Detailed information for compound 1466704

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 453.456 | Formula: C25H22F3N3O2
  • H donors: 2 H acceptors: 3 LogP: 3.96 Rotable bonds: 4
    Rule of 5 violations (Lipinski): 1
  • SMILES: O=C1CC(=Nc2c(N1)cc(c(c2)C)C(F)(F)F)c1cccc(c1)c1ccnc(c1)C(O)(C)C
  • InChi: 1S/C25H22F3N3O2/c1-14-9-20-21(12-18(14)25(26,27)28)31-23(32)13-19(30-20)17-6-4-5-15(10-17)16-7-8-29-22(11-16)24(2,3)33/h4-12,33H,13H2,1-3H3,(H,31,32)
  • InChiKey: MFJCYGFNJGDDOS-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

No synonyms found for this compound

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Rattus norvegicus Metabotropic glutamate receptor 2 Starlite/ChEMBL References

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_127095 All targets in OG5_127095
Schistosoma mansoni metabotropic glutamate receptor Get druggable targets OG5_127095 All targets in OG5_127095
Schistosoma japonicum ko:K04606 glutamate receptor, metabotropic 3, putative Get druggable targets OG5_127095 All targets in OG5_127095
Echinococcus granulosus metabotropic glutamate receptor 5 Get druggable targets OG5_127095 All targets in OG5_127095
Brugia malayi Metabotropic glutamate receptor precursor. Get druggable targets OG5_127095 All targets in OG5_127095
Echinococcus multilocularis metabotropic glutamate receptor 5 Get druggable targets OG5_127095 All targets in OG5_127095
Schistosoma japonicum hypothetical protein Get druggable targets OG5_127095 All targets in OG5_127095
Brugia malayi metabotropic glutamate receptor subtype 5a (mGluR5a), putative Get druggable targets OG5_127095 All targets in OG5_127095
Schistosoma mansoni metabotropic glutamate receptor 2 3 (mglur group 2) Get druggable targets OG5_127095 All targets in OG5_127095
Loa Loa (eye worm) glutamate receptor Get druggable targets OG5_127095 All targets in OG5_127095
Schistosoma japonicum Metabotropic glutamate receptor precursor, putative Get druggable targets OG5_127095 All targets in OG5_127095
Echinococcus multilocularis metabotropic glutamate receptor 2 Get druggable targets OG5_127095 All targets in OG5_127095
Echinococcus granulosus metabotropic glutamate receptor 2 Get druggable targets OG5_127095 All targets in OG5_127095
By sequence similarity to non orthologous known druggable targets
Species Potential target Known druggable target Length Alignment span Identity
Onchocerca volvulus Metabotropic glutamate receptor 2   872 aa 774 aa 20.4 %
Loa Loa (eye worm) hypothetical protein Metabotropic glutamate receptor 2   872 aa 822 aa 21.2 %
Onchocerca volvulus Golgi-associated plant pathogenesis-related protein 1 homolog Metabotropic glutamate receptor 2   872 aa 884 aa 35.3 %
Schistosoma mansoni metabotropic glutamate receptor Metabotropic glutamate receptor 2   872 aa 892 aa 26.9 %
Onchocerca volvulus Cell death abnormality protein 8 homolog Metabotropic glutamate receptor 2   872 aa 883 aa 43.3 %
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Plasmodium vivax AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.002 0.0343 0.3656
Brugia malayi Nuclear hormone receptor family member nhr-14 0.0011 0.011 0.0153
Brugia malayi Matrixin family protein 0.0019 0.0307 0.0716
Echinococcus multilocularis terminal deoxycytidyl transferase rev1 0.0036 0.0745 0.0731
Trichomonas vaginalis dullard protein, putative 0.0013 0.0172 0.1176
Trichomonas vaginalis penicillin-binding protein, putative 0.0036 0.0731 0.5011
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0006 0.00000000031699 0.0000000021721
Brugia malayi Nuclear hormone receptor family member nhr-1 0.0011 0.011 0.0153
Giardia lamblia Nuclear LIM interactor-interacting factor 1 0.0013 0.0172 0.0644
Trypanosoma brucei proteasome regulatory non-ATPase subunit 11 0.0017 0.027 0.1009
Echinococcus granulosus Nuclear hormone receptor family member nhr 41 0.0011 0.011 0.0094
Brugia malayi nuclear hormone receptor 0.0011 0.011 0.0153
Leishmania major DNA polymerase kappa, putative 0.0044 0.0922 0.5382
Onchocerca volvulus Matrix metalloproteinase homolog 0.0042 0.0877 0.2829
Trypanosoma brucei DNA polymerase kappa, putative 0.0065 0.1459 0.8983
Echinococcus granulosus aldehyde dehydrogenase mitochondrial 0.0061 0.1347 0.1333
Loa Loa (eye worm) hypothetical protein 0.0036 0.0731 0.1926
Schistosoma mansoni cpg binding protein 0.003 0.0593 0.0578
Echinococcus granulosus 26S proteasome regulatory subunit N11 0.0017 0.027 0.0255
Echinococcus granulosus transcription factor Dp 1 0.0041 0.0864 0.085
Trypanosoma cruzi ATP-dependent DEAD/H DNA helicase recQ, putative 0.0016 0.023 0.074
Echinococcus multilocularis ecdysone induced protein 78C 0.0011 0.011 0.0094
Toxoplasma gondii ATP-dependent DNA helicase, RecQ family protein 0.0026 0.0482 0.2953
Brugia malayi Hypothetical 35.8 kDa protein F37A4.5 in chromosome III 0.0023 0.0406 0.1001
Treponema pallidum exodeoxyribonuclease (exoA) 0.002 0.0343 1
Mycobacterium tuberculosis Probable lipase LipD 0.0036 0.0731 0.1295
Loa Loa (eye worm) hypothetical protein 0.0011 0.011 0.0145
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0006 0.00000000031699 0.0000000021721
Loa Loa (eye worm) hypothetical protein 0.001 0.0085 0.0076
Trypanosoma brucei DNA polymerase kappa, putative 0.0065 0.1459 0.8983
Loa Loa (eye worm) hypothetical protein 0.0031 0.0607 0.157
Loa Loa (eye worm) nuclear hormone receptor family member nhr-41 0.0011 0.011 0.0145
Loa Loa (eye worm) hypothetical protein 0.0023 0.0409 0.1001
Echinococcus multilocularis metabotropic glutamate receptor 5 0.0075 0.1713 0.17
Echinococcus granulosus tyrosyl DNA phosphodiesterase 1 0.0071 0.1611 0.1598
Loa Loa (eye worm) hypothetical protein 0.0064 0.1429 0.3926
Trypanosoma cruzi apurinic/apyrimidinic endonuclease, putative 0.002 0.0343 0.1499
Schistosoma mansoni metabotropic glutamate receptor 2 3 (mglur group 2) 0.0069 0.157 0.1557
Loa Loa (eye worm) hypothetical protein 0.0011 0.011 0.0145
Loa Loa (eye worm) hypothetical protein 0.0011 0.011 0.0145
Echinococcus granulosus DNA apurinic or apyrimidinic site lyase 0.002 0.0343 0.0328
Trypanosoma brucei DNA polymerase kappa, putative 0.0065 0.1459 0.8983
Echinococcus multilocularis Carboxy terminal domain RNA polymerase II 0.0013 0.0172 0.0156
Echinococcus multilocularis ATP dependent DNA helicase Q5 0.0031 0.0607 0.0592
Trichomonas vaginalis dullard protein, putative 0.0013 0.0172 0.1176
Brugia malayi Steroid receptor seven-up type 2 0.0011 0.011 0.0153
Brugia malayi ATP-dependent DNA helicase, RecQ family protein 0.0031 0.0607 0.1577
Toxoplasma gondii histone lysine methyltransferase SET1 0.0054 0.119 0.8722
Schistosoma mansoni aldehyde dehydrogenase 0.0061 0.1347 0.1333
Trypanosoma cruzi DNA polymerase kappa, putative 0.0065 0.1459 0.8983
Trypanosoma brucei DNA polymerase kappa, putative 0.0044 0.0922 0.5382
Loa Loa (eye worm) nuclear hormone receptor family member nhr-1 0.0011 0.011 0.0145
Loa Loa (eye worm) hypothetical protein 0.0019 0.0307 0.0709
Onchocerca volvulus Matrilysin homolog 0.0019 0.0307 0.079
Schistosoma mansoni RAR-like nuclear receptor 0.0011 0.011 0.0094
Onchocerca volvulus 0.0027 0.0502 0.149
Trypanosoma cruzi hypothetical protein, conserved 0.0013 0.0172 0.0347
Echinococcus granulosus geminin 0.0169 0.4041 0.4032
Loa Loa (eye worm) steroid hormone receptor 0.0011 0.011 0.0145
Mycobacterium ulcerans aldehyde dehydrogenase 0.0061 0.1347 0.916
Echinococcus granulosus histone lysine N methyltransferase MLL3 0.0009 0.0059 0.0044
Echinococcus granulosus beta LACTamase domain containing family member 0.0036 0.0731 0.0717
Brugia malayi hypothetical protein 0.0122 0.2882 0.8089
Brugia malayi polk-prov protein 0.004 0.0834 0.2226
Loa Loa (eye worm) hypothetical protein 0.0036 0.0731 0.1926
Echinococcus granulosus terminal deoxycytidyl transferase rev1 0.0036 0.0745 0.0731
Schistosoma mansoni eukaryotic translation initiation factor 4h 0.0134 0.3182 0.3171
Echinococcus multilocularis 26S proteasome regulatory subunit N11 0.0023 0.0406 0.0391
Echinococcus multilocularis Nuclear hormone receptor family member nhr 41 0.0011 0.011 0.0094
Trypanosoma cruzi DNA polymerase kappa, putative 0.0065 0.1459 0.8983
Trypanosoma brucei tyrosyl-DNA Phosphodiesterase (Tdp1), putative 0.0071 0.1611 1
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0011 0.011 0.0153
Echinococcus granulosus metabotropic glutamate receptor 5 0.0075 0.1713 0.17
Trypanosoma brucei proteasome regulatory non-ATPase subunit 11 0.0017 0.027 0.1009
Loa Loa (eye worm) hypothetical protein 0.0019 0.0307 0.0709
Trichomonas vaginalis chromodomain-helicase-DNA-binding protein, putative 0.0006 0.00000000031699 0.0000000021721
Trypanosoma cruzi tyrosyl-DNA Phosphodiesterase (Tdp1), putative 0.0071 0.1611 1
Echinococcus granulosus muscleblind protein 0.0149 0.3549 0.3539
Schistosoma mansoni cpg binding protein 0.0029 0.0552 0.0537
Trypanosoma brucei Mitochondrial import inner membrane translocase subunit TIM50 0.0013 0.0172 0.0347
Trichomonas vaginalis penicillin-binding protein, putative 0.0036 0.0731 0.5011
Trypanosoma cruzi proteasome regulatory non-ATPase subunit 11, putative 0.0017 0.027 0.1009
Schistosoma mansoni tyrosyl-DNA phosphodiesterase 0.0071 0.1611 0.1598
Brugia malayi steroid hormone receptor 0.0011 0.011 0.0153
Plasmodium vivax NLI interacting factor-like phosphatase, putative 0.0013 0.0172 0.0846
Echinococcus multilocularis dnaJ subfamily B 0.0408 1 1
Echinococcus multilocularis beta LACTamase domain containing family member 0.0036 0.0731 0.0717
Mycobacterium ulcerans hypothetical protein 0.0036 0.0731 0.4565
Loa Loa (eye worm) hypothetical protein 0.0036 0.0731 0.1926
Mycobacterium tuberculosis Probable lipase LipE 0.0036 0.0731 0.1295
Mycobacterium tuberculosis Probable hydrolase 0.0036 0.0731 0.1295
Trypanosoma brucei DNA polymerase kappa, putative 0.004 0.0834 0.4789
Loa Loa (eye worm) beta-lactamase 0.0036 0.0731 0.1926
Mycobacterium ulcerans esterase/lipase LipP 0.0036 0.0731 0.4565
Brugia malayi Muscleblind-like protein 0.0149 0.3549 1
Mycobacterium tuberculosis Conserved protein 0.0036 0.0731 0.1295
Echinococcus multilocularis transcription factor Dp 1 0.0041 0.0864 0.085
Schistosoma mansoni DNA polymerase eta 0.0064 0.1429 0.1416
Schistosoma mansoni FTZ-F1 nuclear receptor-like protein 0.0011 0.011 0.0094
Brugia malayi ATP-dependent DNA helicase, RecQ family protein 0.0031 0.0607 0.1577
Toxoplasma gondii ATP-dependent DNA helicase, RecQ family protein 0.0031 0.0607 0.3971
Leishmania major DNA polymerase kappa, putative,DNA polymerase IV, putative 0.0044 0.0922 0.5382
Onchocerca volvulus Bile acid receptor homolog 0.0011 0.011 0.0087
Mycobacterium ulcerans DNA polymerase IV 0.0065 0.1459 1
Mycobacterium ulcerans aldehyde dehydrogenase 0.0061 0.1347 0.916
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0046 0.0975 0.2629
Loa Loa (eye worm) matrix metalloproteinase 0.0019 0.0307 0.0709
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0061 0.1352 0.1338
Echinococcus multilocularis GPCR, family 3, C terminal 0.001 0.0085 0.007
Schistosoma mansoni hypothetical protein 0.0408 1 1
Loa Loa (eye worm) hypothetical protein 0.0122 0.2882 0.8088
Brugia malayi Matrixin family protein 0.0019 0.0307 0.0716
Loa Loa (eye worm) exodeoxyribonuclease III family protein 0.002 0.0343 0.0814
Schistosoma mansoni thyroid hormone receptor 0.0011 0.011 0.0094
Schistosoma mansoni hypothetical protein 0.0169 0.4041 0.4032
Plasmodium falciparum ADP-dependent DNA helicase RecQ 0.0042 0.0874 1
Loa Loa (eye worm) hypothetical protein 0.0029 0.0567 0.1454
Entamoeba histolytica exodeoxyribonuclease III, putative 0.002 0.0343 0.1194
Echinococcus multilocularis histone lysine N methyltransferase MLL3 0.0009 0.0059 0.0044
Trichomonas vaginalis nuclear lim interactor-interacting factor, putative 0.0013 0.0172 0.1176
Echinococcus granulosus bloom syndrome protein 0.0044 0.0944 0.0929
Schistosoma mansoni nuclear hormone receptor 0.0011 0.011 0.0094
Brugia malayi Tyrosyl-DNA phosphodiesterase family protein 0.0071 0.1611 0.4451
Giardia lamblia Sgs1 DNA helicase, putative 0.0031 0.0607 0.6071
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0046 0.0975 0.0961
Brugia malayi Bloom's syndrome protein homolog 0.0044 0.0944 0.254
Schistosoma mansoni hypothetical protein 0.001 0.0085 0.007
Loa Loa (eye worm) nuclear hormone receptor family member nhr-49 0.0011 0.011 0.0145
Trypanosoma cruzi tyrosyl-DNA Phosphodiesterase (Tdp1), putative 0.0071 0.1611 1
Brugia malayi nuclear receptor NHR-88 0.0011 0.011 0.0153
Loa Loa (eye worm) hypothetical protein 0.0011 0.011 0.0145
Loa Loa (eye worm) hypothetical protein 0.0011 0.011 0.0145
Echinococcus multilocularis dna polymerase eta 0.0064 0.1429 0.1416
Leishmania major aldehyde dehydrogenase, mitochondrial precursor 0.0061 0.1347 0.8229
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0046 0.0975 0.2623
Mycobacterium tuberculosis Possible conserved lipoprotein LpqK 0.0036 0.0731 0.1295
Trypanosoma brucei DNA polymerase kappa, putative 0.0032 0.0641 0.3495
Loa Loa (eye worm) receptor family ligand binding region containing protein 0.0016 0.0229 0.0486
Echinococcus multilocularis dna polymerase kappa 0.0065 0.1459 0.1446
Loa Loa (eye worm) nuclear hormone receptor family member nhr-40 0.0011 0.011 0.0145
Schistosoma mansoni thyroid hormone receptor 0.0011 0.011 0.0094
Loa Loa (eye worm) nuclear hormone receptor family member nhr-31 0.0011 0.011 0.0145
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0006 0.00000000031699 0.0000000021721
Echinococcus multilocularis thyroid hormone receptor alpha 0.0011 0.011 0.0094
Mycobacterium tuberculosis Probable aldehyde dehydrogenase 0.0061 0.1347 0.2408
Schistosoma mansoni rab geranylgeranyl transferase alpha subunit 0.0036 0.0745 0.0731
Schistosoma mansoni ap endonuclease 0.002 0.0343 0.0328
Brugia malayi Nuclear hormone receptor family member nhr-49 0.0011 0.011 0.0153
Trypanosoma brucei DNA polymerase kappa, putative 0.0032 0.0641 0.3495
Trichomonas vaginalis nuclear lim interactor-interacting factor, putative 0.0013 0.0172 0.1176
Loa Loa (eye worm) RecQ helicase 0.0044 0.0944 0.2534
Loa Loa (eye worm) proteasome 26S subunit 0.0017 0.027 0.0605
Echinococcus granulosus hepatocyte nuclear factor 4 alpha 0.0011 0.011 0.0094
Mycobacterium tuberculosis Conserved hypothetical protein 0.0036 0.0745 0.132
Mycobacterium ulcerans hydrolase 0.0023 0.0409 0.2155
Echinococcus multilocularis 26S proteasome regulatory subunit N11 0.0017 0.027 0.0255
Schistosoma mansoni Tr4/Tr2 (homologue) 0.0011 0.011 0.0094
Plasmodium vivax ATP-dependent DNA helicase Q1, putative 0.0015 0.0215 0.1561
Echinococcus multilocularis muscleblind protein 1 0.0149 0.3549 0.3539
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0011 0.011 0.0153
Mycobacterium tuberculosis Possible penicillin-binding protein 0.0229 0.5544 1
Mycobacterium tuberculosis Possible DNA-damage-inducible protein P DinP (DNA polymerase V) (pol IV 2) (DNA nucleotidyltransferase (DNA-directed)) 0.0044 0.0922 0.1641
Brugia malayi Metabotropic glutamate receptor precursor. 0.0061 0.1361 0.3735
Trypanosoma brucei DNA polymerase IV, putative 0.0065 0.1459 0.8983
Trichomonas vaginalis DNA polymerase eta, putative 0.0065 0.1459 1
Toxoplasma gondii exonuclease III APE 0.002 0.0343 0.1822
Trichomonas vaginalis Clan MP, family M67, Poh1-like metallopeptidase 0.0017 0.027 0.1852
Schistosoma mansoni blooms syndrome DNA helicase 0.0029 0.0552 0.0537
Loa Loa (eye worm) matrixin family protein 0.0042 0.0877 0.2342
Brugia malayi Matrixin family protein 0.0045 0.097 0.2617
Trichomonas vaginalis DNA polymerase IV / kappa, putative 0.0065 0.1459 1
Loa Loa (eye worm) hypothetical protein 0.0134 0.3182 0.8947
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0011 0.011 0.0153
Brugia malayi Receptor family ligand binding region containing protein 0.0016 0.0229 0.0493
Mycobacterium tuberculosis Probable exodeoxyribonuclease III protein XthA (exonuclease III) (EXO III) (AP endonuclease VI) 0.002 0.0343 0.0593
Trichomonas vaginalis chromodomain-helicase-DNA-binding protein, putative 0.0006 0.00000000031699 0.0000000021721
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0046 0.0975 0.0961
Leishmania major ATP-dependent DEAD/H DNA helicase recQ, putative 0.0034 0.0677 0.3734
Brugia malayi beta-lactamase family protein 0.0036 0.0731 0.1933
Trypanosoma brucei DNA polymerase kappa, putative 0.0032 0.0641 0.3495
Echinococcus multilocularis COUP TF:Svp nuclear hormone receptor 0.0011 0.011 0.0094
Schistosoma mansoni metabotropic glutamate receptor 0.0051 0.1114 0.11
Trichomonas vaginalis esterase, putative 0.0036 0.0731 0.5011
Brugia malayi RNA binding protein 0.0134 0.3182 0.8948
Schistosoma mansoni blooms syndrome DNA helicase 0.0016 0.023 0.0215
Brugia malayi Matrixin family protein 0.0019 0.0307 0.0716
Leishmania major DNA polymerase eta, putative 0.0064 0.1429 0.8782
Leishmania major hypothetical protein, conserved 0.0036 0.0731 0.4101
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0036 0.0731 0.0717
Trichomonas vaginalis nuclear lim interactor-interacting factor, putative 0.0013 0.0172 0.1176
Trichomonas vaginalis ap endonuclease, putative 0.002 0.0343 0.2353
Loa Loa (eye worm) hypothetical protein 0.004 0.0834 0.222
Schistosoma mansoni retinoic acid receptor RXR 0.0011 0.011 0.0094
Loa Loa (eye worm) hypothetical protein 0.0036 0.0731 0.1926
Entamoeba histolytica deoxycytidyl transferase, putative 0.0036 0.0745 0.3986
Schistosoma mansoni hypothetical protein 0.0169 0.4041 0.4032
Schistosoma mansoni eukaryotic translation initiation factor 4h 0.0134 0.3182 0.3171
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0046 0.0975 0.0961
Trichomonas vaginalis Clan MP, family M67, Poh1-like metallopeptidase 0.0017 0.027 0.1852
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0011 0.011 0.0153
Echinococcus multilocularis 0.0013 0.0172 0.0156
Onchocerca volvulus 0.0029 0.0552 0.1668
Mycobacterium leprae conserved hypothetical protein 0.0036 0.0731 1
Mycobacterium ulcerans exodeoxyribonuclease III protein XthA 0.002 0.0343 0.1669
Brugia malayi Matrixin family protein 0.0019 0.0307 0.0716
Loa Loa (eye worm) metabotropic GABA-B receptor subtype 2 0.0016 0.0229 0.0486
Onchocerca volvulus 0.0011 0.011 0.0087
Loa Loa (eye worm) matrixin family protein 0.0045 0.097 0.2611
Schistosoma mansoni nuclear lim interactor-interacting factor (nli-interacting factor) (nli-if) 0.0013 0.0172 0.0156
Plasmodium falciparum NLI interacting factor-like phosphatase, putative 0.0013 0.0172 0.0686
Mycobacterium ulcerans aldehyde dehydrogenase 0.0061 0.1347 0.916
Toxoplasma gondii Dullard family phosphatase domain-containing protein 0.0013 0.0172 0.0422
Schistosoma mansoni nuclear lim interactor-interacting factor (nli-interacting factor) (nli-if) 0.0013 0.0172 0.0156
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0006 0.00000000031699 0.0000000021721
Trypanosoma brucei unspecified product 0.0025 0.0464 0.2307
Trichomonas vaginalis ap endonuclease, putative 0.002 0.0343 0.2353
Brugia malayi Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative 0.0036 0.0731 0.1933
Schistosoma mansoni DNA helicase recq1 0.0031 0.0607 0.0592
Echinococcus multilocularis tyrosyl DNA phosphodiesterase 1 0.0071 0.1611 0.1598
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0046 0.0975 0.0961
Echinococcus granulosus 26S proteasome regulatory subunit N11 0.0023 0.0406 0.0391
Toxoplasma gondii proteasome regulatory subunit 0.0023 0.0406 0.2332
Brugia malayi Nuclear hormone receptor family member nhr-41 0.0011 0.011 0.0153
Mycobacterium ulcerans lipase LipD 0.0036 0.0731 0.4565
Echinococcus multilocularis FTZ F1 nuclear receptor protein 0.0011 0.011 0.0094
Onchocerca volvulus 0.0036 0.0731 0.231
Brugia malayi Hemopexin family protein 0.0027 0.0502 0.1276
Loa Loa (eye worm) hypothetical protein 0.0013 0.0167 0.031
Trichomonas vaginalis Clan MP, family M67, Poh1-like metallopeptidase 0.0017 0.027 0.1852
Giardia lamblia Endonuclease/Exonuclease/phosphatase 0.002 0.0343 0.2785
Trypanosoma cruzi DNA polymerase eta, putative 0.0039 0.0804 0.4587
Brugia malayi ecdysteroid receptor 0.0011 0.011 0.0153
Echinococcus multilocularis FTZ F1 alpha 0.0011 0.011 0.0094
Loa Loa (eye worm) 26S proteasome regulatory subunit rpn11 0.0023 0.0406 0.0994
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0011 0.011 0.0094
Echinococcus multilocularis aldehyde dehydrogenase, mitochondrial 0.0061 0.1347 0.1333
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0011 0.011 0.0094
Plasmodium falciparum 26S proteasome regulatory subunit RPN11, putative 0.0023 0.0406 0.3794
Trichomonas vaginalis DNA helicase recq, putative 0.0044 0.0944 0.6466
Echinococcus granulosus dna polymerase eta 0.0064 0.1429 0.1416
Trypanosoma cruzi DNA polymerase kappa, putative 0.0065 0.1459 0.8983
Echinococcus granulosus metabotropic glutamate receptor 2 0.0051 0.1114 0.11
Trypanosoma cruzi hypothetical protein, conserved 0.0036 0.0731 0.4101
Echinococcus multilocularis bloom syndrome protein 0.0044 0.0944 0.0929
Brugia malayi exodeoxyribonuclease III family protein 0.002 0.0343 0.0822
Echinococcus multilocularis hepatocyte nuclear factor 4 alpha 0.0011 0.011 0.0094
Schistosoma mansoni metabotropic glutamate receptor 0.003 0.0581 0.0566
Trypanosoma brucei DNA polymerase IV, putative 0.0065 0.1459 0.8983
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0011 0.011 0.0094
Mycobacterium tuberculosis Conserved protein 0.0036 0.0731 0.1295
Schistosoma mansoni cpg binding protein 0.003 0.0593 0.0578
Echinococcus multilocularis DNA (apurinic or apyrimidinic site) lyase 0.002 0.0343 0.0328
Entamoeba histolytica 26S proteasome non-ATPase regulatory subunit 14, putative 0.0023 0.0406 0.1628
Onchocerca volvulus Huntingtin homolog 0.0122 0.2882 1
Loa Loa (eye worm) hypothetical protein 0.0013 0.0172 0.0322
Trypanosoma brucei apurinic/apyrimidinic endonuclease, putative 0.002 0.0343 0.1499
Echinococcus granulosus Eukaryotic translation initiation factor 4H 0.0134 0.3182 0.3171
Plasmodium vivax hypothetical protein, conserved 0.0036 0.0731 1
Echinococcus granulosus cpg binding protein 0.003 0.0593 0.0578
Trichomonas vaginalis nuclear lim interactor-interacting factor, putative 0.0013 0.0172 0.1176
Brugia malayi beta-lactamase 0.0036 0.0731 0.1933
Trichomonas vaginalis DNA helicase recq1, putative 0.0044 0.0944 0.6466
Mycobacterium tuberculosis Probable conserved lipoprotein 0.0036 0.0731 0.1295
Plasmodium vivax NLI interacting factor-like phosphatase, putative 0.0013 0.0172 0.0846
Brugia malayi Nuclear hormone receptor family member nhr-3 0.0011 0.011 0.0153
Echinococcus granulosus CTD small phosphatase protein like 0.0013 0.0172 0.0156
Loa Loa (eye worm) hypothetical protein 0.0011 0.011 0.0145
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0011 0.011 0.0153
Loa Loa (eye worm) nuclear Hormone Receptor family member 0.0011 0.011 0.0145
Onchocerca volvulus 0.0019 0.0307 0.079
Trichomonas vaginalis D-aminoacylase, putative 0.0036 0.0731 0.5011
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0046 0.0975 0.0961
Loa Loa (eye worm) hypothetical protein 0.0036 0.0731 0.1926
Toxoplasma gondii BRCA1 C Terminus (BRCT) domain-containing protein 0.0018 0.0297 0.1444
Trypanosoma brucei DNA polymerase kappa, putative 0.004 0.0834 0.4789
Echinococcus granulosus dna polymerase kappa 0.0065 0.1459 0.1446
Echinococcus multilocularis matrix metallopeptidase 7 (M10 family) 0.0068 0.154 0.1527
Mycobacterium tuberculosis Probable peptidoglycan hydrolase 0.0023 0.0409 0.0711
Trypanosoma brucei DNA polymerase kappa, putative 0.0065 0.1459 0.8983
Echinococcus granulosus ecdysone induced protein 78C 0.0011 0.011 0.0094
Schistosoma mansoni retinoid-x-receptor (RXR) 0.0011 0.011 0.0094
Schistosoma mansoni matrix metallopeptidase-7 (M10 family) 0.0019 0.0307 0.0291
Schistosoma mansoni eukaryotic translation initiation factor 4h 0.0134 0.3182 0.3171
Schistosoma mansoni photoreceptor-specific nuclear receptor related 0.0011 0.011 0.0094
Onchocerca volvulus Matrilysin homolog 0.0042 0.0877 0.2829
Schistosoma mansoni nuclear receptor 2DBD-gamma 0.0011 0.011 0.0094
Trichomonas vaginalis DNA helicase recq, putative 0.0034 0.0677 0.4637
Entamoeba histolytica recQ family helicase, putative 0.0034 0.0677 0.3509
Echinococcus multilocularis geminin 0.0169 0.4041 0.4032
Mycobacterium ulcerans DNA polymerase IV 0.0065 0.1459 1
Schistosoma mansoni DNA helicase recq5 0.0031 0.0607 0.0592
Mycobacterium tuberculosis Probable esterase LipL 0.0036 0.0731 0.1295
Loa Loa (eye worm) hypothetical protein 0.0149 0.3549 1
Entamoeba histolytica recQ family DNA helicase 0.0016 0.023 0.0407
Echinococcus granulosus Carboxy terminal domain RNA polymerase II 0.0013 0.0172 0.0156
Echinococcus multilocularis Eukaryotic translation initiation factor 4H 0.0134 0.3182 0.3171
Loa Loa (eye worm) hypothetical protein 0.0011 0.011 0.0145
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0036 0.0731 0.0717
Echinococcus multilocularis muscleblind protein 0.0149 0.3549 0.3539
Schistosoma mansoni nuclear hormone receptor nor-1/nor-2 0.0011 0.011 0.0094
Plasmodium vivax ADP-dependent DNA helicase RecQ, putative 0.0026 0.0497 0.6169
Trypanosoma brucei ATP-dependent DEAD/H DNA helicase recQ, putative 0.0034 0.0677 0.3734
Trypanosoma cruzi ATP-dependent DEAD/H DNA helicase recQ, putative 0.0016 0.023 0.074
Brugia malayi Nuclear hormone receptor family member nhr-40 0.0011 0.011 0.0153
Mycobacterium tuberculosis Probable esterase/lipase LipP 0.0036 0.0731 0.1295
Toxoplasma gondii ATP-dependent DNA helicase, RecQ family protein 0.0016 0.023 0.0899
Leishmania major hypothetical protein, conserved 0.0013 0.0172 0.0347
Loa Loa (eye worm) CXXC zinc finger family protein 0.0029 0.0552 0.1412
Schistosoma mansoni aldehyde dehydrogenase 0.0061 0.1347 0.1333
Loa Loa (eye worm) glutamate receptor 0.0024 0.0437 0.1084
Wolbachia endosymbiont of Brugia malayi exonuclease III 0.002 0.0343 0.5
Schistosoma mansoni steroid hormone receptor ad4bp 0.0011 0.011 0.0094
Entamoeba histolytica tyrosyl-DNA phosphodiesterase, putative 0.0071 0.1611 1
Trypanosoma cruzi ATP-dependent DEAD/H DNA helicase recQ, putative 0.0034 0.0677 0.3734
Schistosoma mansoni DNA polymerase IV / kappa 0.0011 0.012 0.0104
Schistosoma mansoni coup transcription factor 0.0011 0.011 0.0094
Trypanosoma brucei DNA polymerase kappa, putative 0.0065 0.1459 0.8983
Trypanosoma cruzi DNA polymerase eta, putative 0.0064 0.1429 0.8782
Echinococcus granulosus GPCR family 3 C terminal 0.001 0.0085 0.007
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0046 0.0975 0.0961
Echinococcus granulosus ATP dependent DNA helicase Q5 0.0031 0.0607 0.0592
Loa Loa (eye worm) hypothetical protein 0.0122 0.2882 0.8088
Trypanosoma brucei DNA polymerase kappa, putative 0.0065 0.1459 0.8983
Brugia malayi Nuclear hormone receptor family member nhr-31 0.0011 0.011 0.0153
Loa Loa (eye worm) hypothetical protein 0.0016 0.0229 0.0486
Onchocerca volvulus 0.0036 0.0731 0.231
Echinococcus granulosus matrix metallopeptidase 7 M10 family 0.0068 0.154 0.1527
Loa Loa (eye worm) hypothetical protein 0.0075 0.1713 0.4738
Mycobacterium ulcerans fusion of enoyl-CoA hydratase, EchA21 and lipase, LipE 0.0036 0.0731 0.4565
Onchocerca volvulus Huntingtin homolog 0.0122 0.2882 1
Loa Loa (eye worm) ATP-dependent DNA helicase 0.0031 0.0607 0.157
Giardia lamblia DINP protein human, muc B family 0.0044 0.0922 1
Echinococcus multilocularis metabotropic glutamate receptor 2 0.0051 0.1114 0.11
Echinococcus granulosus FTZ F1 nuclear receptor protein 0.0011 0.011 0.0094
Onchocerca volvulus 0.0036 0.0731 0.231
Brugia malayi CXXC zinc finger family protein 0.0029 0.0552 0.1419
Echinococcus granulosus FTZ F1 alpha 0.0011 0.011 0.0094
Echinococcus granulosus COUP TF:Svp nuclear hormone receptor 0.0011 0.011 0.0094
Schistosoma mansoni terminal deoxycytidyl transferase 0.0036 0.0745 0.0731
Echinococcus multilocularis ATP dependent DNA helicase Q1 0.0031 0.0607 0.0592
Schistosoma mansoni matrix metallopeptidase-9 (M10 family) 0.0045 0.095 0.0936
Echinococcus granulosus ATP dependent DNA helicase Q1 0.0031 0.0607 0.0592
Trypanosoma brucei DNA polymerase kappa, putative 0.0065 0.1459 0.8983
Brugia malayi 26S proteasome regulatory subunit rpn11 0.0023 0.0406 0.1001
Trypanosoma brucei DNA polymerase eta, putative 0.0064 0.1429 0.8782
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0046 0.0975 0.0961
Leishmania major proteasome regulatory non-ATP-ase subunit 11, putative,19S proteasome regulatory subunit, Metallo- peptidase, Clan MP, Family M6 0.0017 0.027 0.1009
Trypanosoma cruzi apurinic/apyrimidinic endonuclease 0.002 0.0343 0.1499
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0006 0.00000000031699 0.0000000021721
Mycobacterium leprae Probable lipase LipE 0.0036 0.0731 1
Brugia malayi metabotropic glutamate receptor subtype 5a (mGluR5a), putative 0.0055 0.1218 0.3325
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0011 0.011 0.0153
Brugia malayi Matrix metalloprotease, N-terminal domain containing protein 0.0023 0.0409 0.1008
Toxoplasma gondii ImpB/MucB/SamB family protein 0.0039 0.0804 0.5575
Loa Loa (eye worm) hypothetical protein 0.0149 0.3549 1
Plasmodium falciparum ATP-dependent DNA helicase Q1 0.0031 0.0607 0.6461
Brugia malayi ImpB/MucB/SamB family protein 0.0036 0.0745 0.1972
Trypanosoma brucei DNA polymerase kappa, putative 0.0065 0.1459 0.8983
Toxoplasma gondii aldehyde dehydrogenase 0.0061 0.1347 1
Loa Loa (eye worm) glutamate receptor 0.0061 0.1361 0.373
Loa Loa (eye worm) hypothetical protein 0.0016 0.023 0.049
Trypanosoma brucei DNA polymerase kappa, putative 0.0065 0.1459 0.8983
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0006 0.00000000031699 0.0000000021721
Brugia malayi beta-lactamase family protein 0.0036 0.0731 0.1933
Loa Loa (eye worm) nuclear hormone receptor family member nhr-14 0.0011 0.011 0.0145
Trypanosoma brucei unspecified product 0.0058 0.1282 0.7795
Trypanosoma brucei hypothetical protein, conserved 0.0036 0.0731 0.4101
Brugia malayi photoreceptor-specific nuclear receptor 0.0011 0.011 0.0153
Echinococcus granulosus retinoic acid receptor rxr beta a 0.0011 0.011 0.0094
Leishmania major tyrosyl-DNA phosphodiesterase 1 0.0071 0.1611 1
Schistosoma mansoni hypothetical protein 0.0027 0.0502 0.0487
Onchocerca volvulus Steroid hormone receptor family member cnr14 homolog 0.0011 0.011 0.0087
Leishmania major apurinic/apyrimidinic endonuclease-redox protein 0.002 0.0343 0.1499
Brugia malayi metabotropic glutamate receptor type 2 0.003 0.0581 0.1501
Echinococcus multilocularis cpg binding protein 0.003 0.0593 0.0578
Trypanosoma brucei DNA polymerase IV, putative 0.0058 0.1282 0.7795
Mycobacterium ulcerans beta-lactamase 0.0036 0.0731 0.4565
Brugia malayi Nuclear hormone receptor-like 1 0.0011 0.011 0.0153
Trichomonas vaginalis D-aminoacylase, putative 0.0036 0.0731 0.5011
Toxoplasma gondii ATP-dependent DNA helicase, RecQ family protein 0.0031 0.0607 0.3971
Trichomonas vaginalis dullard protein, putative 0.0013 0.0172 0.1176
Giardia lamblia Non ATPase subunit MPR1 of 26S proteasome 0.0017 0.027 0.1874
Mycobacterium tuberculosis Conserved protein 0.0036 0.0731 0.1295
Plasmodium vivax 26S proteasome regulatory subunit RPN11, putative 0.0023 0.0406 0.4679
Brugia malayi ImpB/MucB/SamB family protein 0.0064 0.1429 0.3931
Loa Loa (eye worm) hypothetical protein 0.0036 0.0731 0.1926
Plasmodium falciparum AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.002 0.0343 0.2964
Loa Loa (eye worm) tyrosyl-DNA phosphodiesterase 0.0071 0.1611 0.4446
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0011 0.011 0.0094
Trichomonas vaginalis D-aminoacylase, putative 0.0036 0.0731 0.5011
Trypanosoma cruzi DNA polymerase kappa, putative 0.0065 0.1459 0.8983
Entamoeba histolytica recQ family helicase, putative 0.0015 0.0215 0.0304
Loa Loa (eye worm) beta-LACTamase domain containing family member 0.0036 0.0731 0.1926
Loa Loa (eye worm) hypothetical protein 0.0019 0.0307 0.0709
Brugia malayi metabotropic GABA-B receptor subtype 2 0.001 0.0085 0.0084
Schistosoma mansoni hypothetical protein 0.0013 0.0167 0.0152
Toxoplasma gondii ABC1 family protein 0.0036 0.0731 0.4984
Loa Loa (eye worm) hypothetical protein 0.0011 0.011 0.0145
Leishmania major DNA polymerase eta, putative 0.0039 0.0804 0.4587
Onchocerca volvulus Protein ultraspiracle homolog 0.0011 0.011 0.0087
Loa Loa (eye worm) ImpB/MucB/SamB family protein 0.0036 0.0745 0.1966
Trypanosoma brucei unspecified product 0.0025 0.0464 0.2307
Trypanosoma cruzi hypothetical protein, conserved 0.0036 0.0731 0.4101
Schistosoma mansoni ap endonuclease 0.002 0.0343 0.0328
Brugia malayi Carboxy-terminal domain RNA polymerase II polypeptide A smallphosphatase 1 0.0013 0.0172 0.033

Activities

Activity type Activity value Assay description Source Reference
IC50 (functional) = 0.014 uM Antagonist activity at recombinant rat mGluR2 expressed in forskolin-stimulated CHO cells assessed as inhibition of (1S,3R)-ACPD induced cAMP production ChEMBL. 20971004
IC50 (binding) = 0.04 uM Partial displacement of [3H]LY354740 from recombinant rat mGluR2 ChEMBL. 20971004

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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