Detailed information for compound 1288152

Basic information

Technical information
  • TDR Targets ID: 1288152
  • Name: [4-(3-ethoxypropylcarbamoyl)phenyl] acetate
  • MW: 265.305 | Formula: C14H19NO4
  • H donors: 1 H acceptors: 2 LogP: 1.53 Rotable bonds: 9
    Rule of 5 violations (Lipinski): 1
  • SMILES: CCOCCCNC(=O)c1ccc(cc1)OC(=O)C
  • InChi: 1S/C14H19NO4/c1-3-18-10-4-9-15-14(17)12-5-7-13(8-6-12)19-11(2)16/h5-8H,3-4,9-10H2,1-2H3,(H,15,17)
  • InChiKey: RDMQEKYJPDZQRW-UHFFFAOYSA-N  

Network

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Synonyms

  • acetic acid [4-[(3-ethoxypropylamino)-oxomethyl]phenyl] ester
  • acetic acid [4-(3-ethoxypropylcarbamoyl)phenyl] ester
  • [4-(3-ethoxypropylcarbamoyl)phenyl] ethanoate
  • STK115559
  • 4-{[(3-ethoxypropyl)amino]carbonyl}phenyl acetate
  • MLS000088784
  • SMR000071925
  • ZINC02820370

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens GNAS complex locus Starlite/ChEMBL No references
Homo sapiens l(3)mbt-like 1 (Drosophila) Starlite/ChEMBL No references

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Echinococcus granulosus endonuclease exonuclease phosphatase Get druggable targets OG5_130415 All targets in OG5_130415
Echinococcus granulosus guanine nucleotide binding protein Gs subunit Get druggable targets OG5_131088 All targets in OG5_131088
Echinococcus multilocularis endonuclease exonuclease phosphatase Get druggable targets OG5_130415 All targets in OG5_130415
Echinococcus granulosus guanine nucleotide binding protein Gs 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
Schistosoma mansoni hypothetical protein Get druggable targets OG5_130415 All targets in OG5_130415
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit Get druggable targets OG5_131088 All targets in OG5_131088
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
Schistosoma japonicum ko:K04632 guanine nucleotide binding protein (G protein), alpha stimulating, putative 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
Schistosoma japonicum Lethal(3)malignant brain tumor-like 3 protein, putative Get druggable targets OG5_130415 All targets in OG5_130415
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain Get druggable targets OG5_131088 All targets in OG5_131088
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative Get druggable targets OG5_131088 All targets in OG5_131088
Schistosoma japonicum Lethal(3)malignant brain tumor-like 4 protein, putative Get druggable targets OG5_130415 All targets in OG5_130415

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
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0072 0.0721 0.2515
Echinococcus granulosus dna polymerase kappa 0.0023 0.0016 0.0016
Brugia malayi mbt repeat family protein 0.0058 0.0514 0.0755
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0055 0.048 0.048
Brugia malayi RNA recognition motif domain containing protein 0.0074 0.0751 0.1103
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0307 0.4059 1
Schistosoma mansoni sex comb on midleg homolog 0.0058 0.0514 0.0514
Loa Loa (eye worm) hypothetical protein 0.0058 0.0514 0.0806
Echinococcus multilocularis histone lysine methyltransferase setb histone lysine methyltransferase eggless 0.0146 0.1777 0.1777
Loa Loa (eye worm) MBCTL1 0.0066 0.0627 0.0983
Schistosoma mansoni eyes absent homolog 0.0089 0.0966 0.0966
Treponema pallidum fructose-bisphosphate aldolase 0.0307 0.4059 1
Plasmodium vivax basic transcription factor 3b, putative 0.022 0.2818 0.7015
Mycobacterium tuberculosis Probable hydrolase 0.0074 0.0751 0.1143
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0072 0.0721 0.2515
Onchocerca volvulus 0.0058 0.0514 0.1523
Loa Loa (eye worm) hypothetical protein 0.003 0.0123 0.0193
Mycobacterium ulcerans bifunctional nicotinate-nucleotide adenylyltransferase NadD/hypothetical protein 0.0299 0.3956 1
Schistosoma mansoni lipoxygenase 0.0107 0.122 0.122
Schistosoma mansoni sex comb on midleg homolog 0.0058 0.0514 0.0514
Loa Loa (eye worm) hypothetical protein 0.0174 0.2165 0.3395
Loa Loa (eye worm) mbt repeat family protein 0.0058 0.0514 0.0806
Schistosoma mansoni ubiquitin-specific peptidase 8 (C19 family) 0.0042 0.0289 0.0289
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0072 0.0721 0.2515
Echinococcus multilocularis bromodomain adjacent to zinc finger domain 0.0398 0.536 0.536
Trichomonas vaginalis set domain proteins, putative 0.0258 0.3373 0.8303
Mycobacterium ulcerans lipase LipD 0.0074 0.0751 0.1867
Echinococcus multilocularis histone lysine N methyltransferase SETMAR 0.0033 0.0166 0.0166
Schistosoma mansoni DNA polymerase eta 0.0023 0.0016 0.0016
Echinococcus multilocularis endonuclease exonuclease phosphatase 0.0227 0.2924 0.2924
Echinococcus granulosus fetal alzheimer antigen falz 0.0151 0.1849 0.1849
Echinococcus granulosus terminal deoxycytidyl transferase rev1 0.0023 0.0016 0.0016
Schistosoma mansoni bromodomain containing protein 0.003 0.0123 0.0123
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.0074 0.0751 0.1177
Loa Loa (eye worm) ImpB/MucB/SamB family protein 0.0023 0.0016 0.0025
Brugia malayi follicle stimulating hormone receptor 0.0243 0.3153 0.4633
Echinococcus granulosus Transcription factor JmjC domain containing protein 0.0104 0.1173 0.1173
Brugia malayi beta-lactamase 0.0074 0.0751 0.1104
Echinococcus granulosus lysine specific demethylase 5A 0.0053 0.0446 0.0446
Entamoeba histolytica transcription factor BTF3, putative 0.022 0.2818 0.6932
Echinococcus granulosus dna polymerase eta 0.0023 0.0016 0.0016
Brugia malayi ImpB/MucB/SamB family protein 0.0023 0.0016 0.0023
Leishmania major basic transcription factor 3a, putative 0.022 0.2818 1
Echinococcus multilocularis Polycystic kidney disease protein 0.0041 0.0283 0.0283
Loa Loa (eye worm) hypothetical protein 0.0089 0.0966 0.1515
Echinococcus granulosus Jumonji AT rich interactive domain 1B 0.0025 0.0045 0.0045
Brugia malayi Pre-SET motif family protein 0.0033 0.0166 0.0244
Mycobacterium ulcerans esterase/lipase LipP 0.0074 0.0751 0.1867
Schistosoma mansoni loxhd1 0.0041 0.0283 0.0283
Echinococcus granulosus Ataxin 2 N terminaldomain containing protein 0.0024 0.0041 0.0041
Loa Loa (eye worm) hypothetical protein 0.0041 0.0283 0.0443
Schistosoma mansoni hypothetical protein 0.0137 0.1644 0.1644
Brugia malayi hypothetical protein 0.0174 0.2165 0.3181
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0074 0.0751 0.0751
Echinococcus granulosus suppression of tumorigenicity 18 protein 0.0066 0.0627 0.0627
Echinococcus multilocularis beta LACTamase domain containing family member 0.0074 0.0751 0.0751
Echinococcus multilocularis tar DNA binding protein 0.0074 0.0751 0.0751
Echinococcus granulosus SAM and MBT domain containing protein 0.0058 0.0514 0.0514
Loa Loa (eye worm) hypothetical protein 0.0023 0.0016 0.0025
Mycobacterium ulcerans beta-lactamase 0.0074 0.0751 0.1867
Mycobacterium tuberculosis Probable lipase LipE 0.0074 0.0751 0.1143
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0055 0.048 0.048
Trypanosoma cruzi transcription factor btf3, putative 0.022 0.2818 1
Schistosoma mansoni methyl-cpg binding protein mbd 0.0113 0.1305 0.1305
Onchocerca volvulus 0.0074 0.0751 0.2228
Loa Loa (eye worm) hypothetical protein 0.0066 0.0627 0.0983
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase 0.0042 0.0289 0.0676
Echinococcus granulosus transcription factor btf3 0.022 0.2818 0.2818
Echinococcus multilocularis lipoxygenase domain containing protein 0.0041 0.0283 0.0283
Schistosoma mansoni lipoxygenase 0.0182 0.228 0.228
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0072 0.0721 0.2515
Loa Loa (eye worm) ICD-1 protein 0.022 0.2818 0.442
Mycobacterium tuberculosis Conserved protein 0.0074 0.0751 0.1143
Schistosoma mansoni hypothetical protein 0.0102 0.1139 0.1139
Echinococcus multilocularis polycomb protein SCMH1 0.0058 0.0514 0.0514
Trypanosoma cruzi cysteine peptidase, putative 0.0072 0.0721 0.2515
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0307 0.4059 1
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0307 0.4059 1
Plasmodium falciparum ataxin-2 like protein, putative 0.0054 0.0469 0.0848
Mycobacterium tuberculosis Probable esterase LipL 0.0074 0.0751 0.1143
Plasmodium vivax SET domain protein, putative 0.0033 0.0166 0.0054
Trypanosoma brucei PAB1-binding protein , putative 0.0054 0.0469 0.1616
Echinococcus granulosus histone acetyltransferase MYST2 0.0066 0.0627 0.0627
Loa Loa (eye worm) jmjC domain-containing protein 0.0053 0.0446 0.07
Loa Loa (eye worm) hypothetical protein 0.047 0.6376 1
Echinococcus granulosus lipoxygenase domain containing protein 0.0041 0.0283 0.0283
Echinococcus multilocularis ubiquitin carboxyl terminal hydrolase 8 0.0042 0.0289 0.0289
Schistosoma mansoni hypothetical protein 0.0165 0.2035 0.2035
Trypanosoma cruzi transcription factor btf3, putative 0.022 0.2818 1
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0072 0.0721 0.2515
Schistosoma mansoni jumonji/arid domain-containing protein 0.0053 0.0446 0.0446
Schistosoma mansoni hypothetical protein 0.0032 0.0145 0.0145
Loa Loa (eye worm) jmjC domain-containing protein 0.0066 0.0626 0.0982
Brugia malayi CXXC zinc finger family protein 0.0031 0.0135 0.0198
Echinococcus multilocularis transcription factor btf3 0.022 0.2818 0.2818
Plasmodium falciparum nicotinamide/nicotinic acid mononucleotide adenylyltransferase 0.0299 0.3956 1
Trichomonas vaginalis D-aminoacylase, putative 0.0074 0.0751 0.1819
Schistosoma mansoni myelin transcription factor 1 myt1 0.0066 0.0627 0.0627
Loa Loa (eye worm) hypothetical protein 0.0285 0.3749 0.5879
Onchocerca volvulus 0.0041 0.0283 0.0838
Mycobacterium ulcerans fructose-bisphosphate aldolase 0.015 0.1826 0.4595
Echinococcus multilocularis lysine specific demethylase 5A 0.0038 0.024 0.024
Loa Loa (eye worm) hypothetical protein 0.0033 0.0165 0.0258
Loa Loa (eye worm) PHD-finger family protein 0.0032 0.0145 0.0228
Brugia malayi Ubiquitin carboxyl-terminal hydrolase family protein 0.0042 0.0289 0.0425
Loa Loa (eye worm) hypothetical protein 0.0048 0.0383 0.06
Trypanosoma cruzi ISWI complex protein 0.0102 0.1139 0.4009
Echinococcus multilocularis zinc finger protein 0.0132 0.1569 0.1569
Mycobacterium ulcerans fusion of enoyl-CoA hydratase, EchA21 and lipase, LipE 0.0074 0.0751 0.1867
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0072 0.0721 0.2515
Schistosoma mansoni bromodomain containing protein 0.0422 0.5698 0.5698
Schistosoma mansoni cpg binding protein 0.0045 0.0341 0.0341
Entamoeba histolytica ubiquitin carboxyl-terminal hydrolase domain containing protein 0.0042 0.0289 0.0676
Echinococcus multilocularis dna polymerase kappa 0.0023 0.0016 0.0016
Echinococcus multilocularis cpg binding protein 0.0045 0.0341 0.0341
Echinococcus multilocularis PHD finger protein rhinoceros 0.0032 0.0145 0.0145
Echinococcus granulosus PHD finger protein rhinoceros 0.0032 0.0145 0.0145
Echinococcus granulosus peregrin 0.0047 0.0369 0.0369
Brugia malayi RNA binding protein 0.0074 0.0751 0.1103
Trypanosoma cruzi PAB1-binding protein , putative 0.0054 0.0469 0.1616
Loa Loa (eye worm) hypothetical protein 0.0074 0.0751 0.1178
Loa Loa (eye worm) bromodomain containing protein 0.0117 0.1363 0.2138
Mycobacterium ulcerans hypothetical protein 0.0074 0.0751 0.1867
Brugia malayi hypothetical protein 0.0041 0.0283 0.0415
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0074 0.0751 0.0751
Schistosoma mansoni hypothetical protein 0.0165 0.2035 0.2035
Plasmodium vivax hypothetical protein, conserved 0.0074 0.0751 0.159
Loa Loa (eye worm) hypothetical protein 0.0255 0.3319 0.5206
Schistosoma mansoni zinc finger protein 0.0102 0.1139 0.1139
Loa Loa (eye worm) hypothetical protein 0.0074 0.0751 0.1178
Echinococcus granulosus Peptidase C19 ubiquitin carboxyl terminal hydrolase 2 0.0042 0.0289 0.0289
Leishmania major hypothetical protein, conserved 0.0074 0.0751 0.2624
Toxoplasma gondii histone lysine methyltransferase SET/SUV39 0.0033 0.0166 0.0076
Schistosoma mansoni transcription factor btf3 0.022 0.2818 0.2818
Trypanosoma cruzi ISWI complex protein 0.0102 0.1139 0.4009
Schistosoma mansoni acetyl-CoA C-acetyltransferase 0.0151 0.1849 0.1849
Toxoplasma gondii histone lysine methyltransferase SET1 0.0076 0.077 0.2337
Onchocerca volvulus 0.0031 0.0135 0.04
Trypanosoma cruzi cysteine peptidase, putative 0.0072 0.0721 0.2515
Echinococcus granulosus zinc finger protein 0.0132 0.1569 0.1569
Loa Loa (eye worm) TAR-binding protein 0.0074 0.0751 0.1177
Schistosoma mansoni cpg binding protein 0.0031 0.0135 0.0135
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0048 0.0383 0.06
Leishmania major cathepsin L-like protease 0.0072 0.0721 0.2515
Loa Loa (eye worm) hypothetical protein 0.0146 0.1777 0.2787
Mycobacterium leprae Probable fructose bisphosphate aldolase Fba 0.015 0.1826 0.3354
Schistosoma mansoni hypothetical protein 0.0024 0.0041 0.0041
Brugia malayi beta-lactamase family protein 0.0074 0.0751 0.1104
Echinococcus multilocularis fetal alzheimer antigen, falz 0.0151 0.1849 0.1849
Loa Loa (eye worm) hypothetical protein 0.0074 0.0751 0.1178
Onchocerca volvulus Polycomb protein Sfmbt homolog 0.0058 0.0514 0.1523
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0072 0.0721 0.2515
Entamoeba histolytica fructose-1,6-bisphosphate aldolase, putative 0.0307 0.4059 1
Mycobacterium tuberculosis Conserved protein 0.0074 0.0751 0.1143
Loa Loa (eye worm) hypothetical protein 0.0054 0.0469 0.0735
Brugia malayi jmjC domain containing protein 0.0104 0.1173 0.1724
Trypanosoma brucei transcription factor BTF3, putative 0.022 0.2818 1
Loa Loa (eye worm) hypothetical protein 0.0074 0.0751 0.1178
Brugia malayi C2-HC type zinc finger protein C.e-MyT1 0.0066 0.0627 0.0921
Echinococcus granulosus RUN 0.0041 0.0283 0.0283
Echinococcus granulosus cpg binding protein 0.0045 0.0341 0.0341
Onchocerca volvulus 0.0174 0.2165 0.6418
Leishmania major ubiquitin hydrolase, putative,cysteine peptidase, Clan CA, family C19, putative 0.0042 0.0289 0.0976
Trichomonas vaginalis esterase, putative 0.0074 0.0751 0.1819
Schistosoma mansoni jumonji/arid domain-containing protein 0.0053 0.0446 0.0446
Brugia malayi mbt repeat family protein 0.0058 0.0514 0.0755
Toxoplasma gondii LsmAD domain-containing protein 0.0054 0.0469 0.1209
Plasmodium vivax ataxin-2 like protein, putative 0.0054 0.0469 0.0848
Echinococcus multilocularis Peptidase C19, ubiquitin carboxyl terminal hydrolase 2 0.0042 0.0289 0.0289
Schistosoma mansoni terminal deoxycytidyl transferase 0.0023 0.0016 0.0016
Loa Loa (eye worm) follicle stimulating hormone receptor 0.0243 0.3153 0.4945
Giardia lamblia Fructose-bisphosphate aldolase 0.0307 0.4059 1
Trichomonas vaginalis D-aminoacylase, putative 0.0074 0.0751 0.1819
Onchocerca volvulus 0.0074 0.0751 0.2228
Mycobacterium tuberculosis Probable esterase/lipase LipP 0.0074 0.0751 0.1143
Loa Loa (eye worm) hypothetical protein 0.0025 0.0047 0.0074
Trypanosoma cruzi cysteine peptidase, putative 0.0072 0.0721 0.2515
Echinococcus multilocularis lipoxygenase domain containing protein 0.0041 0.0283 0.0283
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0146 0.1777 0.1777
Loa Loa (eye worm) PHD-finger family protein 0.0137 0.1644 0.2577
Trypanosoma cruzi cysteine peptidase, clan CA, family C1, cathepsin L-like, putative 0.0066 0.0632 0.2197
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase 0.0042 0.0289 0.0676
Schistosoma mansoni rab geranylgeranyl transferase alpha subunit 0.0023 0.0016 0.0016
Echinococcus multilocularis suppression of tumorigenicity 18 protein 0.0066 0.0627 0.0627
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0055 0.048 0.0753
Onchocerca volvulus Alhambra homolog 0.0032 0.0145 0.0431
Brugia malayi ImpB/MucB/SamB family protein 0.0023 0.0016 0.0023
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0055 0.048 0.048
Brugia malayi Bromodomain containing protein 0.05 0.6806 1
Echinococcus granulosus histone lysine methyltransferase setb 0.0146 0.1777 0.1777
Trichomonas vaginalis penicillin-binding protein, putative 0.0074 0.0751 0.1819
Schistosoma mansoni ubiquitin-specific peptidase 2 (C19 family) 0.0042 0.0289 0.0289
Brugia malayi Bromodomain containing protein 0.0047 0.0369 0.0542
Echinococcus granulosus ubiquitin specific protease 41 0.0042 0.0289 0.0289
Echinococcus multilocularis methyl CpG binding domain protein 2 0.0113 0.1305 0.1305
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0072 0.0721 0.2515
Plasmodium falciparum LCCL domain-containing protein 0.0041 0.0283 0.036
Trypanosoma cruzi cruzipain precursor, putative 0.0072 0.0721 0.2515
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0055 0.048 0.0705
Echinococcus multilocularis RUN 0.0041 0.0283 0.0283
Echinococcus granulosus Polycystic kidney disease protein 0.0041 0.0283 0.0283
Brugia malayi hypothetical protein 0.0054 0.0469 0.0689
Mycobacterium tuberculosis Probable lipase LipD 0.0074 0.0751 0.1143
Trichomonas vaginalis conserved hypothetical protein 0.0042 0.0289 0.0676
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0072 0.0721 0.2515
Loa Loa (eye worm) doublecortin family protein 0.0041 0.0283 0.0443
Echinococcus multilocularis SAM and MBT domain containing protein 0.0058 0.0514 0.0514
Echinococcus granulosus bromodomain adjacent to zinc finger domain 0.0398 0.536 0.536
Leishmania major hypothetical protein, conserved 0.0054 0.0469 0.1616
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0307 0.4059 1
Trypanosoma cruzi major cysteine proteinase, putative 0.0057 0.0501 0.1731
Trypanosoma brucei ubiquitin carboxyl-terminal hydrolase, putative 0.0042 0.0289 0.0976
Brugia malayi PHD-finger family protein 0.0032 0.0145 0.0214
Brugia malayi Bromodomain containing protein 0.0254 0.3313 0.4868
Echinococcus granulosus ubiquitin carboxyl terminal hydrolase 8 0.0042 0.0289 0.0289
Brugia malayi F/Y-rich N-terminus family protein 0.0034 0.0174 0.0255
Echinococcus granulosus lipoxygenase domain containing protein 0.0041 0.0283 0.0283
Brugia malayi hypothetical protein 0.0035 0.0194 0.0285
Onchocerca volvulus 0.0033 0.0166 0.0492
Brugia malayi beta-lactamase family protein 0.0074 0.0751 0.1104
Trichomonas vaginalis conserved hypothetical protein 0.022 0.2818 0.6932
Echinococcus multilocularis peregrin 0.0047 0.0369 0.0369
Echinococcus granulosus arachidonate 5 lipoxygenase 0.0182 0.228 0.228
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0307 0.4059 1
Trichomonas vaginalis conserved hypothetical protein 0.022 0.2818 0.6932
Brugia malayi Pre-SET motif family protein 0.0227 0.2927 0.4301
Schistosoma mansoni hypothetical protein 0.0041 0.0283 0.0283
Echinococcus granulosus beta LACTamase domain containing family member 0.0074 0.0751 0.0751
Schistosoma mansoni hypothetical protein 0.035 0.4677 0.4677
Loa Loa (eye worm) hypothetical protein 0.0089 0.0966 0.1515
Brugia malayi PHD-finger family protein 0.0025 0.0047 0.0069
Trichomonas vaginalis conserved hypothetical protein 0.022 0.2818 0.6932
Brugia malayi latrophilin 2 splice variant baaae 0.0033 0.0165 0.0242
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0033 0.0166 0.0166
Plasmodium vivax nicotinate-nucleotide adenylyltransferase, putative 0.0299 0.3956 1
Leishmania major hypothetical protein, conserved 0.0102 0.1139 0.4009
Schistosoma mansoni rab6-interacting 0.0041 0.0283 0.0283
Schistosoma mansoni cpg binding protein 0.0045 0.0341 0.0341
Echinococcus granulosus endonuclease exonuclease phosphatase 0.0227 0.2924 0.2924
Brugia malayi Calcitonin receptor-like protein seb-1 0.0048 0.0383 0.0562
Mycobacterium leprae PROBABLE NICOTINATE-NUCLEOTIDE ADENYLYLTRANSFERASE NADD (DEAMIDO-NAD(+) PYROPHOSPHORYLASE) (DEAMIDO-NAD(+) DIPHOSPHORYLASE) (NIC 0.0299 0.3956 1
Loa Loa (eye worm) hypothetical protein 0.0032 0.0145 0.0228
Mycobacterium tuberculosis Conserved protein 0.0074 0.0751 0.1143
Schistosoma mansoni hypothetical protein 0.0033 0.0165 0.0165
Brugia malayi PHD-finger family protein 0.0167 0.2073 0.3046
Loa Loa (eye worm) hypothetical protein 0.027 0.3543 0.5557
Trypanosoma cruzi PAB1-binding protein , putative 0.0054 0.0469 0.1616
Mycobacterium tuberculosis Possible penicillin-binding protein 0.0475 0.645 1
Echinococcus granulosus methyl CpG binding domain protein 2 0.0113 0.1305 0.1305
Giardia lamblia PHD finger protein 15 0.0032 0.0145 0.0321
Trichomonas vaginalis D-aminoacylase, putative 0.0074 0.0751 0.1819
Toxoplasma gondii NAC domain-containing protein 0.022 0.2818 1
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0055 0.048 0.048
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0307 0.4059 1
Brugia malayi hypothetical protein 0.0041 0.0283 0.0415
Schistosoma mansoni polycystin 1-related 0.0041 0.0283 0.0283
Loa Loa (eye worm) beta-lactamase 0.0074 0.0751 0.1178
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0048 0.0383 0.0562
Brugia malayi beta-NAC-like protein 0.022 0.2818 0.4141
Echinococcus multilocularis arachidonate 5 lipoxygenase 0.0182 0.228 0.228
Schistosoma mansoni rab6-interacting 0.0041 0.0283 0.0283
Leishmania major cathepsin L-like protease 0.0072 0.0721 0.2515
Echinococcus multilocularis bromodomain adjacent to zinc finger domain 0.0239 0.3089 0.3089
Brugia malayi TAR-binding protein 0.0074 0.0751 0.1103
Echinococcus multilocularis geminin 0.0165 0.2035 0.2035
Leishmania major cathepsin L-like protease 0.0072 0.0721 0.2515
Echinococcus granulosus bromodomain adjacent to zinc finger domain 0.0239 0.3089 0.3089
Loa Loa (eye worm) hypothetical protein 0.0074 0.0751 0.1178
Loa Loa (eye worm) RNA binding protein 0.0074 0.0751 0.1177
Echinococcus multilocularis terminal deoxycytidyl transferase rev1 0.0023 0.0016 0.0016
Loa Loa (eye worm) hypothetical protein 0.0054 0.0468 0.0734
Trypanosoma brucei hypothetical protein, conserved 0.0074 0.0751 0.2624
Giardia lamblia Ubiquitin carboxyl-terminal hydrolase 4 0.0042 0.0289 0.0676
Trypanosoma cruzi ubiquitin carboxyl-terminal hydrolase, putative 0.0042 0.0289 0.0976
Schistosoma mansoni tar DNA-binding protein 0.0074 0.0751 0.0751
Mycobacterium tuberculosis Probable nicotinate-nucleotide adenylyltransferase NadD (deamido-NAD(+) pyrophosphorylase) (deamido-NAD(+) diphosphorylase) (nic 0.0299 0.3956 0.6123
Brugia malayi hypothetical protein 0.0089 0.0966 0.1419
Schistosoma mansoni zinc finger protein 0.0132 0.1569 0.1569
Echinococcus granulosus polycomb protein SCMH1 0.0058 0.0514 0.0514
Echinococcus granulosus geminin 0.0165 0.2035 0.2035
Echinococcus multilocularis histone acetyltransferase MYST2 0.0066 0.0627 0.0627
Schistosoma mansoni jumonji domain containing protein 0.0083 0.0869 0.0869
Plasmodium falciparum ataxin-2 like protein, putative 0.0054 0.0469 0.0848
Trypanosoma cruzi hypothetical protein, conserved 0.0074 0.0751 0.2624
Mycobacterium tuberculosis Probable fructose-bisphosphate aldolase Fba 0.015 0.1826 0.2814
Schistosoma mansoni tar DNA-binding protein 0.0074 0.0751 0.0751
Plasmodium vivax multidomain scavenger receptor, putative 0.0041 0.0283 0.036
Mycobacterium tuberculosis Possible conserved lipoprotein LpqK 0.0074 0.0751 0.1143
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0307 0.4059 1
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0055 0.048 0.048
Entamoeba histolytica fructose-1,6-bisphosphate aldolase, putative 0.0307 0.4059 1
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0055 0.048 0.048
Echinococcus multilocularis ubiquitin specific protease 41 0.0042 0.0289 0.0289
Entamoeba histolytica hypothetical protein 0.022 0.2818 0.6932
Schistosoma mansoni tar DNA-binding protein 0.0074 0.0751 0.0751
Plasmodium falciparum basic transcription factor 3b, putative 0.022 0.2818 0.7015
Echinococcus multilocularis Ataxin 2, N terminal,domain containing protein 0.0024 0.0041 0.0041
Echinococcus multilocularis dna polymerase eta 0.0023 0.0016 0.0016
Onchocerca volvulus 0.0258 0.3373 1
Schistosoma mansoni scm-relatedprotein containing 4 mbt domains (sfmbt) 0.0058 0.0514 0.0514
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0055 0.048 0.048
Loa Loa (eye worm) beta-LACTamase domain containing family member 0.0074 0.0751 0.1178
Onchocerca volvulus 0.0074 0.0751 0.2228
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0307 0.4059 1
Brugia malayi Doublecortin family protein 0.0041 0.0283 0.0415
Echinococcus granulosus 5'partial|histone lysine N methyltransferase SETDB2 0.0031 0.0139 0.0139
Loa Loa (eye worm) pre-SET domain-containing protein family protein 0.0227 0.2927 0.4591
Brugia malayi Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative 0.0074 0.0751 0.1104
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0072 0.0721 0.2515
Schistosoma mansoni methyl-cpg binding protein mbd 0.0113 0.1305 0.1305
Echinococcus multilocularis jumonji domain containing protein 0.0044 0.0322 0.0322
Loa Loa (eye worm) hypothetical protein 0.0042 0.0289 0.0454
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0146 0.1777 0.1777
Trypanosoma cruzi ubiquitin carboxyl-terminal hydrolase, putative 0.0042 0.0289 0.0976
Loa Loa (eye worm) CXXC zinc finger family protein 0.0031 0.0135 0.0212
Echinococcus granulosus jumonji domain containing protein 0.0044 0.0322 0.0322
Schistosoma mansoni tar DNA-binding protein 0.0074 0.0751 0.0751
Toxoplasma gondii ABC1 family protein 0.0074 0.0751 0.2267
Trichomonas vaginalis penicillin-binding protein, putative 0.0074 0.0751 0.1819
Loa Loa (eye worm) hypothetical protein 0.0041 0.0283 0.0443
Echinococcus multilocularis Transcription factor, JmjC domain containing protein 0.0104 0.1173 0.1173
Schistosoma mansoni bromodomain-containing nuclear protein 1 brd1 0.0032 0.0145 0.0145
Echinococcus multilocularis Jumonji, AT rich interactive domain 1B 0.0025 0.0045 0.0045
Trypanosoma cruzi hypothetical protein, conserved 0.0074 0.0751 0.2624
Echinococcus granulosus tar DNA binding protein 0.0074 0.0751 0.0751
Onchocerca volvulus 0.0041 0.0283 0.0838
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0067 0.0646 0.0646
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0072 0.0721 0.2515
Brugia malayi jmjC domain containing protein 0.0053 0.0446 0.0656
Loa Loa (eye worm) hypothetical protein 0.0074 0.0751 0.1178
Mycobacterium tuberculosis Probable conserved lipoprotein 0.0074 0.0751 0.1143
Trypanosoma brucei ISWI complex protein 0.0102 0.1139 0.4009
Schistosoma mansoni histone-lysine n-methyltransferase suv9 0.0033 0.0166 0.0166
Schistosoma mansoni tar DNA-binding protein 0.0074 0.0751 0.0751

Activities

Activity type Activity value Assay description Source Reference
Potency (functional) = 5.0119 um PUBCHEM_BIOASSAY: qHTS Assay for the Inhibitors of L3MBTL1. (Class of assay: confirmatory) [Related pubchem assays: 485292 (Probe Development Summary for Inhibitors of L3MBTL1)] ChEMBL. No reference
Potency (functional) 11.2202 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) = 35.4813 um PUBCHEM_BIOASSAY: qHTS Fluorescence Polarization Assay for Inhibitors of MLL CXXC domain - DNA interaction. (Class of assay: confirmatory) [Related pubchem assays: 2698 (Summary assay.)] ChEMBL. No reference
Potency (functional) 89.1251 uM PUBCHEM_BIOASSAY: HTS for Inhibitors of HP1-beta Chromodomain Interactions with Methylated Histone Tails. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488962] 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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