Detailed information for compound 1417673

Basic information

Technical information
  • TDR Targets ID: 1417673
  • Name: methyl 3-(morpholine-4-carbonyl)-2,4-di(pheny l)cyclobutane-1-carboxylate
  • MW: 379.449 | Formula: C23H25NO4
  • H donors: 0 H acceptors: 2 LogP: 2.45 Rotable bonds: 6
    Rule of 5 violations (Lipinski): 1
  • SMILES: COC(=O)C1C(c2ccccc2)C(C1c1ccccc1)C(=O)N1CCOCC1
  • InChi: 1S/C23H25NO4/c1-27-23(26)21-18(16-8-4-2-5-9-16)20(19(21)17-10-6-3-7-11-17)22(25)24-12-14-28-15-13-24/h2-11,18-21H,12-15H2,1H3
  • InChiKey: HFJKDTBIAOUSBU-UHFFFAOYSA-N  


Substructure search Similarity search

Network

Hover on a compound node to display the structore

Synonyms

  • 3-(morpholino-oxomethyl)-2,4-di(phenyl)-1-cyclobutanecarboxylic acid methyl ester
  • 3-(morpholine-4-carbonyl)-2,4-di(phenyl)cyclobutane-1-carboxylic acid methyl ester
  • methyl 3-morpholin-4-ylcarbonyl-2,4-di(phenyl)cyclobutane-1-carboxylate
  • Oprea1_338088
  • BAS 02056505
  • Oprea1_116351
  • 3-(Morpholine-4-carbonyl)-2,4-diphenyl-cyclobutanecarboxylic acid methyl ester
  • MLS000070554
  • SMR000010996

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens ATM serine/threonine kinase Starlite/ChEMBL No references
Homo sapiens thyroid stimulating hormone receptor Starlite/ChEMBL No references
Homo sapiens GNAS complex locus Starlite/ChEMBL No references

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative Get druggable targets OG5_131088 All targets in OG5_131088
Schistosoma japonicum ko:K04632 guanine nucleotide binding protein (G protein), alpha stimulating, putative Get druggable targets OG5_131088 All targets in OG5_131088
Toxoplasma gondii FATC domain-containing protein Get druggable targets OG5_128955 All targets in OG5_128955
Trypanosoma cruzi phosphatidylinositol kinase related protein, putative Get druggable targets OG5_128955 All targets in OG5_128955
Brugia malayi follicle stimulating hormone receptor Get druggable targets OG5_130089 All targets in OG5_130089
Echinococcus granulosus guanine nucleotide binding protein Gs subunit Get druggable targets OG5_131088 All targets in OG5_131088
Candida albicans similar to putative phosphatidylinositol kinase involved in telomere length regulation Get druggable targets OG5_128955 All targets in OG5_128955
Leishmania mexicana phosphatidylinositol 3-kinase-like protein Get druggable targets OG5_128955 All targets in OG5_128955
Candida albicans identical to the C terminus of CaP19.5580 potential phosphatidylinositol kinase Get druggable targets OG5_128955 All targets in OG5_128955
Leishmania major phosphatidylinositol kinase related protein, putative Get druggable targets OG5_128955 All targets in OG5_128955
Loa Loa (eye worm) follicle stimulating hormone receptor Get druggable targets OG5_130089 All targets in OG5_130089
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit Get druggable targets OG5_131088 All targets in OG5_131088
Trypanosoma cruzi phosphatidylinositol kinase related protein, putative Get druggable targets OG5_128955 All targets in OG5_128955
Trypanosoma cruzi phosphatidylinositol kinase related protein, putative Get druggable targets OG5_128955 All targets in OG5_128955
Echinococcus multilocularis serine protein kinase ATM Get druggable targets OG5_128955 All targets in OG5_128955
Echinococcus granulosus serine protein kinase ATM Get druggable targets OG5_128955 All targets in OG5_128955
Leishmania donovani phosphatidylinositol 3-kinase-like protein Get druggable targets OG5_128955 All targets in OG5_128955
Trichomonas vaginalis PIKK family atypical protein kinase Get druggable targets OG5_128955 All targets in OG5_128955
Trypanosoma brucei phosphatidylinositol kinase related protein, putative Get druggable targets OG5_128955 All targets in OG5_128955
Schistosoma japonicum IPR000971,Globin;IPR012292,Globin-related;IPR009050,Globin-like,domain-containing Get druggable targets OG5_128955 All targets in OG5_128955
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) Get druggable targets OG5_131088 All targets in OG5_131088
Leishmania infantum phosphatidylinositol kinase related protein, putative Get druggable targets OG5_128955 All targets in OG5_128955
Schistosoma japonicum hypothetical protein Get druggable targets OG5_128955 All targets in OG5_128955
Entamoeba histolytica hypothetical protein Get druggable targets OG5_128955 All targets in OG5_128955
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit Get druggable targets OG5_131088 All targets in OG5_131088
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) Get druggable targets OG5_131088 All targets in OG5_131088
Candida albicans similar to putative phosphatidylinositol kinase involved in telomere length regulation Get druggable targets OG5_128955 All targets in OG5_128955
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain Get druggable targets OG5_131088 All targets in OG5_131088
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_128955 All targets in OG5_128955
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) Get druggable targets OG5_131088 All targets in OG5_131088
Leishmania braziliensis phosphatidylinositol kinase related protein, putative Get druggable targets OG5_128955 All targets in OG5_128955
Schistosoma japonicum hypothetical protein Get druggable targets OG5_128955 All targets in OG5_128955
Neospora caninum phosphatidylinositol 3- and 4-kinase domain- containing protein, putative Get druggable targets OG5_128955 All targets in OG5_128955
Trypanosoma brucei gambiense phosphatidylinositol kinase domain protein, putative Get druggable targets OG5_128955 All targets in OG5_128955
Echinococcus granulosus guanine nucleotide binding protein Gs subunit Get druggable targets OG5_131088 All targets in OG5_131088
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein Get druggable targets OG5_128955 All targets in OG5_128955
Schistosoma japonicum ko:K04728 ataxia telangectasia mutated family protein, putative Get druggable targets OG5_128955 All targets in OG5_128955
Schistosoma mansoni ataxia telangiectasia mutated (atm) Get druggable targets OG5_128955 All targets in OG5_128955
By sequence similarity to non orthologous known druggable targets
Species Potential target Known druggable target Length Alignment span Identity
Schistosoma mansoni GTP-binding protein alpha subunit gna GNAS complex locus 394 aa 450 aa 28.7 %
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Echinococcus granulosus cadherin EGF LAG seven pass G type receptor 0.0095 0.2872 0.4427
Loa Loa (eye worm) inositol-1 0.0041 0.0987 0.0943
Schistosoma mansoni hypothetical protein 0.0206 0.6701 1
Toxoplasma gondii FATC domain-containing protein 0.003 0.0613 0.1147
Loa Loa (eye worm) hypothetical protein 0.0029 0.0595 0.0549
Mycobacterium tuberculosis Probable ATP-dependent CLP protease proteolytic subunit 1 ClpP1 (endopeptidase CLP) 0.0102 0.3109 1
Trichomonas vaginalis PIKK family atypical protein kinase 0.0022 0.033 0.0313
Loa Loa (eye worm) follicle stimulating hormone receptor 0.028 0.9266 0.9263
Schistosoma mansoni ataxia telangiectasia mutated (atm)-related 0.0022 0.033 0.0492
Echinococcus granulosus serine protein kinase ATM 0.003 0.0613 0.0756
Trichomonas vaginalis PIKK family atypical protein kinase 0.0022 0.033 0.0313
Toxoplasma gondii poly(ADP-ribose) polymerase catalytic domain-containing protein 0.0029 0.0595 0.1111
Mycobacterium leprae PROBABLE ATP-DEPENDENT CLP PROTEASE PROTEOLYTIC SUBUNIT 2 CLPP2 (ENDOPEPTIDASE CLP 2) 0.0156 0.4967 1
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0034 0.0767 0.1144
Trichomonas vaginalis PIKK family atypical protein kinase 0.0022 0.033 0.0313
Echinococcus granulosus FKBP12 rapamycin complex associated protein 0.0022 0.033 0.0296
Schistosoma mansoni chromosome transmission fidelity factor 0.0029 0.0595 0.0888
Trichomonas vaginalis PIKK family atypical protein kinase 0.0022 0.033 0.0313
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.0095 0.2872 0.2765
Plasmodium vivax ATP-dependent Clp protease proteolytic subunit, putative 0.0156 0.4967 1
Echinococcus granulosus inositol monophosphatase 1 0.0041 0.0987 0.1364
Trypanosoma brucei phosphatidylinositol 4-kinase, putative 0.0022 0.033 0.2997
Brugia malayi DKFZp564C0469 protein 0.0029 0.0595 0.0454
Mycobacterium leprae ATP-dependent Clp protease proteolytic subunit 1 0.0054 0.1432 0.1913
Schistosoma mansoni ataxia telangiectasia mutated (atm) 0.003 0.0613 0.0914
Entamoeba histolytica myo-inositol monophosphatase, putative 0.0041 0.0987 1
Entamoeba histolytica hypothetical protein 0.003 0.0613 0.4302
Trypanosoma cruzi phosphatidylinositol kinase related protein, putative 0.0022 0.0331 0.0022
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.0194 0.6303 0.6285
Trichomonas vaginalis PIKK family atypical protein kinase 0.0022 0.033 0.0313
Loa Loa (eye worm) hypothetical protein 0.0095 0.2872 0.2837
Plasmodium falciparum ATP-dependent Clp protease proteolytic subunit 0.0054 0.1432 0.1913
Echinococcus granulosus nibrin 0.0029 0.0595 0.0727
Giardia lamblia Replication factor C, subunit 1 0.0029 0.0595 1
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.0022 0.033 0.0185
Loa Loa (eye worm) transcription factor SMAD2 0.0243 0.8006 0.7996
Schistosoma mansoni smad1 5 8 and 0.0017 0.0148 0.022
Loa Loa (eye worm) MH1 domain-containing protein 0.0017 0.0148 0.0099
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0055 0.1487 0.2177
Trichomonas vaginalis PIKK family atypical protein kinase 0.0022 0.033 0.0313
Brugia malayi RNA recognition motif domain containing protein 0.0194 0.6303 0.6247
Toxoplasma gondii ATP-dependent Clp endopeptidase, proteolytic subunit ClpP domain-containing protein 0.0156 0.4967 1
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.003 0.0613 0.0472
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0055 0.1487 0.222
Mycobacterium leprae possible inositol monophosphatase SubH (IMPase) (inositol-1-phosphatase) (I-1-Pase ). 0.0037 0.0839 0.0558
Echinococcus multilocularis peptidase Clp (S14 family) 0.0102 0.3109 0.4811
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0055 0.1487 0.222
Trypanosoma cruzi phosphatidylinositol kinase related protein, putative 0.0026 0.0467 0.2086
Trichomonas vaginalis RNA polymerase II ctd phosphatase, putative 0.0029 0.0595 0.0607
Trichomonas vaginalis PIKK family atypical protein kinase 0.0022 0.033 0.0313
Brugia malayi Pre-SET motif family protein 0.024 0.7896 0.7864
Echinococcus granulosus histone lysine methyltransferase setb 0.0034 0.0767 0.1006
Trichomonas vaginalis PIKK family atypical protein kinase 0.0022 0.033 0.0313
Trichomonas vaginalis PIKK family atypical protein kinase 0.0022 0.033 0.0313
Trichomonas vaginalis PIKK family atypical protein kinase 0.0022 0.033 0.0313
Trichomonas vaginalis RNA polymerase II ctd phosphatase, putative 0.0029 0.0595 0.0607
Mycobacterium ulcerans ATP-dependent Clp protease proteolytic subunit 0.0156 0.4967 1
Schistosoma mansoni tar DNA-binding protein 0.0194 0.6303 0.9406
Chlamydia trachomatis ATP-dependent Clp protease proteolytic subunit 0.0156 0.4967 1
Trypanosoma brucei phosphatidylinositol 3-kinase, putative 0.0022 0.033 0.2997
Loa Loa (eye worm) latrophilin receptor protein 2 0.0095 0.2872 0.2837
Schistosoma mansoni topbp1 0.0029 0.0595 0.0888
Loa Loa (eye worm) Smad1 0.0017 0.0148 0.0099
Trichomonas vaginalis PIKK family atypical protein kinase 0.0022 0.033 0.0313
Schistosoma mansoni TGF-beta signal transducer Smad2 0.0017 0.0148 0.022
Loa Loa (eye worm) hypothetical protein 0.0034 0.0767 0.0722
Schistosoma mansoni smad1 5 8 and 0.0017 0.0148 0.022
Trichomonas vaginalis replication factor C large subunit, putative 0.0029 0.0595 0.0607
Schistosoma mansoni Smad4 0.0017 0.0148 0.022
Schistosoma mansoni topbp1 0.0029 0.0595 0.0888
Brugia malayi RNA binding protein 0.0194 0.6303 0.6247
Echinococcus granulosus phosphatidylinositol 3 and 4 kinase 0.0022 0.033 0.0296
Trichomonas vaginalis PIKK family atypical protein kinase 0.0022 0.033 0.0313
Toxoplasma gondii histone lysine methyltransferase SET/SUV39 0.0034 0.0767 0.146
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.0022 0.033 0.0185
Schistosoma mansoni inositol monophosphatase 0.0041 0.0987 0.1473
Echinococcus multilocularis histone lysine methyltransferase setb histone lysine methyltransferase eggless 0.0034 0.0767 0.1006
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.0095 0.2872 0.4427
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0301 1 1
Trichomonas vaginalis PIKK family atypical protein kinase 0.0022 0.033 0.0313
Schistosoma mansoni tar DNA-binding protein 0.0194 0.6303 0.9406
Trichomonas vaginalis chromosome transmission fidelity factor, putative 0.0029 0.0595 0.0607
Toxoplasma gondii inositol(myo)-1(or 4)-monophosphatase 2, putative 0.0041 0.0987 0.1908
Loa Loa (eye worm) hypothetical protein 0.0029 0.0595 0.0549
Trypanosoma cruzi BRCA1 C Terminus (BRCT) domain containing protein, putative 0.0029 0.0595 0.4033
Leishmania major myo-inositol-1(or 4)-monophosphatase 1, putative 0.0041 0.0987 1
Trichomonas vaginalis PIKK family atypical protein kinase 0.0022 0.033 0.0313
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.0095 0.2872 0.4427
Brugia malayi Calcitonin receptor-like protein seb-1 0.0301 1 1
Loa Loa (eye worm) hypothetical protein 0.0029 0.0595 0.0549
Trypanosoma cruzi hypothetical protein, conserved 0.0029 0.0595 0.4033
Echinococcus multilocularis histone lysine N methyltransferase SETMAR 0.0034 0.0767 0.1006
Trichomonas vaginalis PIKK family atypical protein kinase 0.0022 0.033 0.0313
Loa Loa (eye worm) hypothetical protein 0.0301 1 1
Trichomonas vaginalis conserved hypothetical protein 0.0029 0.0595 0.0607
Echinococcus multilocularis GPCR, family 2 0.0095 0.2872 0.4427
Trichomonas vaginalis PIKK family atypical protein kinase 0.0022 0.033 0.0313
Toxoplasma gondii target of rapamycin (TOR), putative 0.0022 0.033 0.0572
Trichomonas vaginalis conserved hypothetical protein 0.0029 0.0595 0.0607
Schistosoma mansoni tar DNA-binding protein 0.0194 0.6303 0.9406
Echinococcus granulosus 5'partial|histone lysine N methyltransferase SETDB2 0.0033 0.0723 0.0935
Brugia malayi latrophilin 2 splice variant baaae 0.0206 0.6701 0.6651
Brugia malayi MH2 domain containing protein 0.0243 0.8006 0.7976
Schistosoma mansoni peptidase Clp (S14 family) 0.0156 0.4967 0.7413
Trichomonas vaginalis inositol monophosphatase, putative 0.0041 0.0987 0.1043
Trichomonas vaginalis myo inositol monophosphatase, putative 0.0041 0.0987 0.1043
Echinococcus multilocularis phosphatidylinositol 3 and 4 kinase 0.0022 0.033 0.0296
Echinococcus multilocularis cadherin EGF LAG seven pass G type receptor 0.0095 0.2872 0.4427
Trichomonas vaginalis PIKK family atypical protein kinase 0.0022 0.033 0.0313
Brugia malayi topoisomerase 0.0029 0.0595 0.0454
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0034 0.0767 0.1144
Trichomonas vaginalis PIKK family atypical protein kinase 0.0022 0.033 0.0313
Echinococcus granulosus tar DNA binding protein 0.0194 0.6303 1
Onchocerca volvulus 0.0034 0.0767 0.0203
Trichomonas vaginalis PIKK family atypical protein kinase 0.0022 0.033 0.0313
Schistosoma mansoni hypothetical protein 0.0095 0.2872 0.4286
Echinococcus granulosus GPCR family 2 0.0095 0.2872 0.4427
Brugia malayi Inositol-1 0.0041 0.0987 0.0852
Trichomonas vaginalis chromosome transmission fidelity factor, putative 0.0029 0.0595 0.0607
Echinococcus granulosus peptidase Clp S14 family 0.0102 0.3109 0.4811
Mycobacterium ulcerans ATP-dependent Clp protease proteolytic subunit 0.0156 0.4967 1
Loa Loa (eye worm) hypothetical protein 0.0029 0.0595 0.0549
Trypanosoma brucei inositol-1(or 4)-monophosphatase 1, putative 0.0041 0.0987 1
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0055 0.1487 0.2177
Entamoeba histolytica hypothetical protein 0.0029 0.0595 0.4033
Echinococcus multilocularis inositol monophosphatase 1 0.0041 0.0987 0.1364
Echinococcus multilocularis nibrin 0.0029 0.0595 0.0727
Echinococcus multilocularis tar DNA binding protein 0.0194 0.6303 1
Schistosoma mansoni histone-lysine n-methyltransferase suv9 0.0034 0.0767 0.1144
Loa Loa (eye worm) hypothetical protein 0.0206 0.6701 0.6685
Schistosoma mansoni hypothetical protein 0.0095 0.2872 0.4286
Trypanosoma cruzi phosphatidylinositol kinase related protein, putative 0.003 0.0613 0.4302
Entamoeba histolytica Activator 1 140 kDa subunit, putative 0.0029 0.0595 0.4033
Loa Loa (eye worm) phosphatidylinositol 3 0.0022 0.033 0.0283
Trypanosoma cruzi hypothetical protein, conserved 0.0029 0.0595 0.4033
Brugia malayi Probable ClpP-like protease 0.0156 0.4967 0.4892
Trichomonas vaginalis PIKK family atypical protein kinase 0.0022 0.033 0.0313
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0055 0.1487 0.2177
Echinococcus granulosus ATP dependent Clp protease proteolytic subunit 0.0156 0.4967 0.783
Trypanosoma brucei Phosphatidylinositol 3-kinase tor1 0.0022 0.033 0.2997
Plasmodium vivax ATP-dependent Clp protease proteolytic subunit, putative 0.0054 0.1432 0.1913
Trypanosoma cruzi FHA domain containing protein, putative 0.0029 0.0595 0.4033
Brugia malayi TAR-binding protein 0.0194 0.6303 0.6247
Brugia malayi follicle stimulating hormone receptor 0.028 0.9266 0.9255
Loa Loa (eye worm) hypothetical protein 0.0026 0.0467 0.042
Toxoplasma gondii hypothetical protein 0.0054 0.1432 0.2811
Treponema pallidum ATP-dependent Clp protease proteolytic subunit 0.0054 0.1432 0.1913
Loa Loa (eye worm) MH2 domain-containing protein 0.0243 0.8006 0.7996
Trichomonas vaginalis PIKK family atypical protein kinase 0.0022 0.033 0.0313
Trichomonas vaginalis PIKK family atypical protein kinase 0.0022 0.033 0.0313
Trichomonas vaginalis conserved hypothetical protein 0.0029 0.0595 0.0607
Trichomonas vaginalis PIKK family atypical protein kinase 0.0022 0.033 0.0313
Brugia malayi ATP dependent DNA ligase C terminal region family protein 0.0029 0.0595 0.0454
Mycobacterium leprae PROBABLE ATP-DEPENDENT CLP PROTEASE PROTEOLYTIC SUBUNIT 1 CLPP1 (ENDOPEPTIDASE CLP) 0.0102 0.3109 0.5749
Trypanosoma brucei phosphatidylinositol 3-related kinase, putative 0.0022 0.033 0.2997
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0055 0.1487 0.222
Trichomonas vaginalis PIKK family atypical protein kinase 0.0022 0.033 0.0313
Mycobacterium tuberculosis Probable ATP-dependent CLP protease proteolytic subunit 2 ClpP2 (endopeptidase CLP 2) 0.0102 0.3109 1
Echinococcus multilocularis FKBP12 rapamycin complex associated protein 0.0022 0.033 0.0296
Brugia malayi Pax transcription activation domain interacting protein 0.0029 0.0595 0.0454
Brugia malayi Pre-SET motif family protein 0.0034 0.0767 0.0628
Trichomonas vaginalis PIKK family atypical protein kinase 0.0022 0.033 0.0313
Loa Loa (eye worm) pre-SET domain-containing protein family protein 0.024 0.7896 0.7885
Toxoplasma gondii ATPase, AAA family protein 0.0029 0.0595 0.1111
Toxoplasma gondii ATP-dependent Clp endopeptidase, proteolytic subunit ClpP domain-containing protein 0.0156 0.4967 1
Trichomonas vaginalis conserved hypothetical protein 0.0029 0.0595 0.0607
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0055 0.1487 0.1446
Brugia malayi Latrophilin receptor protein 2 0.0095 0.2872 0.2765
Trichomonas vaginalis PIKK family atypical protein kinase 0.0022 0.033 0.0313
Schistosoma mansoni tar DNA-binding protein 0.0194 0.6303 0.9406
Trypanosoma brucei phosphatidylinositol kinase related protein, putative 0.003 0.0613 0.6009
Schistosoma mansoni DNA ligase IV 0.0029 0.0595 0.0888
Echinococcus multilocularis ATP dependent Clp protease proteolytic subunit 0.0156 0.4967 0.783
Trypanosoma brucei target of rapamycin kinase 3, putative 0.0022 0.033 0.2997
Plasmodium vivax SET domain protein, putative 0.0034 0.0767 0.0393
Loa Loa (eye worm) TAR-binding protein 0.0194 0.6303 0.6285
Schistosoma mansoni phosphatidylinositol 3-and 4-kinase 0.0022 0.033 0.0492
Brugia malayi hypothetical protein 0.0029 0.0595 0.0454
Wolbachia endosymbiont of Brugia malayi fructose-1,6-bisphosphatase 0.0041 0.0987 0.0897
Trypanosoma cruzi myo-inositol-1(or 4)-monophosphatase 1, putative 0.0041 0.0987 1
Trichomonas vaginalis PIKK family atypical protein kinase 0.0022 0.033 0.0313
Schistosoma mansoni hypothetical protein 0.0095 0.2872 0.4286
Schistosoma mansoni tar DNA-binding protein 0.0194 0.6303 0.9406
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0034 0.0767 0.1144
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0055 0.1487 0.136
Chlamydia trachomatis ATP-dependent Clp protease proteolytic subunit 0.0156 0.4967 1
Loa Loa (eye worm) RNA binding protein 0.0194 0.6303 0.6285
Schistosoma mansoni smad1 5 8 and 0.0017 0.0148 0.022
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0055 0.1487 0.2177
Echinococcus granulosus replication factor c subunit 1 0.0029 0.0595 0.0727
Loa Loa (eye worm) phosphatidylinositol 3 0.0022 0.033 0.0283
Loa Loa (eye worm) hypothetical protein 0.0029 0.0595 0.0549
Trichomonas vaginalis set domain proteins, putative 0.0273 0.9046 1
Wolbachia endosymbiont of Brugia malayi ATP-dependent Clp protease proteolytic subunit 0.0156 0.4967 1
Mycobacterium ulcerans extragenic suppressor protein SuhB 0.0041 0.0987 0.0897
Schistosoma mansoni hypothetical protein 0.0095 0.2872 0.4286
Trypanosoma brucei BRCA1 C Terminus (BRCT) domain containing protein, putative 0.0029 0.0595 0.5821
Trichomonas vaginalis myo inositol monophosphatase, putative 0.0041 0.0987 0.1043
Onchocerca volvulus 0.0273 0.9046 1
Loa Loa (eye worm) MH2 domain-containing protein 0.0017 0.0148 0.0099
Echinococcus multilocularis replication factor c subunit 1 0.0029 0.0595 0.0727
Trichomonas vaginalis PIKK family atypical protein kinase 0.0022 0.033 0.0313
Treponema pallidum ATP-dependent Clp protease proteolytic subunit 0.0156 0.4967 1
Leishmania major phosphatidylinositol kinase related protein, putative 0.0022 0.0331 0.0022
Loa Loa (eye worm) hypothetical protein 0.0029 0.0595 0.0549
Loa Loa (eye worm) hypothetical protein 0.0156 0.4967 0.4943
Schistosoma mansoni inositol monophosphatase 0.0041 0.0987 0.1473
Trichomonas vaginalis PIKK family atypical protein kinase 0.0022 0.033 0.0313
Schistosoma mansoni smad 0.0017 0.0148 0.022
Trypanosoma cruzi myo-inositol-1(or 4)-monophosphatase 1, putative 0.0041 0.0987 1
Trichomonas vaginalis conserved hypothetical protein 0.0029 0.0595 0.0607
Plasmodium falciparum ATP-dependent Clp protease proteolytic subunit 0.0156 0.4967 1
Trichomonas vaginalis PIKK family atypical protein kinase 0.003 0.0613 0.0627
Brugia malayi hypothetical protein 0.0029 0.0595 0.0454
Echinococcus multilocularis serine protein kinase ATM 0.003 0.0613 0.0756

Activities

Activity type Activity value Assay description Source Reference
Potency (functional) 1.3115 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) 7.0795 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) = 10 um PUBCHEM_BIOASSAY: qHTS Assay for Agonists of the Thyroid Stimulating Hormone Receptor. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) = 10 um PUBCHEM_BIOASSAY: qHTS Assay for Agonists of the Thyroid Stimulating Hormone Receptor: Activators of Intracellular cAMP Concentrations in Parental HEK 293. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) = 14.1254 um PUBCHEM_BIOASSAY: qHTS Assay for Identifying a Potential Treatment of Ataxia-Telangiectasia. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 31.6228 uM PUBCHEM_BIOASSAY: Inhibitors of the vitamin D receptor (VDR): qHTS. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID504855] 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.
 
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External resources for this compound

Bibliographic References

No literature references available for this target.

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