Detailed information for compound 440183

Basic information

Technical information
  • TDR Targets ID: 440183
  • Name: 6-phenylmethoxy-2,3,4,9-tetrahydropyrido[3,4- b]indol-1-one
  • MW: 292.332 | Formula: C18H16N2O2
  • H donors: 2 H acceptors: 1 LogP: 3.16 Rotable bonds: 3
    Rule of 5 violations (Lipinski): 1
  • SMILES: O=C1NCCc2c1[nH]c1c2cc(cc1)OCc1ccccc1
  • InChi: 1S/C18H16N2O2/c21-18-17-14(8-9-19-18)15-10-13(6-7-16(15)20-17)22-11-12-4-2-1-3-5-12/h1-7,10,20H,8-9,11H2,(H,19,21)
  • InChiKey: GFULUZWYBKHEKQ-UHFFFAOYSA-N  


Substructure search Similarity search

Network

Hover on a compound node to display the structore

Synonyms

  • 6-benzyloxy-2,3,4,9-tetrahydropyrido[3,4-b]indol-1-one
  • 6-benzoxy-2,3,4,9-tetrahydro-$b-carbolin-1-one
  • 6-(phenylmethoxy)-2,3,4,9-tetrahydropyrido[3,4-b]indol-1-one
  • 6-(benzyloxy)-2,3,4,9-tetrahydro-$b-carbolin-1-one
  • 6-Benzyloxy-2,3,4,9-tetrahydro-beta-carbolin-1-one
  • BAS 00327290
  • ChemDiv1_000090
  • STK091605
  • CBDivE_004952
  • Oprea1_334650
  • ChemDivAM_000241
  • Oprea1_330602
  • 6-(Benzyloxy)-2,3,4,9-tetrahydro-1H-beta-carbolin-1-one
  • Pyridino[3,4-b]indol-1(2H)-one, 3,4-dihydro-6-benzyloxy-
  • ZINC03895842
  • AG-690/36535032

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Rattus norvegicus Metabotropic glutamate receptor 1 Starlite/ChEMBL References

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Echinococcus granulosus metabotropic glutamate receptor 5 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
Schistosoma japonicum ko:K04606 glutamate receptor, metabotropic 3, putative 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
Brugia malayi metabotropic glutamate receptor subtype 5a (mGluR5a), putative 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
Schistosoma japonicum hypothetical protein 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) hypothetical protein 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 mansoni metabotropic glutamate receptor 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
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
Schistosoma mansoni 60S ribosomal protein L21 0.002 0.0053 0.0099
Echinococcus granulosus Tolloid protein 1 0.0048 0.1051 0.2224
Leishmania major hypothetical protein, unknown function 0.002 0.0053 0.5
Onchocerca volvulus Matrilysin homolog 0.004 0.0779 1
Loa Loa (eye worm) hypothetical protein 0.002 0.0053 0.0055
Loa Loa (eye worm) nuclear Hormone Receptor family member 0.0024 0.0192 0.0199
Schistosoma mansoni voltage-dependent calcium channel 0.002 0.0053 0.0099
Echinococcus multilocularis transient receptor potential cation channel 0.0021 0.0105 0.0098
Schistosoma mansoni vesicular amine transporter 0.002 0.0053 0.0099
Mycobacterium tuberculosis Probable peptidoglycan hydrolase 0.0022 0.0139 0.5
Schistosoma mansoni hypothetical protein 0.002 0.0053 0.0099
Loa Loa (eye worm) hypothetical protein 0.002 0.0053 0.0055
Loa Loa (eye worm) hypothetical protein 0.0021 0.0105 0.011
Brugia malayi Voltage-gated potassium channel, Shaker-family (KCNA, Kv1-like) alpha-subunit 0.002 0.0053 0.0053
Echinococcus granulosus transient receptor potential cation channel 0.0021 0.0105 0.0117
Brugia malayi Voltage-gated calcium channel, T-type, alpha subunit. C. elegans cca-1 ortholog 0.002 0.0053 0.0053
Mycobacterium ulcerans hydrolase 0.0022 0.0139 0.5
Schistosoma mansoni nuclear receptor 2DBD-gamma 0.0024 0.0192 0.0357
Schistosoma mansoni transient receptor potential cation channel subfamily m member 0.002 0.0053 0.0099
Schistosoma mansoni transient receptor potential cation channel subfamily m member 0.002 0.0053 0.0099
Onchocerca volvulus 0.0026 0.0267 0.3431
Schistosoma mansoni calcium-activated potassium channel 0.002 0.0053 0.0099
Loa Loa (eye worm) bone morphogenetic protein 1b 0.0048 0.1051 0.1093
Loa Loa (eye worm) glutamate receptor 0.0019 0.0036 0.0037
Brugia malayi Voltage-gated potassium channel, HERG (KCNH2)-related. C. elegans unc-103 ortholog 0.002 0.0053 0.0053
Brugia malayi Nuclear hormone receptor-like 1 0.0292 0.9608 0.9608
Schistosoma mansoni voltage-gated potassium channel 0.002 0.0053 0.0099
Echinococcus multilocularis short transient receptor potential channel 6 0.0021 0.0105 0.0098
Toxoplasma gondii transporter, cation channel family protein 0.002 0.0053 0.5
Schistosoma mansoni matrix metallopeptidase-9 (M10 family) 0.0043 0.088 0.1638
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0024 0.0192 0.0192
Schistosoma mansoni calcium channel voltage-dependent p/q type alpha 1a-related 0.002 0.0053 0.0099
Schistosoma mansoni cyclic-nucleotide-gated cation channel 0.002 0.0053 0.0099
Loa Loa (eye worm) hypothetical protein 0.002 0.0053 0.0055
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0024 0.0192 0.0261
Brugia malayi Nuclear hormone receptor family member nhr-40 0.0024 0.0192 0.0192
Loa Loa (eye worm) AStacin protease 0.003 0.0417 0.0434
Brugia malayi voltage-dependent calcium channel 0.002 0.0053 0.0053
Echinococcus multilocularis transient receptor potential cation channel 0.0021 0.0105 0.0098
Echinococcus granulosus short transient receptor potential channel 6 0.0021 0.0105 0.0117
Brugia malayi Voltage-gated potassium channel, EAG (KCNH1)-related. C. elegans egl-2 ortholog 0.002 0.0053 0.0053
Brugia malayi Cyclic-nucleotide gated cation channel 0.002 0.0053 0.0053
Schistosoma mansoni voltage-gated potassium channel 0.002 0.0053 0.0099
Trichomonas vaginalis voltage and ligand gated potassium channel, putative 0.002 0.0053 0.5
Brugia malayi Matrix metalloprotease, N-terminal domain containing protein 0.0022 0.0139 0.0139
Echinococcus granulosus Nuclear hormone receptor family member nhr 41 0.0024 0.0192 0.0309
Brugia malayi Nuclear hormone receptor family member nhr-31 0.0024 0.0192 0.0192
Schistosoma mansoni voltage-gated potassium channel 0.002 0.0053 0.0099
Schistosoma mansoni Tr4/Tr2 (homologue) 0.0024 0.0192 0.0357
Loa Loa (eye worm) hypothetical protein 0.002 0.0053 0.0055
Loa Loa (eye worm) hypothetical protein 0.002 0.0053 0.0055
Loa Loa (eye worm) voltage and ligand gated potassium channel 0.002 0.0053 0.0055
Loa Loa (eye worm) hypothetical protein 0.002 0.0053 0.0055
Onchocerca volvulus 0.0024 0.0192 0.2458
Loa Loa (eye worm) hypothetical protein 0.0022 0.0139 0.0145
Toxoplasma gondii transporter, cation channel family protein 0.002 0.0053 0.5
Schistosoma mansoni voltage-gated ion channel 0.002 0.0053 0.0099
Schistosoma mansoni ryanodine receptor related 0.002 0.0053 0.0099
Schistosoma mansoni hypothetical protein 0.0026 0.0267 0.0498
Echinococcus multilocularis thyroid hormone receptor alpha 0.0171 0.537 1
Loa Loa (eye worm) glutamate receptor 0.0049 0.1077 0.1121
Trypanosoma brucei inositol 1,4,5-trisphosphate receptor 0.002 0.0053 0.5
Echinococcus granulosus retinoic acid receptor rxr beta a 0.0024 0.0192 0.0309
Loa Loa (eye worm) voltage-gated potassium channel 0.002 0.0053 0.0055
Schistosoma mansoni high voltage-activated calcium channel Cav2A 0.002 0.0053 0.0099
Echinococcus granulosus matrix metallopeptidase 7 M10 family 0.0066 0.1687 0.3642
Loa Loa (eye worm) matrixin family protein 0.004 0.0779 0.0811
Loa Loa (eye worm) voltage-dependent calcium channel 0.002 0.0053 0.0055
Loa Loa (eye worm) ryanodine receptor 0.002 0.0053 0.0055
Loa Loa (eye worm) hypothetical protein 0.002 0.0053 0.0055
Brugia malayi Voltage-gated potassium channel, Shaw-family (KCNC, Kv3-like) alpha-subunit 0.002 0.0053 0.0053
Schistosoma mansoni metabotropic glutamate receptor 0.0041 0.0798 0.1487
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0024 0.0192 0.0309
Brugia malayi ecdysteroid receptor 0.0024 0.0192 0.0192
Brugia malayi Nuclear hormone receptor family member nhr-41 0.0024 0.0192 0.0192
Echinococcus granulosus FTZ F1 nuclear receptor protein 0.0024 0.0192 0.0309
Loa Loa (eye worm) hypothetical protein 0.002 0.0053 0.0055
Schistosoma mansoni metabotropic glutamate receptor 2 3 (mglur group 2) 0.0056 0.1312 0.2444
Schistosoma mansoni high voltage-activated calcium channel Cav1 0.002 0.0053 0.0099
Brugia malayi Voltage-gated potassium channel, Shab-family (KCNB, Kv2-like) alpha-subunit 0.002 0.0053 0.0053
Loa Loa (eye worm) hypothetical protein 0.002 0.0053 0.0055
Schistosoma mansoni voltage-gated potassium channel 0.002 0.0053 0.0099
Schistosoma mansoni nuclear hormone receptor 0.0024 0.0192 0.0357
Schistosoma mansoni voltage-gated potassium channel 0.002 0.0053 0.0099
Brugia malayi nuclear hormone receptor 0.0024 0.0192 0.0192
Brugia malayi Nuclear hormone receptor-like 1 0.0292 0.9608 0.9608
Loa Loa (eye worm) cyclic-nucleotide gated cation channel 0.002 0.0053 0.0055
Brugia malayi Voltage-gated calcium channel, alpha subunit 0.002 0.0053 0.0053
Leishmania major hypothetical protein, conserved 0.002 0.0053 0.5
Onchocerca volvulus Transient receptor potential cation channel trpm homolog 0.002 0.0053 0.0681
Brugia malayi photoreceptor-specific nuclear receptor 0.0024 0.0192 0.0192
Brugia malayi Transient-receptor-potential like protein 0.002 0.0053 0.0053
Loa Loa (eye worm) nuclear hormone receptor family member nhr-49 0.0024 0.0192 0.0199
Loa Loa (eye worm) hypothetical protein 0.0024 0.0192 0.0199
Schistosoma mansoni FTZ-F1 nuclear receptor-like protein 0.0024 0.0192 0.0357
Echinococcus granulosus metabotropic glutamate receptor 2 0.0041 0.0798 0.1661
Echinococcus multilocularis matrix metallopeptidase 7 (M10 family) 0.0066 0.1687 0.3072
Schistosoma mansoni hyperpolarization activated cyclic nucleotide-gated potassium channel 0.002 0.0053 0.0099
Loa Loa (eye worm) nuclear hormone receptor family member nhr-40 0.0024 0.0192 0.0199
Trypanosoma brucei Voltage-dependent calcium channel subunit, putative 0.002 0.0053 0.5
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0024 0.0192 0.0192
Schistosoma mansoni hyperpolarization activated cyclic nucleotide-gated potassium channel 0.002 0.0053 0.0099
Schistosoma mansoni cyclic-nucleotide-gated cation channel 0.002 0.0053 0.0099
Brugia malayi metabotropic glutamate receptor subtype 5a (mGluR5a), putative 0.0044 0.0916 0.0916
Loa Loa (eye worm) voltage-gated potassium channel 0.002 0.0053 0.0055
Loa Loa (eye worm) hypothetical protein 0.0046 0.0982 0.1022
Onchocerca volvulus Transient receptor potential cation channel trpm homolog 0.002 0.0053 0.0681
Toxoplasma gondii hypothetical protein 0.002 0.0053 0.5
Schistosoma mansoni coup transcription factor 0.0024 0.0192 0.0357
Echinococcus granulosus COUP TF:Svp nuclear hormone receptor 0.0024 0.0192 0.0309
Schistosoma mansoni two-pore calcium channel 0.002 0.0053 0.0099
Loa Loa (eye worm) hypothetical protein 0.002 0.0053 0.0055
Loa Loa (eye worm) hypothetical protein 0.0024 0.0192 0.0199
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0024 0.0192 0.0192
Schistosoma mansoni thyroid hormone receptor 0.0171 0.537 1
Schistosoma mansoni voltage-gated potassium channel KCNQ 0.002 0.0053 0.0099
Loa Loa (eye worm) hypothetical protein 0.002 0.0053 0.0055
Schistosoma mansoni transient receptor potential cation channel subfamily m member 0.002 0.0053 0.0099
Brugia malayi hypothetical protein 0.002 0.0053 0.0053
Echinococcus multilocularis metabotropic glutamate receptor 5 0.006 0.1474 0.2672
Loa Loa (eye worm) hypothetical protein 0.002 0.0049 0.0051
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0024 0.0192 0.0192
Mycobacterium leprae PROBABLE HYDROLASE 0.0022 0.0139 0.5
Brugia malayi Steroid receptor seven-up type 2 0.0024 0.0192 0.0192
Onchocerca volvulus Matrix metalloproteinase homolog 0.004 0.0779 1
Schistosoma mansoni voltage-gated potassium channel 0.002 0.0053 0.0099
Brugia malayi Voltage-gated potassium channel, KCNQ (Kv7-like) alpha-subunit. C. elegans kqt-1 ortholog 0.002 0.0053 0.0053
Brugia malayi Large-conductance calcium-activated potassium channel Slo-1 (KCNMA) alpha subunit. C. elegans slo-1 ortholog 0.002 0.0053 0.0053
Schistosoma mansoni transient receptor potential cation channel subfamily m member 0.002 0.0053 0.0099
Onchocerca volvulus Bile acid receptor homolog 0.0024 0.0192 0.2458
Toxoplasma gondii transporter, cation channel family protein 0.002 0.0053 0.5
Echinococcus multilocularis ecdysone induced protein 78C 0.0024 0.0192 0.0261
Loa Loa (eye worm) hypothetical protein 0.002 0.0053 0.0055
Loa Loa (eye worm) hypothetical protein 0.002 0.0053 0.0055
Schistosoma mansoni voltage-gated potassium channel 0.002 0.0053 0.0099
Brugia malayi Nuclear hormone receptor family member nhr-1 0.0024 0.0192 0.0192
Loa Loa (eye worm) hypothetical protein 0.002 0.0053 0.0055
Brugia malayi Voltage-gated potassium channel, Shab-family (KCNB, Kv2-like) alpha-subunit. C. elegans exp-2 ortholog 0.002 0.0053 0.0053
Echinococcus multilocularis FTZ F1 nuclear receptor protein 0.0024 0.0192 0.0261
Brugia malayi Voltage-gated calcium channel, P/Q-type, alpha subunit. C. elegans unc-2 ortholog 0.002 0.0053 0.0053
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0024 0.0192 0.0309
Schistosoma mansoni transient receptor potential channel 0.0021 0.0105 0.0196
Loa Loa (eye worm) cyclic-nucleotide gated cation channel 0.002 0.0053 0.0055
Brugia malayi Hemopexin family protein 0.0026 0.0267 0.0267
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.002 0.0053 0.5
Loa Loa (eye worm) nuclear hormone receptor family member nhr-14 0.0024 0.0192 0.0199
Onchocerca volvulus Protein ultraspiracle homolog 0.0024 0.0192 0.2458
Loa Loa (eye worm) hypothetical protein 0.002 0.0053 0.0055
Loa Loa (eye worm) hypothetical protein 0.0024 0.0192 0.0199
Brugia malayi Voltage-gated potassium channel, Shaw-family (KCNC, Kv3-like) alpha-subunit 0.002 0.0053 0.0053
Echinococcus granulosus FTZ F1 alpha 0.0024 0.0192 0.0309
Brugia malayi Ryanodine Receptor TM 4-6 family protein 0.002 0.0053 0.0053
Schistosoma mansoni voltage-gated potassium channel 0.002 0.0053 0.0099
Schistosoma mansoni metabotropic glutamate receptor 0.0024 0.0197 0.0367
Echinococcus multilocularis hepatocyte nuclear factor 4 alpha 0.0024 0.0192 0.0261
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0024 0.0192 0.0192
Brugia malayi ion channel NompC 0.002 0.0053 0.0053
Schistosoma mansoni transient receptor potential channel 0.002 0.0053 0.0099
Loa Loa (eye worm) hypothetical protein 0.0024 0.0192 0.0199
Brugia malayi Nuclear hormone receptor family member nhr-14 0.0024 0.0192 0.0192
Loa Loa (eye worm) steroid hormone receptor 0.0024 0.0192 0.0199
Loa Loa (eye worm) nuclear hormone receptor family member nhr-41 0.0024 0.0192 0.0199
Echinococcus multilocularis COUP TF:Svp nuclear hormone receptor 0.0024 0.0192 0.0261
Loa Loa (eye worm) voltage-gated calcium channel 0.002 0.0053 0.0055
Loa Loa (eye worm) hypothetical protein 0.0024 0.0192 0.0199
Echinococcus multilocularis FTZ F1 alpha 0.0024 0.0192 0.0261
Brugia malayi metabotropic glutamate receptor type 2 0.0024 0.0197 0.0197
Schistosoma mansoni voltage-gated potassium channel 0.002 0.0053 0.0099
Loa Loa (eye worm) hypothetical protein 0.0024 0.0192 0.0199
Schistosoma mansoni hypothetical protein 0.0147 0.4539 0.8452
Toxoplasma gondii hypothetical protein 0.002 0.0053 0.5
Loa Loa (eye worm) hypothetical protein 0.0291 0.9561 0.9951
Loa Loa (eye worm) hypothetical protein 0.0024 0.0192 0.0199
Schistosoma mansoni nuclear hormone receptor nor-1/nor-2 0.0024 0.0192 0.0357
Schistosoma mansoni cyclic-nucleotide-gated cation channel 0.002 0.0053 0.0099
Leishmania major calcium channel protein, putative,ion transporter, putative 0.002 0.0053 0.5
Loa Loa (eye worm) hypothetical protein 0.002 0.0053 0.0055
Trypanosoma cruzi inositol 1,4,5-trisphosphate receptor, putative 0.002 0.0053 0.5
Echinococcus multilocularis metabotropic glutamate receptor 2 0.0041 0.0798 0.1402
Loa Loa (eye worm) nuclear hormone receptor family member nhr-31 0.0024 0.0192 0.0199
Echinococcus granulosus Mitotic checkpoint protein PRCC C terminal 0.0147 0.4539 1
Loa Loa (eye worm) hypothetical protein 0.002 0.0053 0.0055
Schistosoma mansoni voltage-gated cation channel 0.002 0.0053 0.0099
Schistosoma mansoni voltage-gated potassium channel 0.002 0.0053 0.0099
Loa Loa (eye worm) matrixin family protein 0.0044 0.0907 0.0944
Brugia malayi Matrixin family protein 0.0044 0.0907 0.0907
Trichomonas vaginalis voltage and ligand gated potassium channel, putative 0.002 0.0053 0.5
Schistosoma mansoni voltage-gated potassium channel 0.002 0.0053 0.0099
Schistosoma mansoni voltage-gated potassium channel 0.002 0.0053 0.0099
Schistosoma mansoni transient receptor potential cation channel subfamily m member 0.002 0.0053 0.0099
Brugia malayi olfactory channel protein osm-9 0.0021 0.0105 0.0105
Schistosoma mansoni steroid hormone receptor ad4bp 0.0024 0.0192 0.0357
Trypanosoma cruzi Voltage-dependent calcium channel subunit, putative 0.002 0.0053 0.5
Schistosoma mansoni RAR-like nuclear receptor 0.0024 0.0192 0.0357
Loa Loa (eye worm) calcium channel 0.002 0.0053 0.0055
Schistosoma mansoni hyperpolarization activated cyclic nucleotide-gated potassium channel 0.002 0.0053 0.0099
Onchocerca volvulus 0.002 0.0053 0.0681
Schistosoma mansoni transient receptor potential channel 4 0.002 0.0053 0.0099
Echinococcus granulosus metabotropic glutamate receptor 5 0.006 0.1474 0.3167
Brugia malayi cation channel family protein 0.002 0.0053 0.0053
Brugia malayi steroid hormone receptor 0.0024 0.0192 0.0192
Echinococcus multilocularis Tolloid protein 1 0.0048 0.1051 0.1876
Echinococcus multilocularis Nuclear hormone receptor family member nhr 41 0.0024 0.0192 0.0261
Loa Loa (eye worm) hypothetical protein 0.002 0.0053 0.0055
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0024 0.0192 0.0192
Echinococcus multilocularis Mitotic checkpoint protein PRCC, C terminal 0.0147 0.4539 0.8436
Schistosoma mansoni transient receptor potential channel 0.002 0.0053 0.0099
Brugia malayi nuclear receptor NHR-88 0.0024 0.0192 0.0192
Loa Loa (eye worm) hypothetical protein 0.002 0.0053 0.0055
Loa Loa (eye worm) hypothetical protein 0.0024 0.0192 0.0199
Echinococcus granulosus ecdysone induced protein 78C 0.0024 0.0192 0.0309
Schistosoma mansoni subfamily M12A unassigned peptidase (M12 family) 0.0048 0.1051 0.1956
Schistosoma mansoni thyroid hormone receptor 0.0171 0.537 1
Echinococcus granulosus hepatocyte nuclear factor 4 alpha 0.0024 0.0192 0.0309
Brugia malayi Voltage-gated potassium channel, Shaw-family (KCNC, Kv3-like) alpha-subunit. C. elegans egl-36 ortholog 0.002 0.0053 0.0053
Schistosoma mansoni voltage-gated potassium channel 0.002 0.0053 0.0099
Schistosoma mansoni photoreceptor-specific nuclear receptor related 0.0024 0.0192 0.0357
Brugia malayi Nuclear hormone receptor family member nhr-49 0.0024 0.0192 0.0192
Brugia malayi cation channel family protein 0.002 0.0053 0.0053
Schistosoma mansoni cyclic-nucleotide-gated cation channel 0.002 0.0053 0.0099
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.002 0.0053 0.5
Schistosoma mansoni retinoid-x-receptor (RXR) 0.0024 0.0192 0.0357
Loa Loa (eye worm) nuclear hormone receptor-like 1 0.0292 0.9608 1
Loa Loa (eye worm) hypothetical protein 0.002 0.0053 0.0055
Schistosoma mansoni inositol 145-trisphosphate receptor 0.002 0.0053 0.0099
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0024 0.0192 0.0261
Loa Loa (eye worm) hypothetical protein 0.006 0.1474 0.1534
Schistosoma mansoni voltage-gated potassium channel 0.002 0.0053 0.0099
Brugia malayi Voltage-gated calcium channel, L-type, alpha subunit. C. elegans egl-19 ortholog 0.002 0.0053 0.0053
Schistosoma mansoni voltage-gated potassium channel 0.002 0.0053 0.0099
Schistosoma mansoni voltage-gated potassium channel 0.002 0.0053 0.0099
Schistosoma mansoni retinoic acid receptor RXR 0.0024 0.0192 0.0357
Brugia malayi Nuclear hormone receptor family member nhr-3 0.0024 0.0192 0.0192
Loa Loa (eye worm) hypothetical protein 0.002 0.0053 0.0055
Onchocerca volvulus Steroid hormone receptor family member cnr14 homolog 0.0024 0.0192 0.2458
Loa Loa (eye worm) nuclear hormone receptor family member nhr-1 0.0024 0.0192 0.0199
Brugia malayi Metabotropic glutamate receptor precursor. 0.0049 0.1077 0.1077
Loa Loa (eye worm) ion channel NompC 0.002 0.0053 0.0055
Schistosoma mansoni voltage-gated potassium channel 0.002 0.0053 0.0099
Schistosoma mansoni voltage-gated potassium channel 0.002 0.0053 0.0099

Activities

Activity type Activity value Assay description Source Reference
Cmax (ADMET) = 145 ng/ml Cmax in rat ChEMBL. 17276684
F (ADMET) = 0 % Oral bioavailability in rat at 1 mg/kg, po ChEMBL. 17276684
F (ADMET) = 9 % Oral bioavailability in rat at 5 mg/kg, po ChEMBL. 17276684
IC50 (functional) = 104 nM Antagonist activity at rat mGluR1a expressed in CHO cells assessed as inhibition of intracellular calcium ion mobilization by FLIPR assay ChEMBL. 17276684
IC50 (functional) = 104 nM Antagonist activity at rat mGluR1a expressed in CHO cells assessed as inhibition of intracellular calcium ion mobilization by FLIPR assay ChEMBL. 17276684

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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