protein rhinoceros 0.0033 0.0518 0.0518
Trichomonas vaginalis chaperonin, putative 0.0028 0.0402 0.036
Echinococcus multilocularis jumonji domain containing 1A 0.0011 0.0055 0.0055
Mycobacterium tuberculosis Probable exodeoxyribonuclease III protein XthA (exonuclease III) (EXO III) (AP endonuclease VI) 0.0019 0.0215 0.2958
Echinococcus granulosus mixed lineage leukemia protein mll 0.001 0.0037 0.0037
Echinococcus multilocularis histone lysine N methyltransferase SETMAR 0.0035 0.055 0.055
Loa Loa (eye worm) hypothetical protein 0.0033 0.0518 0.1095
Chlamydia trachomatis acylglycerophosphoethanolamine acyltransferase 0.0017 0.0193 0.5
Echinococcus granulosus DNA apurinic or apyrimidinic site lyase 0.0019 0.0215 0.0215
Leishmania major 4-coumarate:coa ligase-like protein 0.0023 0.0314 0.7479
Brugia malayi jmjC domain containing protein 0.0011 0.0055 0.0116
Schistosoma mansoni jumonji domain containing protein 0.0086 0.1613 0.1613
Loa Loa (eye worm) Smad1 0.001 0.0036 0.0077
Loa Loa (eye worm) latrophilin receptor protein 2 0.0016 0.0154 0.0325
Plasmodium falciparum AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.0019 0.0215 0.3461
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0045 0.0761 0.0761
Loa Loa (eye worm) jmjC domain-containing protein 0.0042 0.0702 0.1485
Schistosoma mansoni hypothetical protein 0.0011 0.0058 0.0058
Brugia malayi AMP-binding enzyme family protein 0.0023 0.0314 0.0665
Echinococcus granulosus TGF beta signal transducer SmadC 0.001 0.0036 0.0036
Mycobacterium ulcerans acyl-CoA synthetase 0.0023 0.0314 1
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0049 0.0844 0.1784
Trypanosoma brucei PHD-zinc-finger like domain containing protein, putative 0.0011 0.0058 0.008
Onchocerca volvulus 0.0271 0.5404 1
Schistosoma mansoni jumonji domain containing protein 0.0011 0.0055 0.0055
Onchocerca volvulus 0.0023 0.0314 0.0582
Brugia malayi AMP-binding enzyme family protein 0.0023 0.0314 0.0665
Brugia malayi jmjC domain containing protein 0.0042 0.0702 0.1485
Loa Loa (eye worm) hypothetical protein 0.0057 0.1006 0.2127
Brugia malayi F/Y-rich N-terminus family protein 0.0023 0.0301 0.0637
Echinococcus multilocularis DNA (apurinic or apyrimidinic site) lyase 0.0019 0.0215 0.0215
Mycobacterium ulcerans acyl-CoA synthetase 0.0023 0.0314 1
Loa Loa (eye worm) hypothetical protein 0.0035 0.055 0.1162
Echinococcus multilocularis lysine specific demethylase 6a 0.0011 0.0055 0.0055
Mycobacterium leprae PROBABLE FATTY-ACID-CoA LIGASE FADD2 (FATTY-ACID-CoA SYNTHETASE) (FATTY-ACID-CoA SYNTHASE) 0.0023 0.0314 0.5
Wolbachia endosymbiont of Brugia malayi exonuclease III 0.0019 0.0215 0.5
Mycobacterium leprae PROBABLE FATTY-ACID-CoA LIGASE FADD7 (FATTY-ACID-CoA SYNTHETASE) (FATTY-ACID-CoA SYNTHASE) 0.0023 0.0314 0.5
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0045 0.0761 0.0761
Loa Loa (eye worm) histone methyltransferase 0.0012 0.0081 0.0171
Brugia malayi PHD-finger family protein 0.0033 0.0518 0.1095
Echinococcus multilocularis histone lysine N methyltransferase MLL3 0.001 0.0037 0.0037
Plasmodium falciparum T-complex protein 1 subunit beta 0.0028 0.0402 0.7494
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0045 0.0761 0.0761
Toxoplasma gondii WD domain, G-beta repeat-containing protein 0.0011 0.0058 0.0024
Entamoeba histolytica acyl-coA synthetase, putative 0.0023 0.0314 0.5316
Brugia malayi AF-10 protein 0.0011 0.0058 0.0122
Loa Loa (eye worm) exodeoxyribonuclease III family protein 0.0019 0.0215 0.0455
Leishmania major apurinic/apyrimidinic endonuclease-redox protein 0.0019 0.0215 0.4618
Plasmodium vivax AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.0019 0.0215 0.3237
Brugia malayi latrophilin 2 splice variant baaae 0.0034 0.0524 0.1109
Loa Loa (eye worm) PHD-finger family protein 0.0033 0.0518 0.1095
Echinococcus granulosus smad 0.001 0.0036 0.0036
Toxoplasma gondii PHD-finger domain-containing protein 0.0033 0.0518 0.4
Mycobacterium ulcerans acyl-CoA synthetase 0.0023 0.0314 1
Mycobacterium tuberculosis Probable chain -fatty-acid-CoA ligase FadD13 (fatty-acyl-CoA synthetase) 0.0023 0.0314 1
Echinococcus multilocularis Jumonji, AT rich interactive domain 1B 0.0013 0.0096 0.0096
Loa Loa (eye worm) hypothetical protein 0.0017 0.0193 0.0408
Brugia malayi jmjC domain containing protein 0.0011 0.0055 0.0116
Schistosoma mansoni hypothetical protein 0.0034 0.0524 0.0524
Schistosoma mansoni chaperonin containing t-complex protein 1 beta subunit tcpb 0.0028 0.0402 0.0402
Giardia lamblia TCP-1 chaperonin subunit beta 0.0028 0.0402 0.6168
Trypanosoma cruzi apurinic/apyrimidinic endonuclease 0.0019 0.0215 0.4618
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0035 0.055 0.055
Trypanosoma cruzi apurinic/apyrimidinic endonuclease, putative 0.0019 0.0215 0.4618
Mycobacterium ulcerans long-chain-fatty-acid--CoA ligase 0.0023 0.0314 1
Loa Loa (eye worm) hypothetical protein 0.0017 0.0193 0.0408
Treponema pallidum exodeoxyribonuclease (exoA) 0.0019 0.0215 0.5
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0045 0.0761 0.0761
Mycobacterium ulcerans hypothetical protein 0.0023 0.0314 1
Echinococcus granulosus histone lysine N methyltransferase MLL3 0.001 0.0037 0.0037
Brugia malayi MH2 domain containing protein 0.001 0.0036 0.0077
Toxoplasma gondii histone lysine methyltransferase SET1 0.0067 0.1212 1
Echinococcus granulosus geminin 0.0174 0.341 0.341
Schistosoma mansoni jumonji/arid domain-containing protein 0.0042 0.0702 0.0702
Echinococcus granulosus JmjC domain containing protein 4 0.0011 0.0055 0.0055
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0045 0.0761 0.1608
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0021 0.0261 0.0261
Echinococcus granulosus cpg binding protein 0.0037 0.0589 0.0589
Schistosoma mansoni hypothetical protein 0.0016 0.0154 0.0154
Brugia malayi jmjC domain containing protein 0.0109 0.2073 0.4383
Schistosoma mansoni smad1 5 8 and 0.001 0.0036 0.0036
Giardia lamblia PHD finger protein 15 0.0033 0.0518 1
Entamoeba histolytica acyl-CoA synthetase, putative 0.0023 0.0314 0.5316
Echinococcus granulosus chaperonin containing TCP1 subunit 2 beta 0.0028 0.0402 0.0402
Onchocerca volvulus 0.0035 0.055 0.1017
Echinococcus multilocularis peregrin 0.0033 0.0518 0.0518
Toxoplasma gondii exonuclease III APE 0.0019 0.0215 0.1384
Brugia malayi Pre-SET motif family protein 0.0238 0.473 1
Echinococcus multilocularis histone lysine N methyltransferase MLL3 0.0012 0.0081 0.0081
Onchocerca volvulus Alhambra homolog 0.0033 0.0518 0.0958
Echinococcus multilocularis cadherin EGF LAG seven pass G type receptor 0.0016 0.0154 0.0154
Schistosoma mansoni protein phosphatase 2C 0.0011 0.0055 0.0055
Plasmodium falciparum conserved Plasmodium membrane protein, unknown function 0.0013 0.0101 0.1
Schistosoma mansoni cpg binding protein 0.0037 0.0589 0.0589
Brugia malayi jmjC domain containing protein 0.0011 0.0055 0.0116
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0075 0.1374 0.1374
Plasmodium vivax hypothetical protein, conserved 0.0013 0.0101 0.0936
Trypanosoma brucei PHD-zinc-finger like domain containing protein, putative 0.0011 0.0058 0.008
Echinococcus multilocularis GPCR, family 2 0.0016 0.0154 0.0154
Schistosoma mansoni ubiquitously transcribed sex (X/Y) chromosome tetratricopeptide repeat protein-related 0.0011 0.0055 0.0055
Toxoplasma gondii PHD-finger domain-containing protein 0.0011 0.0058 0.0024
Echinococcus granulosus Transcription factor JmjC domain containing protein 0.0109 0.2073 0.2073
Mycobacterium tuberculosis Fatty-acid-AMP ligase FadD30 (fatty-acid-AMP synthetase) (fatty-acid-AMP synthase) 0.0017 0.0193 0.139
Brugia malayi MH1 domain containing protein 0.001 0.0036 0.0077
Schistosoma mansoni cpg binding protein 0.0035 0.0548 0.0548
Loa Loa (eye worm) jmjC domain-containing protein 0.0011 0.0055 0.0116
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0035 0.055 0.055
Trichomonas vaginalis chaperonin-60kD, ch60, putative 0.0028 0.0402 0.036
Schistosoma mansoni hypothetical protein 0.0174 0.341 0.341
Schistosoma mansoni Smad4 0.001 0.0036 0.0036
Schistosoma mansoni hypothetical protein 0.0033 0.0518 0.0518
Echinococcus granulosus phd:f box containing protein 0.0011 0.0055 0.0055
Schistosoma mansoni ap endonuclease 0.0019 0.0215 0.0215
Echinococcus granulosus lysine specific demethylase 6a 0.0011 0.0055 0.0055
Echinococcus multilocularis jumonji domain containing protein 0.0046 0.0786 0.0786
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.0016 0.0154 0.0154
Echinococcus multilocularis smad 0.001 0.0036 0.0036
Loa Loa (eye worm) hypothetical protein 0.0049 0.0844 0.1784
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0045 0.0761 0.0761
Brugia malayi MH2 domain containing protein 0.0144 0.2801 0.5923
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.0016 0.0154 0.0325
Loa Loa (eye worm) hypothetical protein 0.0023 0.0314 0.0665
Loa Loa (eye worm) jmjC domain-containing protein 0.0011 0.0055 0.0116
Plasmodium falciparum phd finger protein, putative 0.0033 0.0518 1
Loa Loa (eye worm) hypothetical protein 0.0011 0.0055 0.0116
Schistosoma mansoni hypothetical protein 0.0016 0.0154 0.0154
Loa Loa (eye worm) hypothetical protein 0.0017 0.0193 0.0408
Echinococcus granulosus jumonji domain containing 1A 0.0011 0.0055 0.0055
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0045 0.0761 0.0761
Trypanosoma cruzi T-complex protein 1, beta subunit, putative 0.0028 0.0402 1
Plasmodium vivax T-complex protein 1 subunit beta, putative 0.0028 0.0402 0.701
Mycobacterium ulcerans long-chain-fatty-acid-CoA ligase 0.0023 0.0314 1
Loa Loa (eye worm) hypothetical protein 0.0013 0.0098 0.0208

Activities

Activity type Activity value Assay description Source Reference
Potency (functional) 5.6234 uM PUBCHEM_BIOASSAY: qHTS for Inhibitors of TGF-b. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID588856, AID588860] ChEMBL. No reference
Potency (functional) 5.6234 uM PUBCHEM_BIOASSAY: qHTS for Inhibitors of TGF-b: Cytotox Counterscreen. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID588855, AID588860] ChEMBL. No reference
Potency (functional) = 7.0795 um PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors Targeting the Menin-MLL Interaction in MLL Related Leukemias: Competition With Texas Red Labeled MLL-derived Mutant Peptide. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 13.1154 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) 39.8107 uM PubChem BioAssay. qHTS Assay for Activators of ClpP. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 44.6684 uM PUBCHEM_BIOASSAY: qHTS Assay for Substrates of Mammalian Selenoprotein Thioredoxin Reductase 1 (TrxR1): qHTS. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488771] ChEMBL. No reference
Potency (functional) 50.1187 uM PubChem BioAssay. qHTS for Agonist of gsp, the Etiologic Mutation Responsible for Fibrous Dysplasia/McCune-Albright Syndrome: qHTS. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 70.7946 uM PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of BAZ2B. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID504391] ChEMBL. No reference

Phenotypes

Whole-cell/tissue/organism interactions

Species name Source Reference Is orphan
Homo sapiens ChEMBL23
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.
 
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External resources for this compound

Bibliographic References

No literature references available for this target.

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