Detailed information for compound 76979

Basic information

Technical information
  • TDR Targets ID: 76979
  • Name: methyl 2-[[2-(2-chlorophenyl)quinoline-4-carb onyl]amino]-2-phenylacetate
  • MW: 430.883 | Formula: C25H19ClN2O3
  • H donors: 1 H acceptors: 3 LogP: 5.37 Rotable bonds: 7
    Rule of 5 violations (Lipinski): 1
  • SMILES: COC(=O)C(c1ccccc1)NC(=O)c1cc(nc2c1cccc2)c1ccccc1Cl
  • InChi: 1S/C25H19ClN2O3/c1-31-25(30)23(16-9-3-2-4-10-16)28-24(29)19-15-22(18-12-5-7-13-20(18)26)27-21-14-8-6-11-17(19)21/h2-15,23H,1H3,(H,28,29)
  • InChiKey: FXGIDODTRRIPTL-UHFFFAOYSA-N  


Substructure search Similarity search

Network

Hover on a compound node to display the structore

Synonyms

  • methyl 2-[[2-(2-chlorophenyl)quinoline-4-carbonyl]amino]-2-phenyl-acetate
  • 2-[[[2-(2-chlorophenyl)-4-quinolyl]-oxomethyl]amino]-2-phenylacetic acid methyl ester
  • methyl 2-[[2-(2-chlorophenyl)quinolin-4-yl]carbonylamino]-2-phenyl-ethanoate
  • 2-[[2-(2-chlorophenyl)quinoline-4-carbonyl]amino]-2-phenyl-acetic acid methyl ester

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens tachykinin receptor 3 Starlite/ChEMBL References

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Echinococcus multilocularis tachykinin peptides receptor 99D Get druggable targets OG5_131969 All targets in OG5_131969
Echinococcus granulosus tachykinin peptides receptor 99D Get druggable targets OG5_131969 All targets in OG5_131969
By sequence similarity to non orthologous known druggable targets
No druggable targets predicted by sequence similarity
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Echinococcus multilocularis Ankyrin repeat domain containing protein 0.0087 0.0748 0.07
Schistosoma mansoni serine/threonine protein kinase 0.0019 0.0051 0.0029
Echinococcus granulosus glutamate receptor ionotropic kainate 0.0453 0.4505 0.4477
Brugia malayi intermediate filament protein 0.0026 0.0124 0.0149
Trichomonas vaginalis set domain proteins, putative 0.0463 0.4608 1
Brugia malayi Guanylyl cyclase protein 23 0.0183 0.1736 0.2087
Echinococcus multilocularis histone lysine N methyltransferase SETMAR 0.0058 0.0456 0.0406
Loa Loa (eye worm) hypothetical protein 0.0183 0.1736 0.1736
Schistosoma mansoni glutamate receptor kainate 0.043 0.427 0.5242
Echinococcus multilocularis neutral amino acid transporter A 0.0763 0.7687 0.7675
Loa Loa (eye worm) hypothetical protein 0.0183 0.1736 0.1736
Echinococcus multilocularis neutral amino acid transporter excitatory amino acid transporter 0.0763 0.7687 0.7675
Onchocerca volvulus 0.0183 0.1736 0.2197
Echinococcus multilocularis glutamate receptor 2 0.0655 0.6583 0.6566
Loa Loa (eye worm) hypothetical protein 0.0076 0.0634 0.0634
Schistosoma mansoni protein kinase 0.0183 0.1736 0.2111
Trypanosoma cruzi tyrosyl-DNA Phosphodiesterase (Tdp1), putative 0.0065 0.0526 0.0687
Mycobacterium tuberculosis Probable exodeoxyribonuclease III protein XthA (exonuclease III) (EXO III) (AP endonuclease VI) 0.0057 0.0437 0.0493
Echinococcus granulosus expressed protein 0.0369 0.3642 0.361
Echinococcus multilocularis metabotropic glutamate receptor 2 0.071 0.7141 0.7126
Echinococcus granulosus histone lysine methyltransferase setb 0.0058 0.0456 0.0406
Loa Loa (eye worm) hypothetical protein 0.0019 0.0051 0.0051
Trichomonas vaginalis DNA helicase recq, putative 0.0021 0.0073 0.0048
Brugia malayi A-kinase anchor protein 10, precursor 0.0019 0.0051 0.0061
Schistosoma mansoni multiple ankyrin repeats single kh domain protein 0.0087 0.0748 0.089
Mycobacterium tuberculosis Probable aldehyde dehydrogenase 0.006 0.0473 0.0539
Onchocerca volvulus 0.0098 0.0861 0.1049
Schistosoma mansoni serine/threonine protein kinase 0.0019 0.0051 0.0029
Loa Loa (eye worm) hypothetical protein 0.0019 0.0051 0.0051
Echinococcus granulosus nmda type glutamate receptor 0.0183 0.1736 0.1694
Schistosoma mansoni hypothetical protein 0.0227 0.219 0.2672
Echinococcus multilocularis histone lysine methyltransferase setb histone lysine methyltransferase eggless 0.0058 0.0456 0.0406
Echinococcus multilocularis glutamate receptor 4 0.0042 0.0291 0.0241
Echinococcus multilocularis aldehyde dehydrogenase, mitochondrial 0.006 0.0473 0.0424
Echinococcus granulosus GPCR family 3 C terminal 0.0115 0.1036 0.099
Onchocerca volvulus 0.0098 0.0861 0.1049
Brugia malayi Hypothetical 29.7 kDa protein C05D11.5 in chromosome III 0.002 0.0061 0.0074
Schistosoma mansoni regulator of G protein signaling 0.0019 0.0051 0.0029
Loa Loa (eye worm) receptor family ligand binding region containing protein 0.0298 0.2916 0.2916
Schistosoma mansoni regulator of G protein signaling 17 19 20 (rgs17 19 20) 0.0019 0.0051 0.0029
Loa Loa (eye worm) hypothetical protein 0.0019 0.0051 0.0051
Brugia malayi hypothetical protein 0.0183 0.1736 0.2087
Echinococcus multilocularis GPCR, family 3, C terminal 0.0115 0.1036 0.099
Echinococcus multilocularis glutamate receptor subunit protein glur 0.027 0.2624 0.2586
Plasmodium vivax SET domain protein, putative 0.0058 0.0456 0.717
Trichomonas vaginalis ap endonuclease, putative 0.0057 0.0437 0.0847
Echinococcus multilocularis nmda type glutamate receptor 0.0551 0.5511 0.5488
Schistosoma mansoni metabotropic glutamate receptor 0.0462 0.4595 0.5644
Loa Loa (eye worm) hypothetical protein 0.0026 0.0124 0.0124
Echinococcus multilocularis excitatory amino acid transporter 3 0.0763 0.7687 0.7675
Toxoplasma gondii endonuclease IV APN 0.0076 0.0634 1
Treponema pallidum glutamate transporter 0.0338 0.3327 1
Schistosoma mansoni glutamate receptor NMDA 0.0613 0.6149 0.7564
Echinococcus multilocularis glutamate receptor 2 0.0472 0.4704 0.4677
Loa Loa (eye worm) hypothetical protein 0.0017 0.0029 0.0029
Loa Loa (eye worm) hypothetical protein 0.0183 0.1736 0.1736
Brugia malayi regulator of G-protein signaling rgs-7 0.0019 0.0051 0.0061
Echinococcus multilocularis excitatory amino acid transporter 2 0.0763 0.7687 0.7675
Brugia malayi regulator of G-protein signaling egl-10 0.0019 0.0051 0.0061
Schistosoma mansoni axis inhibition protein axin 0.0019 0.0051 0.0029
Brugia malayi Excitatory amino acid transporter 0.0763 0.7687 0.9238
Trichomonas vaginalis DNA helicase recq1, putative 0.0021 0.0073 0.0048
Loa Loa (eye worm) hypothetical protein 0.0026 0.0119 0.0119
Echinococcus multilocularis expressed protein 0.0369 0.3642 0.361
Echinococcus granulosus glutamate receptor ionotrophic AMPA 3 0.0655 0.6583 0.6566
Entamoeba histolytica tyrosyl-DNA phosphodiesterase, putative 0.0065 0.0526 0.2819
Schistosoma mansoni ap endonuclease 0.0057 0.0437 0.0506
Chlamydia trachomatis neutral amino acid transporter 0.0338 0.3327 0.3819
Mycobacterium ulcerans glutamine-binding lipoprotein GlnH 0.0324 0.3178 1
Loa Loa (eye worm) glutamate receptor 0.0279 0.2716 0.2716
Onchocerca volvulus Poor gastrulation protein homolog 0.0115 0.1036 0.1279
Echinococcus multilocularis receptor type guanylyl cyclase 0.0183 0.1736 0.1694
Chlamydia trachomatis glutamine binding protein 0.0324 0.3178 0.3607
Mycobacterium tuberculosis Probable C4-dicarboxylate-transport transmembrane protein DctA 0.0763 0.7687 1
Schistosoma mansoni glutamate receptor kainate 0.0655 0.6585 0.8102
Echinococcus multilocularis atrial natriuretic peptide receptor 0.0183 0.1736 0.1694
Leishmania major aldehyde dehydrogenase, mitochondrial precursor 0.006 0.0473 0.0274
Echinococcus granulosus lamin 0.0026 0.0124 0.0073
Schistosoma mansoni glutamate receptor AMPA 0.043 0.427 0.5242
Schistosoma mansoni aldehyde dehydrogenase 0.006 0.0473 0.055
Echinococcus multilocularis Ribosomal protein S1, RNA binding domain 0.0227 0.219 0.215
Echinococcus granulosus Ankyrin repeat domain containing protein 0.0087 0.0748 0.07
Echinococcus multilocularis tyrosyl DNA phosphodiesterase 1 0.0065 0.0526 0.0478
Toxoplasma gondii histone lysine methyltransferase SET/SUV39 0.0058 0.0456 0.7178
Onchocerca volvulus 0.0026 0.0124 0.0083
Brugia malayi hypothetical protein 0.0098 0.0861 0.1035
Echinococcus multilocularis glutamate (NMDA) receptor subunit 0.043 0.427 0.424
Onchocerca volvulus 0.0069 0.0569 0.0665
Echinococcus granulosus Glutamate receptor ionotropic kainate 2 0.0839 0.8464 0.8456
Echinococcus granulosus atrial natriuretic peptide receptor 0.0183 0.1736 0.1694
Loa Loa (eye worm) glutamate receptor 1 0.0472 0.4704 0.4704
Echinococcus granulosus lamin dm0 0.0026 0.0124 0.0073
Brugia malayi hypothetical protein 0.0019 0.0051 0.0061
Echinococcus multilocularis Glutamate receptor, ionotropic kainate 2 0.0839 0.8464 0.8456
Loa Loa (eye worm) tyrosyl-DNA phosphodiesterase 0.0065 0.0526 0.0526
Brugia malayi hypothetical protein 0.0019 0.0051 0.0061
Loa Loa (eye worm) RGS-3 protein 0.0019 0.0051 0.0051
Echinococcus granulosus neutral amino acid transporter A 0.0763 0.7687 0.7675
Echinococcus granulosus glutamate receptor 2 0.0655 0.6583 0.6566
Loa Loa (eye worm) PXA domain-containing protein 0.0019 0.0051 0.0051
Echinococcus granulosus Ribosomal protein S1 RNA binding domain 0.0227 0.219 0.215
Trypanosoma brucei tyrosyl-DNA Phosphodiesterase (Tdp1), putative 0.0065 0.0526 1
Brugia malayi metabotropic GABA-B receptor subtype 2 0.0115 0.1036 0.1246
Echinococcus multilocularis DNA (apurinic or apyrimidinic site) lyase 0.0057 0.0437 0.0388
Toxoplasma gondii aldehyde dehydrogenase 0.006 0.0473 0.7447
Loa Loa (eye worm) hypothetical protein 0.0042 0.0291 0.0291
Brugia malayi PXA domain containing protein 0.0019 0.0051 0.0061
Brugia malayi PXA domain containing protein 0.0019 0.0051 0.0061
Schistosoma mansoni metabotropic glutamate receptor 2 3 (mglur group 2) 0.0805 0.8121 1
Loa Loa (eye worm) metabotropic glutamate receptor 8 0.0183 0.1736 0.1736
Brugia malayi Pre-SET motif family protein 0.0058 0.0456 0.0547
Schistosoma mansoni multiple ankyrin repeats single kh domain protein 0.0087 0.0748 0.089
Loa Loa (eye worm) hypothetical protein 0.0183 0.1736 0.1736
Loa Loa (eye worm) RGC/RGC protein kinase 0.0183 0.1736 0.1736
Schistosoma mansoni tyrosine kinase 0.0183 0.1736 0.2111
Brugia malayi DNA-(Apurinic or apyrimidinic site) lyase 0.0076 0.0634 0.0762
Schistosoma mansoni regulator of G protein signaling 0.0019 0.0051 0.0029
Echinococcus multilocularis lamin dm0 0.0026 0.0124 0.0073
Plasmodium falciparum apurinic/apyrimidinic endonuclease Apn1, putative 0.0076 0.0634 1
Brugia malayi Bloom's syndrome protein homolog 0.0021 0.0073 0.0088
Echinococcus multilocularis neutral amino acid transporter A 0.0763 0.7687 0.7675
Schistosoma mansoni serine/threonine protein kinase 0.0019 0.0051 0.0029
Mycobacterium ulcerans aldehyde dehydrogenase 0.006 0.0473 0.132
Echinococcus multilocularis neutral amino acid transporter excitatory amino acid transporter 0.0338 0.3327 0.3293
Schistosoma mansoni axis inhibition protein axin 0.0019 0.0051 0.0029
Schistosoma mansoni ATP-binding cassette transporter 0.043 0.427 0.5242
Echinococcus multilocularis metabotropic glutamate receptor 5 0.0988 1 1
Schistosoma mansoni regulator of G protein signaling 0.0019 0.0051 0.0029
Plasmodium vivax apurinic/apyrimidinic endonuclease Apn1, putative 0.0076 0.0634 1
Echinococcus granulosus glutamate receptor subunit protein glur 0.027 0.2624 0.2586
Echinococcus granulosus glutamate receptor 1 0.0042 0.0291 0.0241
Brugia malayi metabotropic glutamate receptor subtype 5a (mGluR5a), putative 0.0641 0.6441 0.7741
Echinococcus multilocularis tachykinin peptides receptor 99D 0.0362 0.3576 0.3543
Brugia malayi Regulator of G protein signaling domain containing protein 0.0019 0.0051 0.0061
Brugia malayi Tyrosyl-DNA phosphodiesterase family protein 0.0065 0.0526 0.0632
Schistosoma mansoni intermediate filament proteins 0.0026 0.0124 0.0119
Loa Loa (eye worm) glutamate receptor 2 0.043 0.427 0.427
Mycobacterium ulcerans aldehyde dehydrogenase 0.006 0.0473 0.132
Onchocerca volvulus 0.0026 0.0124 0.0083
Onchocerca volvulus Excitatory amino acid transporter homolog 0.0763 0.7687 1
Echinococcus multilocularis musashi 0.0026 0.0124 0.0073
Mycobacterium tuberculosis Probable endonuclease IV End (endodeoxyribonuclease IV) (apurinase) 0.0076 0.0634 0.0751
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0058 0.0456 0.0529
Brugia malayi metabotropic glutamate receptor type 2 0.0462 0.4595 0.5523
Echinococcus granulosus aldehyde dehydrogenase mitochondrial 0.006 0.0473 0.0424
Echinococcus granulosus bloom syndrome protein 0.0021 0.0073 0.0022
Brugia malayi Intermediate filament tail domain containing protein 0.0026 0.0124 0.0149
Loa Loa (eye worm) intermediate filament protein 0.0026 0.0124 0.0124
Echinococcus multilocularis sodium:dicarboxylate symporter 0.0338 0.3327 0.3293
Chlamydia trachomatis glutamate symporter 0.0763 0.7687 1
Trichomonas vaginalis ap endonuclease, putative 0.0057 0.0437 0.0847
Echinococcus granulosus glutamate NMDA receptor subunit 0.043 0.427 0.424
Echinococcus granulosus metabotropic glutamate receptor 2 0.071 0.7141 0.7126
Mycobacterium ulcerans aldehyde dehydrogenase 0.006 0.0473 0.132
Brugia malayi metabotropic GABA-B receptor subtype 2 0.0183 0.1736 0.2087
Loa Loa (eye worm) G protein signaling regulator EGL-10 0.0019 0.0051 0.0051
Echinococcus granulosus Excitatory amino acid transporter 0.0763 0.7687 0.7675
Brugia malayi Receptor family ligand binding region containing protein 0.0183 0.1736 0.2087
Loa Loa (eye worm) RGC/RGC protein kinase 0.0183 0.1736 0.1736
Brugia malayi Glutamate receptor 1 precursor 0.0472 0.4704 0.5653
Echinococcus granulosus neutral amino acid transporter 0.0763 0.7687 0.7675
Echinococcus multilocularis Glutamate receptor, ionotropic kainate 2 0.0839 0.8464 0.8456
Echinococcus granulosus transcription factor Dp 1 0.0038 0.0244 0.0194
Loa Loa (eye worm) AGC/GRK/GRK protein kinase 0.0019 0.0051 0.0051
Echinococcus multilocularis bloom syndrome protein 0.0021 0.0073 0.0022
Brugia malayi Metabotropic glutamate receptor precursor. 0.0825 0.8321 1
Loa Loa (eye worm) hypothetical protein 0.0115 0.1036 0.1036
Treponema pallidum amino acid ABC transporter, periplasmic binding protein 0.0324 0.3178 0.9484
Brugia malayi Pre-SET motif family protein 0.0407 0.4031 0.4845
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0058 0.0456 0.0529
Loa Loa (eye worm) hypothetical protein 0.0042 0.0291 0.0291
Echinococcus granulosus tyrosyl DNA phosphodiesterase 1 0.0065 0.0526 0.0478
Mycobacterium ulcerans exodeoxyribonuclease III protein XthA 0.0057 0.0437 0.1206
Echinococcus multilocularis Glutamate receptor, ionotropic kainate 3 0.0776 0.7826 0.7815
Loa Loa (eye worm) hypothetical protein 0.0183 0.1736 0.1736
Loa Loa (eye worm) hypothetical protein 0.0306 0.3003 0.3003
Entamoeba histolytica hypothetical protein 0.0183 0.1736 1
Brugia malayi M-phase phosphoprotein, mpp8 0.0098 0.0861 0.1035
Loa Loa (eye worm) hypothetical protein 0.0183 0.1736 0.1736
Loa Loa (eye worm) hypothetical protein 0.0183 0.1736 0.1736
Loa Loa (eye worm) intermediate filament tail domain-containing protein 0.0026 0.0124 0.0124
Echinococcus granulosus receptor type guanylyl cyclase 0.0183 0.1736 0.1694
Loa Loa (eye worm) hypothetical protein 0.0058 0.0456 0.0456
Loa Loa (eye worm) hypothetical protein 0.0042 0.0291 0.0291
Loa Loa (eye worm) metabotropic GABA-B receptor subtype 2 0.0298 0.2916 0.2916
Loa Loa (eye worm) hypothetical protein 0.0019 0.0051 0.0051
Echinococcus granulosus sodium:dicarboxylate symporter 0.0763 0.7687 0.7675
Leishmania major extracellular receptor, putative 0.0183 0.1736 1
Loa Loa (eye worm) RecQ helicase 0.0021 0.0073 0.0073
Onchocerca volvulus Metabotropic glutamate receptor homolog 0.0115 0.1036 0.1279
Echinococcus granulosus glutamate receptor 4 0.0042 0.0291 0.0241
Echinococcus granulosus glutamate receptor ionotropic kainate 3 0.0453 0.4505 0.4477
Echinococcus granulosus 5'partial|histone lysine N methyltransferase SETDB2 0.0056 0.0433 0.0384
Plasmodium falciparum AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.0057 0.0437 0.6644
Echinococcus multilocularis excitatory amino acid transporter 2 0.0763 0.7687 0.7675
Loa Loa (eye worm) exodeoxyribonuclease III family protein 0.0057 0.0437 0.0437
Echinococcus multilocularis tyrosine kinase 0.0183 0.1736 0.1694
Echinococcus granulosus excitatory amino acid transporter 2 0.0763 0.7687 0.7675
Schistosoma mansoni glutamate receptor AMPA 0.043 0.427 0.5242
Loa Loa (eye worm) hypothetical protein 0.0298 0.2916 0.2916
Wolbachia endosymbiont of Brugia malayi Na+/H+-dicarboxylate symporter 0.0763 0.7687 1
Loa Loa (eye worm) hypothetical protein 0.0019 0.0051 0.0051
Echinococcus multilocularis glutamate receptor 2 0.0428 0.425 0.4221
Loa Loa (eye worm) pre-SET domain-containing protein family protein 0.0407 0.4031 0.4031
Loa Loa (eye worm) hypothetical protein 0.0988 1 1
Mycobacterium tuberculosis Probable glutamine-binding lipoprotein GlnH (GLNBP) 0.0324 0.3178 0.4088
Treponema pallidum amino acid ABC transporter, periplasmic binding protein (hisJ) 0.0324 0.3178 0.9484
Echinococcus granulosus tyrosine kinase 0.0183 0.1736 0.1694
Leishmania major tyrosyl-DNA phosphodiesterase 1 0.0065 0.0526 0.0687
Loa Loa (eye worm) hypothetical protein 0.0098 0.0861 0.0861
Brugia malayi Probable G protein-coupled receptor kinase F19C6.1, putative 0.0019 0.0051 0.0061
Schistosoma mansoni tyrosyl-DNA phosphodiesterase 0.0065 0.0526 0.0616
Onchocerca volvulus Atrial natriuretic peptide receptor 3 homolog 0.0183 0.1736 0.2197
Schistosoma mansoni regulator of G protein signaling 0.0019 0.0051 0.0029
Chlamydia trachomatis arginine ABC transporter substrate-binding protein ArtJ 0.0324 0.3178 0.3607
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0058 0.0456 0.0529
Trypanosoma cruzi extracellular receptor, putative 0.0183 0.1736 1
Echinococcus granulosus excitatory amino acid transporter 3 0.0763 0.7687 0.7675
Schistosoma mansoni tyrosine kinase 0.0183 0.1736 0.2111
Schistosoma mansoni hypothetical protein 0.0115 0.1036 0.1246
Echinococcus granulosus Glutamate receptor ionotropic kainate 2 0.0839 0.8464 0.8456
Schistosoma mansoni regulator of G protein signaling 3 rgs3 0.0019 0.0051 0.0029
Schistosoma mansoni glutamate receptor NMDA 0.043 0.427 0.5242
Loa Loa (eye worm) hypothetical protein 0.002 0.0061 0.0061
Schistosoma mansoni metabotropic glutamate receptor 0.071 0.7141 0.8789
Echinococcus granulosus Glutamate receptor ionotropic kainate 2 0.0839 0.8464 0.8456
Loa Loa (eye worm) hypothetical protein 0.0098 0.0861 0.0861
Brugia malayi exodeoxyribonuclease III family protein 0.0057 0.0437 0.0525
Echinococcus granulosus excitatory amino acid transporter 2 0.0763 0.7687 0.7675
Schistosoma mansoni z-protein (S1r protein) 0.0019 0.0051 0.0029
Echinococcus multilocularis transcription factor Dp 1 0.0038 0.0244 0.0194
Echinococcus granulosus Excitatory amino acid transporter 0.0763 0.7687 0.7675
Echinococcus granulosus intermediate filament protein 0.0026 0.0124 0.0073
Echinococcus granulosus tachykinin peptides receptor 99D 0.0362 0.3576 0.3543
Echinococcus multilocularis Excitatory amino acid transporter 0.0763 0.7687 0.7675
Onchocerca volvulus 0.0463 0.4608 0.5963
Echinococcus multilocularis Excitatory amino acid transporter 0.0763 0.7687 0.7675
Schistosoma mansoni histone-lysine n-methyltransferase suv9 0.0069 0.0569 0.0668
Schistosoma mansoni sodium/dicarboxylate symporter-related 0.0338 0.3327 0.4077
Echinococcus multilocularis NMDA receptor 0.0453 0.4505 0.4477
Brugia malayi Glutamate receptor 2 precursor 0.0472 0.4704 0.5653
Schistosoma mansoni solute carrier family 1 (glial high affinity glutamate transporter 0.0763 0.7687 0.9464
Brugia malayi Receptor family ligand binding region containing protein 0.0298 0.2916 0.3504
Loa Loa (eye worm) hypothetical protein 0.0019 0.0051 0.0051
Mycobacterium leprae PROBABLE ENDONUCLEASE IV END (ENDODEOXYRIBONUCLEASE IV) (APURINASE) 0.0076 0.0634 1
Treponema pallidum glutamate/aspartate transporter 0.0338 0.3327 1
Schistosoma mansoni aldehyde dehydrogenase 0.006 0.0473 0.055
Schistosoma mansoni lamin 0.0026 0.0124 0.0119
Schistosoma mansoni lamin 0.0026 0.0124 0.0119
Echinococcus granulosus neutral amino acid transporter A 0.0763 0.7687 0.7675
Loa Loa (eye worm) glutamate receptor 0.0825 0.8321 0.8321
Echinococcus multilocularis nmda type glutamate receptor 0.0183 0.1736 0.1694
Toxoplasma gondii exonuclease III APE 0.0057 0.0437 0.6885
Trypanosoma cruzi tyrosyl-DNA Phosphodiesterase (Tdp1), putative 0.0065 0.0526 0.0687
Loa Loa (eye worm) excitatory amino acid transporter 0.0763 0.7687 0.7687
Echinococcus granulosus DNA apurinic or apyrimidinic site lyase 0.0057 0.0437 0.0388
Schistosoma mansoni glutamate receptor kainate 0.0655 0.6585 0.8102
Mycobacterium ulcerans endonuclease IV 0.0076 0.0634 0.1838
Echinococcus multilocularis glutamate receptor ionotropic kainate 0.0453 0.4505 0.4477
Schistosoma mansoni ap endonuclease 0.0057 0.0437 0.0506
Loa Loa (eye worm) RGC/RGC protein kinase 0.0183 0.1736 0.1736
Echinococcus granulosus nmda type glutamate receptor 0.0551 0.5511 0.5488
Echinococcus granulosus glutamate receptor 2 0.0428 0.425 0.4221
Plasmodium vivax AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.0057 0.0437 0.6877
Echinococcus multilocularis lamin 0.0026 0.0124 0.0073
Brugia malayi Regulator of G protein signaling domain containing protein 0.0019 0.0051 0.0061
Giardia lamblia Endonuclease/Exonuclease/phosphatase 0.0057 0.0437 0.5
Brugia malayi hypothetical protein 0.0118 0.1064 0.1279
Echinococcus multilocularis Glutamate receptor, ionotropic kainate 2 0.0839 0.8464 0.8456
Schistosoma mansoni sodium/dicarboxylate symporter-related 0.0338 0.3327 0.4077
Schistosoma mansoni regulator of G protein signaling 0.0019 0.0051 0.0029
Echinococcus multilocularis glutamate receptor, ionotrophic, AMPA 3 0.0655 0.6583 0.6566
Echinococcus multilocularis sodium:dicarboxylate symporter 0.0763 0.7687 0.7675
Entamoeba histolytica exodeoxyribonuclease III, putative 0.0057 0.0437 0.229
Onchocerca volvulus 0.0183 0.1736 0.2197
Loa Loa (eye worm) AGC/GRK/BARK protein kinase 0.0019 0.0051 0.0051
Schistosoma mansoni regulator of G protein signaling 17 19 20 (rgs17 19 20) 0.0019 0.0051 0.0029
Echinococcus multilocularis neutral amino acid transporter A 0.0763 0.7687 0.7675

Activities

Activity type Activity value Assay description Source Reference
Ki (binding) = 2581 nM Inhibition of [125I]-MePhe7-Neurokinin B (NKB) binding in human Tachykinin receptor 3 of chinese hamster ovary (hNK-3-CHO) cell membranes. ChEMBL. 9191956
Ki (binding) = 2581 nM Inhibition of [125I]-MePhe7-Neurokinin B (NKB) binding in human Tachykinin receptor 3 of chinese hamster ovary (hNK-3-CHO) cell membranes. ChEMBL. 9191956

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.
 
In any case, if you have information about papers containing relevant validation data for this target, please log in using your TDR Targets username and password and send them to us using the corresponding form in this page (only visible to registered users) or contact us.

External resources for this compound

Bibliographic References

1 literature reference was collected for this gene.

If you have references for this compound, please enter them in a user comment (below) or Contact us.