Detailed information for compound 168271

Basic information

Technical information
  • TDR Targets ID: 168271
  • Name: 2-[2-(4-chlorophenyl)imidazo[4,5-b]pyridin-3- yl]-1-morpholin-4-ylethanone
  • MW: 356.806 | Formula: C18H17ClN4O2
  • H donors: 0 H acceptors: 3 LogP: 2.25 Rotable bonds: 4
    Rule of 5 violations (Lipinski): 1
  • SMILES: Clc1ccc(cc1)c1nc2c(n1CC(=O)N1CCOCC1)nccc2
  • InChi: 1S/C18H17ClN4O2/c19-14-5-3-13(4-6-14)17-21-15-2-1-7-20-18(15)23(17)12-16(24)22-8-10-25-11-9-22/h1-7H,8-12H2
  • InChiKey: FAHWRRQOBFWCIG-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • 2-[2-(4-chlorophenyl)imidazo[4,5-b]pyridin-3-yl]-1-morpholino-ethanone
  • 2-[2-(4-chlorophenyl)-3-imidazo[4,5-b]pyridinyl]-1-morpholinoethanone
  • 2-[2-(4-chlorophenyl)imidazo[4,5-b]pyridin-3-yl]-1-morpholin-4-yl-ethanone
  • 2-[2-(4-chlorophenyl)imidazo[5,4-b]pyridin-3-yl]-1-morpholin-4-ylethanone
  • 2-[2-(4-chlorophenyl)imidazo[5,4-b]pyridin-3-yl]-1-morpholino-ethanone
  • 2-[2-(4-chlorophenyl)-3-imidazo[5,4-b]pyridinyl]-1-morpholinoethanone
  • 2-[2-(4-chlorophenyl)imidazo[5,4-b]pyridin-3-yl]-1-morpholin-4-yl-ethanone

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Rattus norvegicus GABA-A receptor; anion channel Starlite/ChEMBL 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
Species Potential target Known druggable target Length Alignment span Identity
Onchocerca volvulus GABA-A receptor; anion channel   467 aa 446 aa 28.0 %
Onchocerca volvulus GABA-A receptor; anion channel   467 aa 435 aa 29.7 %
Onchocerca volvulus Large subunit GTPase 1 homolog GABA-A receptor; anion channel   467 aa 496 aa 26.0 %
Brugia malayi nicotinic acetylcholine receptor alpha subunit, putative GABA-A receptor; anion channel   467 aa 384 aa 19.5 %
Onchocerca volvulus GABA-A receptor; anion channel   467 aa 454 aa 30.4 %
Loa Loa (eye worm) hypothetical protein GABA-A receptor; anion channel   467 aa 494 aa 25.5 %
Echinococcus granulosus glycine receptor subunit alpha 1 GABA-A receptor; anion channel   467 aa 430 aa 32.3 %
Loa Loa (eye worm) hypothetical protein GABA-A receptor; anion channel   467 aa 446 aa 29.1 %
Onchocerca volvulus Gamma-aminobutyric acid receptor subunit beta homolog GABA-A receptor; anion channel   467 aa 433 aa 34.6 %
Onchocerca volvulus Eukaryotic initiation factor 4A-III homolog GABA-A receptor; anion channel   467 aa 453 aa 26.9 %
Onchocerca volvulus Acetylcholine receptor subunit alpha-type homolog GABA-A receptor; anion channel   467 aa 418 aa 19.6 %
Schistosoma mansoni Cys-loop ligand gated ion channel subunit GABA-A receptor; anion channel   467 aa 479 aa 29.2 %
Brugia malayi Neurotransmitter-gated ion-channel ligand binding domain containing protein GABA-A receptor; anion channel   467 aa 375 aa 21.9 %
Brugia malayi Neurotransmitter-gated ion-channel ligand binding domain containing protein GABA-A receptor; anion channel   467 aa 454 aa 29.5 %
Onchocerca volvulus GABA-A receptor; anion channel   467 aa 434 aa 26.7 %
Onchocerca volvulus GABA-A receptor; anion channel   467 aa 447 aa 25.7 %
Echinococcus multilocularis glycine receptor subunit beta GABA-A receptor; anion channel   467 aa 478 aa 28.7 %
Loa Loa (eye worm) nicotinic acetylcholine receptor alpha subunit GABA-A receptor; anion channel   467 aa 379 aa 19.3 %
Onchocerca volvulus GABA-A receptor; anion channel   467 aa 468 aa 28.6 %
Echinococcus granulosus glycine receptor subunit beta GABA-A receptor; anion channel   467 aa 439 aa 29.6 %
Brugia malayi Cation transporter family protein GABA-A receptor; anion channel   467 aa 453 aa 28.5 %
Echinococcus multilocularis glycine receptor subunit alpha 1 GABA-A receptor; anion channel   467 aa 430 aa 32.3 %
Loa Loa (eye worm) hypothetical protein GABA-A receptor; anion channel   467 aa 461 aa 27.8 %
Loa Loa (eye worm) hypothetical protein GABA-A receptor; anion channel   467 aa 441 aa 33.8 %
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Echinococcus multilocularis cadherin EGF LAG seven pass G type receptor 0.0017 0.0327 0.0327
Echinococcus multilocularis peptidyl prolyl cis trans isomerase FKBP4 0.0049 0.2827 0.2827
Brugia malayi Calcitonin receptor-like protein seb-1 0.0053 0.3098 0.3098
Trichomonas vaginalis conserved hypothetical protein 0.0041 0.222 0.3892
Brugia malayi Neurotransmitter-gated ion-channel transmembrane region family protein 0.0023 0.0787 0.0787
Plasmodium vivax basic transcription factor 3b, putative 0.0034 0.1688 0.2959
Trichomonas vaginalis conserved hypothetical protein 0.0034 0.1688 0.2959
Schistosoma mansoni nAChR subunit 0.0023 0.0787 0.0787
Onchocerca volvulus 0.0023 0.0787 0.0947
Trypanosoma brucei transcription factor BTF3, putative 0.0034 0.1688 0.2959
Echinococcus multilocularis fatty acid amide hydrolase 1 0.01 0.6738 0.6738
Loa Loa (eye worm) hypothetical protein 0.01 0.6738 0.6738
Loa Loa (eye worm) hypothetical protein 0.012 0.8305 0.8305
Plasmodium falciparum basic transcription factor 3b, putative 0.0034 0.1688 0.2959
Trypanosoma brucei FK506-binding protein (FKBP)-type peptidyl-prolyl isomerase, putative 0.0057 0.3431 0.6015
Schistosoma mansoni rotamase 0.0033 0.157 0.157
Echinococcus multilocularis expressed protein 0.0033 0.157 0.157
Schistosoma mansoni family M1 non-peptidase homologue (M01 family) 0.0023 0.0806 0.0806
Echinococcus granulosus nAChR subunit 0.0023 0.0787 0.0812
Brugia malayi Peptidase family M1 containing protein 0.012 0.8272 0.8272
Echinococcus granulosus chromobox protein 1 0.0073 0.471 0.4859
Onchocerca volvulus Pyruvate kinase homolog 0.0033 0.1566 0.1886
Schistosoma mansoni immunophilin 0.0057 0.3431 0.3431
Echinococcus multilocularis thyroid hormone receptor alpha 0.0133 0.9324 0.9324
Echinococcus multilocularis glycine receptor subunit beta 0.0023 0.0787 0.0787
Echinococcus granulosus expressed protein 0.0033 0.157 0.1619
Trypanosoma brucei Aminopeptidase M1, putative 0.0035 0.1761 0.3087
Toxoplasma gondii pyruvate kinase PyK1 0.0033 0.1566 0.2746
Leishmania major pyruvate kinase 0.0033 0.1566 0.2746
Echinococcus multilocularis transcription factor btf3 0.0034 0.1688 0.1688
Schistosoma mansoni Cys-loop ligand gated ion channel subunit 0.0023 0.0787 0.0787
Chlamydia trachomatis pyruvate kinase 0.0033 0.1566 0.5
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0053 0.3098 0.3098
Echinococcus multilocularis GPCR, family 2 0.0017 0.0327 0.0327
Brugia malayi Peptidase family M1 containing protein 0.0035 0.1761 0.1761
Loa Loa (eye worm) Pin1-type peptidyl-prolyl cis-trans isomerase 0.0033 0.157 0.157
Echinococcus multilocularis gcn5proteinral control of amino acid synthesis 0.0142 1 1
Trypanosoma brucei pyruvate kinase 1, putative 0.0033 0.1566 0.2746
Plasmodium falciparum peptidyl-prolyl cis-trans isomerase FKBP35 0.0057 0.3431 0.6015
Loa Loa (eye worm) pyruvate kinase 0.0033 0.1566 0.1566
Loa Loa (eye worm) glutamate-gated chloride channel alpha3A subunit 0.0023 0.0787 0.0787
Loa Loa (eye worm) hypothetical protein 0.0041 0.222 0.222
Echinococcus multilocularis nicotinic acetylcholine receptor beta 1 subunit 0.0023 0.0787 0.0787
Schistosoma mansoni methionyl aminopeptidase 2 (M24 family) 0.0086 0.5704 0.5704
Giardia lamblia Methionine aminopeptidase 0.0086 0.5704 1
Brugia malayi hypothetical protein 0.0035 0.1761 0.1761
Brugia malayi gamma-aminobutyric-acid receptor beta subunit precursor 0.0023 0.0787 0.0787
Entamoeba histolytica peptidyl-prolyl cis-trans isomerase, FKBP-type, putative 0.0057 0.3431 0.5361
Plasmodium vivax pyruvate kinase 2, putative 0.0017 0.0339 0.0595
Echinococcus multilocularis peptidyl prolyl cis trans isomerase FKBP4 0.0057 0.3431 0.3431
Trypanosoma cruzi peptidyl-prolyl cis-trans isomerase, putative 0.0057 0.3431 0.6015
Brugia malayi Neurotransmitter-gated ion-channel ligand binding domain containing protein 0.0023 0.0787 0.0787
Brugia malayi FKBP-type peptidyl-prolyl cis-trans isomerase-59, BmFKBP59 0.0057 0.3431 0.3431
Brugia malayi acetylcholine receptor alpha subunit precursor, putative 0.0023 0.0787 0.0787
Mycobacterium ulcerans aminopeptidase N PepN 0.0035 0.1761 0.5133
Echinococcus multilocularis puromycin sensitive aminopeptidase 0.0035 0.1761 0.1761
Leishmania major aminopeptidase, putative,metallo-peptidase, Clan MA(E), Family M1 0.0035 0.1761 0.3087
Plasmodium falciparum pyruvate kinase 2 0.0017 0.0339 0.0595
Loa Loa (eye worm) peptidase family M1 containing protein 0.0097 0.6511 0.6511
Loa Loa (eye worm) hypothetical protein 0.0023 0.0787 0.0787
Schistosoma mansoni nAChR subunit (ShAR1-beta2-like) 0.0023 0.0787 0.0787
Onchocerca volvulus Heterochromatin protein 1 homolog 0.0041 0.222 0.2674
Plasmodium falciparum pyruvate kinase 0.0033 0.1566 0.2746
Loa Loa (eye worm) hypothetical protein 0.0023 0.0787 0.0787
Echinococcus granulosus puromycin sensitive aminopeptidase 0.0035 0.1761 0.1817
Trypanosoma brucei peptidyl-prolyl cis-trans isomerase, putative 0.0057 0.3431 0.6015
Loa Loa (eye worm) acetylcholine receptor alpha subunit 0.0023 0.0787 0.0787
Schistosoma mansoni immunophilin FK506 binding protein FKBP12 0.0057 0.3431 0.3431
Loa Loa (eye worm) hypothetical protein 0.0023 0.0787 0.0787
Echinococcus granulosus glycine receptor subunit alpha 1 0.0023 0.0787 0.0812
Echinococcus granulosus nicotinic acetylcholine receptor subunit alpha 8 0.0023 0.0787 0.0812
Echinococcus granulosus fatty acid amide hydrolase 1 0.01 0.6738 0.6951
Brugia malayi Pyruvate kinase, muscle isozyme 0.0033 0.1566 0.1566
Schistosoma mansoni nAChR subunit (ShAR1-alpha-like) 0.0023 0.0787 0.0787
Leishmania major pyruvate kinase 0.0033 0.1566 0.2746
Giardia lamblia Histone acetyltransferase GCN5 0.0038 0.1998 0.3092
Brugia malayi initiation factor 2-associated protein. 0.0086 0.5704 0.5704
Trypanosoma cruzi pyruvate kinase 2, putative 0.0033 0.1566 0.2746
Trypanosoma cruzi aminopeptidase, putative 0.0035 0.1761 0.3087
Loa Loa (eye worm) ligand-Gated ion Channel family member 0.0023 0.0787 0.0787
Echinococcus granulosus nicotinic acetylcholine receptor beta 1 subunit 0.0023 0.0787 0.0812
Toxoplasma gondii histone lysine acetyltransferase GCN5-A 0.0042 0.2267 0.3973
Brugia malayi Pyruvate kinase, M2 isozyme 0.0033 0.1566 0.1566
Loa Loa (eye worm) hypothetical protein 0.0023 0.0806 0.0806
Echinococcus multilocularis glycine receptor subunit alpha 1 0.0023 0.0787 0.0787
Schistosoma mansoni aminopeptidase PILS (M01 family) 0.0035 0.1761 0.1761
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.0017 0.0327 0.0338
Echinococcus multilocularis nicotinic acetylcholine receptor a11 subunit 0.0023 0.0787 0.0787
Plasmodium falciparum histone acetyltransferase GCN5 0.0038 0.1998 0.3503
Schistosoma mansoni nAChR subunit 0.0023 0.0787 0.0787
Onchocerca volvulus Pyruvate kinase homolog 0.0033 0.1566 0.1886
Schistosoma mansoni gcn5proteinral control of amino-acid synthesis 5-like 2 gcnl2 0.0142 1 1
Echinococcus multilocularis neuronal acetylcholine receptor subunit alpha 4 0.0023 0.0787 0.0787
Schistosoma mansoni pyruvate kinase 0.0017 0.0339 0.0339
Loa Loa (eye worm) hypothetical protein 0.012 0.8305 0.8305
Echinococcus granulosus methionyl aminopeptidase 2 0.0086 0.5704 0.5885
Echinococcus multilocularis puromycin sensitive aminopeptidase 0.0035 0.1761 0.1761
Brugia malayi latrophilin 2 splice variant baaae 0.0036 0.1816 0.1816
Trichomonas vaginalis bromodomain-containing protein, putative 0.0042 0.2267 0.3973
Loa Loa (eye worm) hypothetical protein 0.0107 0.7317 0.7317
Trypanosoma brucei pyruvate kinase 1 0.0033 0.1566 0.2746
Loa Loa (eye worm) hypothetical protein 0.0023 0.0787 0.0787
Echinococcus multilocularis acetylcholine receptor subunit beta 1 0.0023 0.0787 0.0787
Trichomonas vaginalis conserved hypothetical protein 0.0029 0.1293 0.2267
Brugia malayi nicotinic acetylcholine receptor beta-1 chain precursor 0.0023 0.0787 0.0787
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.0017 0.0327 0.0327
Echinococcus multilocularis glycine receptor subunit alpha 1 0.0023 0.0787 0.0787
Loa Loa (eye worm) aminopeptidase N 0.0035 0.1761 0.1761
Schistosoma mansoni cytosol alanyl aminopeptidase (M01 family) 0.0035 0.1761 0.1761
Giardia lamblia Pyruvate kinase 0.0033 0.1566 0.2287
Schistosoma mansoni immunophilin 0.0049 0.2827 0.2827
Onchocerca volvulus Huntingtin homolog 0.012 0.8305 1
Trypanosoma brucei peptidyl-prolyl cis-trans isomerase/rotamase, putative 0.0032 0.151 0.2647
Trichomonas vaginalis conserved hypothetical protein 0.0033 0.157 0.2752
Entamoeba histolytica peptidyl-prolyl cis-trans isomerase, FKBP-type , putative 0.0057 0.3431 0.5361
Brugia malayi Hypothetical glycine receptor like protein T20B12.9 in chromosome III 0.0023 0.0787 0.0787
Schistosoma mansoni chromobox protein 0.0073 0.471 0.471
Brugia malayi excitatory GABA receptor EXP-1A 0.0023 0.0787 0.0787
Echinococcus multilocularis fatty acid amide hydrolase 1 0.01 0.6738 0.6738
Schistosoma mansoni thyroid hormone receptor 0.0133 0.9324 0.9324
Onchocerca volvulus 0.0032 0.1534 0.1848
Echinococcus granulosus pyruvate kinase 0.0017 0.0339 0.035
Trichomonas vaginalis conserved hypothetical protein 0.0034 0.1688 0.2959
Brugia malayi nicotinic acetylcholine receptor alpha subunit, putative 0.0023 0.0787 0.0787
Loa Loa (eye worm) initiation factor 2-associated protein 0.0086 0.5704 0.5704
Trypanosoma cruzi transcription factor btf3, putative 0.0034 0.1688 0.2959
Toxoplasma gondii pyruvate kinase PyKII 0.0017 0.0339 0.0595
Loa Loa (eye worm) hypothetical protein 0.0023 0.0787 0.0787
Giardia lamblia FKBP-type peptidyl-prolyl cis-trans isomerase 0.0057 0.3431 0.5763
Trypanosoma cruzi transcription factor btf3, putative 0.0034 0.1688 0.2959
Trichomonas vaginalis rotamase, putative 0.0032 0.151 0.2647
Echinococcus multilocularis chromobox protein 1 0.0073 0.471 0.471
Leishmania major fk506-binding protein 1-like protein 0.0057 0.3431 0.6015
Echinococcus granulosus Mitotic checkpoint protein PRCC C terminal 0.0123 0.856 0.8832
Echinococcus multilocularis pyruvate kinase 0.0033 0.1566 0.1566
Brugia malayi Pin1-type peptidyl-prolyl cis-trans isomerase, BmPin1 0.0033 0.157 0.157
Echinococcus multilocularis pyruvate kinase 0.0017 0.0339 0.0339
Schistosoma mansoni fatty-acid amide hydrolase 0.01 0.6738 0.6738
Brugia malayi Neurotransmitter-gated ion-channel ligand binding domain containing protein 0.0023 0.0787 0.0787
Schistosoma mansoni chromobox protein 0.0073 0.471 0.471
Onchocerca volvulus 0.0023 0.0787 0.0947
Leishmania major peptidyl-prolyl cis-trans isomerase/rotamase, putative,PPIase, putative 0.0032 0.151 0.2647
Schistosoma mansoni nAChR subunit 0.0023 0.0787 0.0787
Trypanosoma cruzi metallo-peptidase, Clan MG, Family M24 0.0086 0.5704 1
Loa Loa (eye worm) hypothetical protein 0.0036 0.1816 0.1816
Trichomonas vaginalis Clan MA, family M1, aminopeptidase N-like metallopeptidase 0.0035 0.1761 0.3087
Trichomonas vaginalis Clan MG, familly M24, aminopeptidase P-like metallopeptidase 0.0086 0.5704 1
Echinococcus multilocularis pyruvate kinase 0.0017 0.0339 0.0339
Loa Loa (eye worm) hypothetical protein 0.0084 0.5556 0.5556
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.0017 0.0327 0.0327
Brugia malayi Neurotransmitter-gated ion-channel ligand binding domain containing protein 0.0023 0.0787 0.0787
Schistosoma mansoni Cys-loop ligand gated ion channel subunit 0.0023 0.0787 0.0787
Schistosoma mansoni nAChR subunit (ShAR1-beta-like) 0.0023 0.0787 0.0787
Trichomonas vaginalis peptidylprolyl isomerase, putative 0.0057 0.3431 0.6015
Trypanosoma brucei methionine aminopeptidase 2, putative 0.0086 0.5704 1
Plasmodium vivax 70 kDa peptidylprolyl isomerase, putative 0.0057 0.3431 0.6015
Loa Loa (eye worm) hypothetical protein 0.0049 0.2827 0.2827
Echinococcus granulosus nicotinic acetylcholine receptor a11 subunit 0.0023 0.0787 0.0812
Echinococcus multilocularis puromycin sensitive aminopeptidase 0.0023 0.0806 0.0806
Trypanosoma cruzi FK506-binding protein (FKBP)-type peptidyl-prolyl isomerase, putative 0.0057 0.3431 0.6015
Echinococcus granulosus acetylcholine receptor subunit beta 1 0.0023 0.0787 0.0812
Echinococcus multilocularis pyruvate kinase 0.0026 0.1035 0.1035
Echinococcus granulosus histone acetyltransferase KAT2B 0.0138 0.9693 1
Onchocerca volvulus Methionine aminopeptidase 2 homolog 0.0086 0.5704 0.6869
Onchocerca volvulus 0.0023 0.0787 0.0947
Trypanosoma brucei metallo-peptidase, Clan MA(E) Family M1 0.0035 0.1761 0.3087
Echinococcus multilocularis methionyl aminopeptidase 2 0.0086 0.5704 0.5704
Loa Loa (eye worm) pyruvate kinase-PB 0.0023 0.0803 0.0803
Loa Loa (eye worm) LGC-31 protein 0.0023 0.0787 0.0787
Loa Loa (eye worm) hypothetical protein 0.0053 0.3098 0.3098
Loa Loa (eye worm) latrophilin receptor protein 2 0.0017 0.0327 0.0327
Trichomonas vaginalis chromobox protein, putative 0.0044 0.2461 0.4315
Trypanosoma cruzi peptidyl-prolyl cis-trans isomerase, putative 0.0057 0.3431 0.6015
Toxoplasma gondii NAC domain-containing protein 0.0034 0.1688 0.2959
Mycobacterium leprae Probable pyruvate kinase PykA 0.0033 0.1566 0.5
Schistosoma mansoni nAChR subunit 0.0023 0.0787 0.0787
Trypanosoma cruzi pyruvate kinase 2, putative 0.0033 0.1566 0.2746
Giardia lamblia 70 kDa peptidylprolyl isomerase, putative 0.0057 0.3431 0.5763
Echinococcus multilocularis Peptidase M1, membrane alanine aminopeptidase, N terminal 0.0035 0.1761 0.1761
Schistosoma mansoni nAChR subunit 0.0023 0.0787 0.0787
Brugia malayi Cation transporter family protein 0.0023 0.0787 0.0787
Loa Loa (eye worm) ICD-1 protein 0.0034 0.1688 0.1688
Trichomonas vaginalis rotamase, putative 0.0033 0.157 0.2752
Echinococcus granulosus cadherin EGF LAG seven pass G type receptor 0.0017 0.0327 0.0338
Loa Loa (eye worm) FKBP5 protein 0.0057 0.3431 0.3431
Schistosoma mansoni hypothetical protein 0.0017 0.0327 0.0327
Schistosoma mansoni nAChR subunit 0.0023 0.0787 0.0787
Echinococcus granulosus glycine receptor subunit alpha 1 0.0023 0.0787 0.0812
Echinococcus granulosus nicotinic acetylcholine receptor alpha subunit 0.0023 0.0787 0.0812
Loa Loa (eye worm) pyruvate kinase 0.0033 0.1566 0.1566
Echinococcus granulosus pyruvate kinase 0.0033 0.1566 0.1616
Schistosoma mansoni pyruvate kinase 0.0033 0.1566 0.1566
Plasmodium vivax methionine aminopeptidase 2, putative 0.0086 0.5704 1
Echinococcus granulosus fatty acid amide hydrolase 1 0.01 0.6738 0.6951
Mycobacterium ulcerans pyruvate kinase 0.0033 0.1566 0.4565
Onchocerca volvulus 0.0023 0.0787 0.0947
Trichomonas vaginalis cat eye syndrome critical region protein 2, cscr2, putative 0.0042 0.2267 0.3973
Echinococcus granulosus pyruvate kinase 0.0017 0.0339 0.035
Loa Loa (eye worm) hypothetical protein 0.0023 0.0787 0.0787
Trichomonas vaginalis conserved hypothetical protein 0.0034 0.1688 0.2959
Onchocerca volvulus Putative nachr subunit 0.0023 0.0787 0.0947
Echinococcus granulosus chromobox protein 1 0.0073 0.471 0.4859
Trypanosoma cruzi metallo-peptidase, Clan MA(E) Family M1 0.0023 0.0806 0.1413
Trichomonas vaginalis fk506-binding protein, putative 0.0057 0.3431 0.6015
Trypanosoma cruzi metallo-peptidase, Clan MG, Family M24 0.0086 0.5704 1
Onchocerca volvulus 0.012 0.8272 0.9961
Brugia malayi Neurotransmitter-gated ion-channel ligand binding domain containing protein 0.0023 0.0787 0.0787
Loa Loa (eye worm) hypothetical protein 0.0033 0.1566 0.1566
Brugia malayi acetylcholine receptor protein, alpha-like chain, putative 0.0023 0.0787 0.0787
Echinococcus granulosus histone acetyltransferase KAT2B 0.0042 0.2267 0.2338
Loa Loa (eye worm) heterochromatin protein 1 0.0073 0.471 0.471
Loa Loa (eye worm) FKBP-type peptidyl-prolyl cis-trans isomerase-12 0.0057 0.3431 0.3431
Schistosoma mansoni transcription factor btf3 0.0034 0.1688 0.1688
Loa Loa (eye worm) hypothetical protein 0.0023 0.0787 0.0787
Echinococcus multilocularis Cys loop ligand gated ion channel subunit 0.0023 0.0787 0.0787
Entamoeba histolytica peptidyl-prolyl cis-trans isomerase, putative 0.0032 0.151 0.1442
Schistosoma mansoni thyroid hormone receptor 0.0133 0.9324 0.9324
Echinococcus multilocularis aminopeptidase N 0.012 0.8272 0.8272
Loa Loa (eye worm) pyruvate kinase 0.0033 0.1566 0.1566
Trichomonas vaginalis Clan MG, familly M24, aminopeptidase P-like metallopeptidase 0.0086 0.5704 1
Echinococcus granulosus aminopeptidase N 0.012 0.8272 0.8534
Echinococcus granulosus transcription factor btf3 0.0034 0.1688 0.1741
Loa Loa (eye worm) nicotinic acetylcholine receptor alpha subunit 0.0023 0.0787 0.0787
Loa Loa (eye worm) hypothetical protein 0.0023 0.0787 0.0787
Brugia malayi Heterochromatin protein 1 0.0073 0.471 0.471
Echinococcus granulosus glycine receptor subunit beta 0.0023 0.0787 0.0812
Trypanosoma cruzi metallo-peptidase, clan MA(E), family M1, putative 0.0035 0.1761 0.3087
Trypanosoma cruzi Aminopeptidase M1, putative 0.0035 0.1761 0.3087
Echinococcus multilocularis glycine receptor subunit alpha 1 0.0023 0.0787 0.0787
Echinococcus granulosus neuronal acetylcholine receptor subunit alpha 4 0.0023 0.0787 0.0812
Entamoeba histolytica acetyltransferase, GNAT family 0.0038 0.1998 0.2438
Entamoeba histolytica aminopeptidase, putative 0.0035 0.1761 0.1954
Echinococcus multilocularis pyruvate kinase 0.0033 0.1566 0.1566
Echinococcus granulosus puromycin sensitive aminopeptidase 0.0035 0.1761 0.1817
Trichomonas vaginalis Clan MA, family M1, aminopeptidase N-like metallopeptidase 0.0035 0.1761 0.3087
Loa Loa (eye worm) hypothetical protein 0.0023 0.0787 0.0787
Leishmania major peptidylprolyl isomerase-like protein 0.0057 0.3431 0.6015
Loa Loa (eye worm) hypothetical protein 0.0032 0.1534 0.1534
Echinococcus granulosus glycine receptor subunit alpha 1 0.0023 0.0787 0.0812
Echinococcus granulosus peptidyl prolyl cis trans isomerase FKBP1A 0.0057 0.3431 0.354
Brugia malayi FKBP-type peptidyl-prolyl cis-trans isomerase-12, BmFKBP-12 0.0057 0.3431 0.3431
Loa Loa (eye worm) hypothetical protein 0.0017 0.0327 0.0327
Loa Loa (eye worm) hypothetical protein 0.0023 0.0787 0.0787
Onchocerca volvulus Heterochromatin protein 1 homolog 0.0044 0.2461 0.2964
Loa Loa (eye worm) hypothetical protein 0.0023 0.0787 0.0787
Schistosoma mansoni hypothetical protein 0.0017 0.0327 0.0327
Loa Loa (eye worm) hypothetical protein 0.0023 0.0787 0.0787
Schistosoma mansoni hypothetical protein 0.0036 0.1816 0.1816
Trichomonas vaginalis Clan MG, familly M24, aminopeptidase P-like metallopeptidase 0.0086 0.5704 1
Onchocerca volvulus 0.0023 0.0787 0.0947
Trichomonas vaginalis conserved hypothetical protein 0.0041 0.222 0.3892
Schistosoma mansoni hypothetical protein 0.0017 0.0327 0.0327
Loa Loa (eye worm) hypothetical protein 0.0023 0.0787 0.0787
Leishmania major aminopeptidase-like protein,metallo-peptidase, Clan MA(E), Family M1 0.0035 0.1761 0.3087
Entamoeba histolytica methionine aminopeptidase, putative 0.0086 0.5704 1
Loa Loa (eye worm) hypothetical protein 0.0023 0.0787 0.0787
Leishmania major basic transcription factor 3a, putative 0.0034 0.1688 0.2959
Onchocerca volvulus Pyruvate kinase homolog 0.0033 0.1566 0.1886
Trichomonas vaginalis Clan MG, familly M24, aminopeptidase P-like metallopeptidase 0.0086 0.5704 1
Brugia malayi Cation transporter family protein 0.0023 0.0787 0.0787
Echinococcus granulosus glycine receptor subunit beta 0.0023 0.0787 0.0812
Brugia malayi Neurotransmitter-gated ion-channel transmembrane region family protein 0.0023 0.0787 0.0787
Loa Loa (eye worm) ACC-1 protein 0.0023 0.0787 0.0787
Echinococcus granulosus pyruvate kinase 0.0033 0.1566 0.1616
Trypanosoma cruzi peptidyl-prolyl cis-trans isomerase 0.0032 0.151 0.2647
Echinococcus multilocularis puromycin sensitive aminopeptidase 0.0035 0.1761 0.1761
Plasmodium falciparum methionine aminopeptidase 2 0.0086 0.5704 1
Echinococcus granulosus peptidyl prolyl cis trans isomerase FKBP4 0.0057 0.3431 0.354
Onchocerca volvulus Huntingtin homolog 0.012 0.8305 1
Echinococcus multilocularis glycine receptor subunit beta 0.0023 0.0787 0.0787
Treponema pallidum peptidyl-prolyl cis-trans isomerase, FKBP-type, 22 kDa (fklB) 0.0057 0.3431 0.5
Loa Loa (eye worm) hypothetical protein 0.0023 0.0787 0.0787
Loa Loa (eye worm) acetyltransferase 0.0142 1 1
Echinococcus multilocularis chromobox protein 1 0.0073 0.471 0.471
Loa Loa (eye worm) hypothetical protein 0.0023 0.0787 0.0787
Mycobacterium ulcerans FK-506 binding protein, peptidyl-prolyl cis-trans isomerase 0.0057 0.3431 1
Toxoplasma gondii peptidylprolyl isomerase 0.0032 0.151 0.2647
Plasmodium vivax histone acetyltransferase GCN5, putative 0.0042 0.2267 0.3973
Schistosoma mansoni amidase 0.01 0.6738 0.6738
Echinococcus multilocularis puromycin sensitive aminopeptidase 0.0035 0.1761 0.1761
Loa Loa (eye worm) hypothetical protein 0.0023 0.0787 0.0787
Brugia malayi hypothetical protein 0.012 0.8305 0.8305
Mycobacterium tuberculosis Probable pyruvate kinase PykA 0.0033 0.1566 0.5
Echinococcus granulosus puromycin sensitive aminopeptidase 0.0035 0.1761 0.1817
Schistosoma mansoni immunophilin 0.0057 0.3431 0.3431
Brugia malayi Latrophilin receptor protein 2 0.0017 0.0327 0.0327
Toxoplasma gondii methionine aminopeptidase 2, putative 0.0086 0.5704 1
Loa Loa (eye worm) hypothetical protein 0.0023 0.0806 0.0806
Loa Loa (eye worm) excitatory GABA receptor EXP-1A 0.0023 0.0787 0.0787
Echinococcus multilocularis pyruvate kinase 0.0017 0.0339 0.0339
Brugia malayi amidase 0.01 0.6738 0.6738
Echinococcus multilocularis nicotinic acetylcholine receptor subunit alpha 8 0.0023 0.0787 0.0787
Schistosoma mansoni nAChR subunit 0.0023 0.0787 0.0787
Brugia malayi Neurotransmitter-gated ion-channel transmembrane region family protein 0.0023 0.0787 0.0787
Entamoeba histolytica hypothetical protein 0.0034 0.1688 0.1804
Loa Loa (eye worm) hypothetical protein 0.0023 0.0787 0.0787
Schistosoma mansoni hypothetical protein 0.0017 0.0327 0.0327
Loa Loa (eye worm) ACC-1 protein 0.0023 0.0787 0.0787
Trypanosoma cruzi peptidyl-prolyl cis-trans isomerase 0.0032 0.151 0.2647
Entamoeba histolytica transcription factor BTF3, putative 0.0034 0.1688 0.1804
Brugia malayi beta-NAC-like protein 0.0034 0.1688 0.1688
Echinococcus granulosus GPCR family 2 0.0017 0.0327 0.0338
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0053 0.3098 0.3098
Schistosoma mansoni hypothetical protein 0.0123 0.856 0.856
Echinococcus granulosus Cys loop ligand gated ion channel subunit 0.0023 0.0787 0.0812
Schistosoma mansoni pyruvate kinase 0.0033 0.1566 0.1566
Loa Loa (eye worm) hypothetical protein 0.0023 0.0803 0.0803
Trichomonas vaginalis pyruvate kinase, putative 0.0033 0.1566 0.2746
Loa Loa (eye worm) nicotinic acetylcholine receptor non-alpha subunit 0.0023 0.0787 0.0787
Trypanosoma brucei Aminopeptidase M1, putative 0.0035 0.1761 0.3087
Plasmodium vivax pyruvate kinase, putative 0.0033 0.1566 0.2746
Brugia malayi acetylcholine receptor, alpha-type subunit unc-38 precursor 0.0023 0.0787 0.0787
Echinococcus multilocularis nAChR subunit 0.0023 0.0787 0.0787
Leishmania major methionine aminopeptidase 2, putative 0.0086 0.5704 1
Echinococcus multilocularis fk506 binding protein 0.0057 0.3431 0.3431
Echinococcus granulosus peptidyl prolyl cis trans isomerase FKBP4 0.0049 0.2827 0.2917
Trypanosoma cruzi FK506-binding protein (FKBP)-type peptidyl-prolyl isomerase, putative 0.0057 0.3431 0.6015
Loa Loa (eye worm) hypothetical protein 0.0023 0.0787 0.0787
Onchocerca volvulus 0.0023 0.0787 0.0947
Brugia malayi Neurotransmitter-gated ion-channel ligand binding domain containing protein 0.0023 0.0787 0.0787
Brugia malayi Neurotransmitter-gated ion-channel ligand binding domain containing protein 0.0023 0.0787 0.0787
Echinococcus multilocularis Mitotic checkpoint protein PRCC, C terminal 0.0123 0.856 0.856
Trypanosoma brucei metallo-peptidase, Clan MG, Family M24 0.0086 0.5704 1
Echinococcus granulosus nicotinic acetylcholine receptor subunit type 0.0023 0.0787 0.0812
Trichomonas vaginalis immunophilin, putative 0.0057 0.3431 0.6015
Echinococcus granulosus puromycin sensitive aminopeptidase 0.0035 0.1761 0.1817
Trichomonas vaginalis chromobox protein, putative 0.0073 0.471 0.8256
Trichomonas vaginalis pyruvate kinase, putative 0.0033 0.1566 0.2746
Trichomonas vaginalis chromobox protein, putative 0.0073 0.471 0.8256
Trichomonas vaginalis conserved hypothetical protein 0.0029 0.1293 0.2267
Toxoplasma gondii histone lysine acetyltransferase GCN5-B 0.0042 0.2267 0.3973
Echinococcus multilocularis puromycin sensitive aminopeptidase 0.0035 0.1761 0.1761
Echinococcus granulosus pyruvate kinase 0.0017 0.0339 0.035
Trichomonas vaginalis chromobox protein, putative 0.0044 0.2461 0.4315
Echinococcus multilocularis nicotinic acetylcholine receptor alpha subunit 0.0023 0.0787 0.0787
Onchocerca volvulus 0.0035 0.1761 0.2121
Schistosoma mansoni Cys-loop ligand gated ion channel subunit 0.0023 0.0787 0.0787
Brugia malayi chromobox protein homolog 3 0.0041 0.222 0.222
Trichomonas vaginalis peptidylprolyl isomerase, putative 0.0057 0.3431 0.6015
Brugia malayi Cation transporter family protein 0.0023 0.0787 0.0787

Activities

Activity type Activity value Assay description Source Reference
ED50 (functional) = 11.5 mg kg-1 Anticonvulsant activity against pentylenetetrazole-induced clonic seizures in mice ChEMBL. 1681105
ED50 (functional) = 11.5 mg kg-1 Anticonvulsant activity against pentylenetetrazole-induced clonic seizures in mice ChEMBL. 1681105
IC50 (binding) = 4100 nM Displacement of [3H]-flunitrazepam from GABA-A benzodiazepine receptor of rat cerebral cortex membrane ChEMBL. 1681105
IC50 (binding) = 4100 nM Displacement of [3H]-flunitrazepam from GABA-A benzodiazepine receptor of rat cerebral cortex membrane ChEMBL. 1681105

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

1 literature reference was collected for this gene.

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