Detailed information for compound 55493

Basic information

Technical information
  • TDR Targets ID: 55493
  • Name: (1R,2R,3S)-1-(1,3-benzodioxol-5-yl)-3-(4-meth oxyphenyl)-2,3-dihydro-1H-indene-2-carboxylic acid
  • MW: 388.413 | Formula: C24H20O5
  • H donors: 1 H acceptors: 2 LogP: 4.44 Rotable bonds: 4
    Rule of 5 violations (Lipinski): 1
  • SMILES: COc1ccc(cc1)[C@@H]1[C@@H](C(=O)O)[C@@H](c2c1cccc2)c1ccc2c(c1)OCO2
  • InChi: 1S/C24H20O5/c1-27-16-9-6-14(7-10-16)21-17-4-2-3-5-18(17)22(23(21)24(25)26)15-8-11-19-20(12-15)29-13-28-19/h2-12,21-23H,13H2,1H3,(H,25,26)/t21-,22+,23+/m0/s1
  • InChiKey: QDRPQGXYQQITQV-YTFSRNRJSA-N  


Substructure search Similarity search

Network

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Synonyms

  • (1R,2R,3S)-1-(1,3-benzodioxol-5-yl)-3-(4-methoxyphenyl)indane-2-carboxylic acid
  • (1R,2R,3S)-1-(1,3-benzodioxol-5-yl)-3-(4-methoxyphenyl)-2-indanecarboxylic acid

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens endothelin receptor type B 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
No druggable targets predicted by sequence similarity
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Loa Loa (eye worm) gonadotropin-releasing hormone receptor 2 0.0152 0.0968 0.0968
Schistosoma mansoni alpha-1 adrenergic receptor 0.0152 0.0968 0.0968
Schistosoma mansoni neuropeptide receptor 0.0152 0.0968 0.0968
Loa Loa (eye worm) hypothetical protein 0.0152 0.0968 0.0968
Schistosoma mansoni hypothetical protein 0.0152 0.0968 0.0968
Loa Loa (eye worm) hypothetical protein 0.0152 0.0968 0.0968
Echinococcus granulosus Glutamate receptor ionotropic kainate 2 0.0292 0.2255 0.2255
Schistosoma mansoni calcium-activated potassium channel 0.066 0.5633 0.5633
Loa Loa (eye worm) hypothetical protein 0.0152 0.0968 0.0968
Echinococcus multilocularis dro:myosuppressin receptor 0.0152 0.0968 0.0968
Echinococcus granulosus nmda type glutamate receptor 0.0262 0.1981 0.1981
Echinococcus multilocularis Glutamate receptor, ionotropic kainate 2 0.0292 0.2255 0.2255
Echinococcus multilocularis tachykinin peptides receptor 99D 0.0152 0.0968 0.0968
Schistosoma mansoni biogenic amine receptor 0.0152 0.0968 0.0968
Echinococcus multilocularis neuropeptides capa receptor 0.0152 0.0968 0.0968
Schistosoma mansoni opsin-like receptor 0.0152 0.0968 0.0968
Mycobacterium tuberculosis Probable glutamine-binding lipoprotein GlnH (GLNBP) 0.0063 0.0148 0.5
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0152 0.0968 0.0968
Schistosoma mansoni opsin-like receptor 0.0152 0.0968 0.0968
Brugia malayi Dopamine receptor protein 2 0.0152 0.0968 0.0968
Loa Loa (eye worm) hypothetical protein 0.0181 0.1237 0.1237
Brugia malayi hypothetical protein 0.0152 0.0968 0.0968
Echinococcus granulosus 7TM GPCR rhodopsin 0.0152 0.0968 0.0968
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0152 0.0968 0.0968
Echinococcus multilocularis neuropeptide Y receptor 0.0152 0.0968 0.0968
Brugia malayi Tachykinin-like peptides receptor 99D 0.0152 0.0968 0.0968
Brugia malayi hypothetical protein 0.0152 0.0968 0.0968
Echinococcus multilocularis tm gpcr rhodopsin gpcr rhodopsin superfamily 0.0152 0.0968 0.0968
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0152 0.0968 0.0968
Echinococcus multilocularis rhodopsin orphan GPCR 0.0152 0.0968 0.0968
Echinococcus granulosus Ribosomal protein S1 RNA binding domain 0.0113 0.0607 0.0607
Loa Loa (eye worm) hypothetical protein 0.0152 0.0968 0.0968
Brugia malayi hypothetical protein 0.0152 0.0968 0.0968
Echinococcus granulosus dro:myosuppressin receptor 0.0152 0.0968 0.0968
Brugia malayi neuropeptide F receptor 0.0152 0.0968 0.0968
Brugia malayi neuropeptide F receptor 0.0152 0.0968 0.0968
Schistosoma mansoni hypothetical protein 0.0152 0.0968 0.0968
Echinococcus granulosus tm gpcr rhodopsin 0.0152 0.0968 0.0968
Onchocerca volvulus 0.0152 0.0968 0.5
Echinococcus granulosus Glutamate receptor ionotropic kainate 2 0.0292 0.2255 0.2255
Schistosoma mansoni amine GPCR 0.0152 0.0968 0.0968
Loa Loa (eye worm) hypothetical protein 0.0152 0.0968 0.0968
Loa Loa (eye worm) hypothetical protein 0.0152 0.0968 0.0968
Echinococcus granulosus glutamate receptor 2 0.018 0.122 0.122
Loa Loa (eye worm) hypothetical protein 0.0152 0.0968 0.0968
Echinococcus granulosus biogenic amine 5HT receptor 0.0152 0.0968 0.0968
Trichomonas vaginalis voltage and ligand gated potassium channel, putative 0.0065 0.0166 0.5
Brugia malayi hypothetical protein 0.0152 0.0968 0.0968
Schistosoma mansoni biogenic amine receptor 0.0152 0.0968 0.0968
Echinococcus granulosus neuropeptide FF receptor 2 0.0152 0.0968 0.0968
Schistosoma mansoni biogenic amine (5HT) receptor 0.0152 0.0968 0.0968
Echinococcus multilocularis rhodopsin orphan GPCR 0.0152 0.0968 0.0968
Schistosoma mansoni peptide (allatostatin)-like receptor 0.0152 0.0968 0.0968
Echinococcus multilocularis G-protein coupled receptor, putative 0.0152 0.0968 0.0968
Brugia malayi Unidentified vitellogenin-linked transcript protein 6, putative 0.0152 0.0968 0.0968
Echinococcus multilocularis glutamate receptor NMDA 0.0087 0.037 0.037
Echinococcus multilocularis neuropeptide Y receptor 0.0152 0.0968 0.0968
Echinococcus granulosus sex peptide receptor 0.0152 0.0968 0.0968
Schistosoma mansoni glutamate receptor kainate 0.0263 0.1986 0.1986
Loa Loa (eye worm) melatonin receptor type 1A 0.0152 0.0968 0.0968
Brugia malayi G-protein-linked acetylcholine receptor protein 2, putative 0.0152 0.0968 0.0968
Echinococcus multilocularis glutamate receptor 2 0.018 0.122 0.122
Echinococcus granulosus small conductance calcium activated potassium 0.066 0.5633 0.5633
Echinococcus granulosus g protein coupled receptor 0.0152 0.0968 0.0968
Echinococcus granulosus hypothetical protein 0.0152 0.0968 0.0968
Loa Loa (eye worm) hypothetical protein 0.0152 0.0968 0.0968
Brugia malayi Dopamine receptor protein 1, putative (partial) 0.0152 0.0968 0.0968
Loa Loa (eye worm) abnormal catecholamine distribution protein 1 0.1136 1 1
Echinococcus multilocularis fmrfamide receptor 0.0152 0.0968 0.0968
Brugia malayi ORL1-like opioid receptor 0.0152 0.0968 0.0968
Loa Loa (eye worm) G-protein coupled receptor 0.0152 0.0968 0.0968
Echinococcus multilocularis growth hormone secretagogue receptor type 1 0.0152 0.0968 0.0968
Echinococcus multilocularis rhodopsin orphan GPCR 0.0152 0.0968 0.0968
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0152 0.0968 0.0968
Schistosoma mansoni peptide (allatostatin/somatostatin)-like receptor 0.0152 0.0968 0.0968
Loa Loa (eye worm) hypothetical protein 0.0152 0.0968 0.0968
Echinococcus granulosus tachykinin peptides receptor 99D 0.0152 0.0968 0.0968
Brugia malayi AKH receptor 0.0152 0.0968 0.0968
Onchocerca volvulus 0.0152 0.0968 0.5
Loa Loa (eye worm) hypothetical protein 0.0152 0.0968 0.0968
Brugia malayi larval opioid receptor 0.0152 0.0968 0.0968
Echinococcus multilocularis glutamate receptor subunit protein glur 0.0113 0.0607 0.0607
Schistosoma mansoni neuropeptide F-like receptor 0.0152 0.0968 0.0968
Echinococcus granulosus rhodopsin orphan GPCR 0.0152 0.0968 0.0968
Schistosoma mansoni amine GPCR 0.0152 0.0968 0.0968
Echinococcus multilocularis g protein coupled receptor 0.0152 0.0968 0.0968
Echinococcus multilocularis glutamate receptor 2 0.0292 0.2255 0.2255
Echinococcus multilocularis neuropeptide s receptor 0.0152 0.0968 0.0968
Echinococcus granulosus somatostatin receptor 0.0152 0.0968 0.0968
Echinococcus multilocularis g-protein coupled receptor 0.0152 0.0968 0.0968
Echinococcus multilocularis Glutamate receptor, ionotropic kainate 3 0.0175 0.1183 0.1183
Schistosoma mansoni calcium-activated potassium channel 0.0452 0.3723 0.3723
Schistosoma mansoni glutamate receptor kainate 0.0263 0.1986 0.1986
Onchocerca volvulus 0.0152 0.0968 0.5
Brugia malayi G-protein coupled receptor 0.0152 0.0968 0.0968
Echinococcus multilocularis tm gpcr rhodopsin gpcr rhodopsin superfamily 0.0152 0.0968 0.0968
Echinococcus multilocularis orexin receptor type 2 0.0152 0.0968 0.0968
Loa Loa (eye worm) hypothetical protein 0.0152 0.0968 0.0968
Onchocerca volvulus 0.0152 0.0968 0.5
Loa Loa (eye worm) hypothetical protein 0.0152 0.0968 0.0968
Loa Loa (eye worm) hypothetical protein 0.0152 0.0968 0.0968
Onchocerca volvulus 0.0152 0.0968 0.5
Schistosoma mansoni amine GPCR 0.0152 0.0968 0.0968
Loa Loa (eye worm) hypothetical protein 0.0152 0.0968 0.0968
Schistosoma mansoni amine GPCR 0.0152 0.0968 0.0968
Brugia malayi Serotonin/octopamine receptor family protein 7 0.0152 0.0968 0.0968
Trichomonas vaginalis voltage and ligand gated potassium channel, putative 0.0065 0.0166 0.5
Schistosoma mansoni peptide (FMRFamide/somatostatin)-like receptor 0.0152 0.0968 0.0968
Brugia malayi G-protein coupled receptor 0.0152 0.0968 0.0968
Loa Loa (eye worm) hypothetical protein 0.0152 0.0968 0.0968
Onchocerca volvulus 0.0152 0.0968 0.5
Echinococcus granulosus rhodopsin orphan GPCR 0.0152 0.0968 0.0968
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0152 0.0968 0.0968
Echinococcus granulosus synaptic vesicular amine transporter 0.1136 1 1
Brugia malayi Serotonin receptor 0.0152 0.0968 0.0968
Loa Loa (eye worm) glutamate receptor 2 0.0263 0.1986 0.1986
Schistosoma mansoni hypothetical protein 0.0152 0.0968 0.0968
Schistosoma mansoni lipoxygenase 0.0114 0.0618 0.0618
Brugia malayi Melatonin receptor type 1A 0.0152 0.0968 0.0968
Brugia malayi Glutamate receptor 1 precursor 0.0263 0.1986 0.1986
Schistosoma mansoni opsin-like receptor 0.0152 0.0968 0.0968
Onchocerca volvulus 0.0152 0.0968 0.5
Echinococcus granulosus growth hormone secretagogue receptor type 1 0.0152 0.0968 0.0968
Echinococcus granulosus fmrfamide receptor 0.0152 0.0968 0.0968
Onchocerca volvulus 0.0152 0.0968 0.5
Loa Loa (eye worm) hypothetical protein 0.0152 0.0968 0.0968
Loa Loa (eye worm) hypothetical protein 0.0152 0.0968 0.0968
Echinococcus granulosus glutamate receptor subunit protein glur 0.0113 0.0607 0.0607
Schistosoma mansoni glutamate receptor NMDA 0.0379 0.3054 0.3054
Loa Loa (eye worm) hypothetical protein 0.0152 0.0968 0.0968
Loa Loa (eye worm) hypothetical protein 0.0152 0.0968 0.0968
Schistosoma mansoni amine GPCR 0.0152 0.0968 0.0968
Echinococcus granulosus neuropeptide receptor A26 0.0152 0.0968 0.0968
Echinococcus multilocularis glutamate receptor, ionotrophic, AMPA 3 0.0292 0.2255 0.2255
Echinococcus multilocularis biogenic amine (5HT) receptor 0.0152 0.0968 0.0968
Echinococcus multilocularis neuropeptide FF receptor 2 0.0152 0.0968 0.0968
Loa Loa (eye worm) TYRA-2 protein 0.0152 0.0968 0.0968
Echinococcus granulosus rhodopsin orphan GPCR 0.0152 0.0968 0.0968
Onchocerca volvulus 0.0152 0.0968 0.5
Chlamydia trachomatis arginine ABC transporter substrate-binding protein ArtJ 0.0063 0.0148 0.5
Loa Loa (eye worm) hypothetical protein 0.0152 0.0968 0.0968
Echinococcus multilocularis 7TM GPCR, rhodopsin 0.0152 0.0968 0.0968
Echinococcus multilocularis rhodopsin orphan GPCR 0.0152 0.0968 0.0968
Schistosoma mansoni vesicular amine transporter 0.1136 1 1
Onchocerca volvulus 0.0152 0.0968 0.5
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0152 0.0968 0.0968
Schistosoma mansoni biogenic amine receptor 0.0152 0.0968 0.0968
Onchocerca volvulus 0.0152 0.0968 0.5
Schistosoma mansoni biogenic amine (dopamine) receptor 0.0152 0.0968 0.0968
Loa Loa (eye worm) hypothetical protein 0.0152 0.0968 0.0968
Echinococcus granulosus g-protein coupled receptor 0.0152 0.0968 0.0968
Echinococcus granulosus pyroglutamylated rfamide peptide receptor 0.0152 0.0968 0.0968
Brugia malayi G protein-coupled receptor 0.0152 0.0968 0.0968
Echinococcus multilocularis glutamate (NMDA) receptor subunit 0.0446 0.3663 0.3663
Brugia malayi hypothetical protein 0.0152 0.0968 0.0968
Schistosoma mansoni growth hormone secretagogue receptor 0.0152 0.0968 0.0968
Schistosoma mansoni peptide (FMRFamide/neurokinin-3)-like receptor 0.0152 0.0968 0.0968
Schistosoma mansoni peptide (FMRFamide/somatostatin)-like receptor 0.0152 0.0968 0.0968
Echinococcus granulosus g protein linked acetylcholine receptor gar 2a 0.0152 0.0968 0.0968
Brugia malayi hypothetical protein 0.0152 0.0968 0.0968
Loa Loa (eye worm) hypothetical protein 0.0152 0.0968 0.0968
Mycobacterium ulcerans glutamine-binding lipoprotein GlnH 0.0063 0.0148 0.5
Echinococcus multilocularis small conductance calcium activated potassium 0.066 0.5633 0.5633
Loa Loa (eye worm) hypothetical protein 0.0152 0.0968 0.0968
Echinococcus multilocularis glutamate receptor 2 0.0263 0.1986 0.1986
Echinococcus multilocularis Ribosomal protein S1, RNA binding domain 0.0113 0.0607 0.0607
Echinococcus granulosus rhodopsin orphan GPCR 0.0152 0.0968 0.0968
Loa Loa (eye worm) hypothetical protein 0.0152 0.0968 0.0968
Loa Loa (eye worm) hypothetical protein 0.0152 0.0968 0.0968
Loa Loa (eye worm) unidentified vitellogenin-linked transcript protein 6 0.0152 0.0968 0.0968
Echinococcus multilocularis fmrfamide receptor 0.0152 0.0968 0.0968
Echinococcus granulosus rhodopsin orphan GPCR 0.0152 0.0968 0.0968
Loa Loa (eye worm) hypothetical protein 0.0152 0.0968 0.0968
Loa Loa (eye worm) G-protein coupled receptor 0.0152 0.0968 0.0968
Echinococcus multilocularis g protein linked acetylcholine receptor gar 2a 0.0152 0.0968 0.0968
Brugia malayi putative neuropeptide receptor 0.0152 0.0968 0.0968
Echinococcus granulosus serotonin receptor 0.0152 0.0968 0.0968
Loa Loa (eye worm) hypothetical protein 0.0152 0.0968 0.0968
Brugia malayi hypothetical protein 0.0152 0.0968 0.0968
Schistosoma mansoni histamine-responsive GPCR (AAF21638) 0.0152 0.0968 0.0968
Echinococcus granulosus rhodopsin orphan GPCR 0.0152 0.0968 0.0968
Brugia malayi putative neuropeptide receptor NPR1 0.0152 0.0968 0.0968
Loa Loa (eye worm) follicle stimulating hormone receptor 0.0152 0.0968 0.0968
Echinococcus granulosus G protein coupled 5 hydroxytryptamine receptor 0.0152 0.0968 0.0968
Brugia malayi RE15519p 0.0152 0.0968 0.0968
Echinococcus multilocularis g protein linked acetylcholine receptor gar 2a 0.0152 0.0968 0.0968
Echinococcus granulosus Glutamate receptor ionotropic kainate 2 0.0292 0.2255 0.2255
Loa Loa (eye worm) hypothetical protein 0.0152 0.0968 0.0968
Loa Loa (eye worm) hypothetical protein 0.0152 0.0968 0.0968
Onchocerca volvulus 0.0152 0.0968 0.5
Loa Loa (eye worm) neuropeptide F receptor 0.0152 0.0968 0.0968
Schistosoma mansoni ATP-binding cassette transporter 0.0263 0.1986 0.1986
Echinococcus granulosus neuropeptides capa receptor 0.0152 0.0968 0.0968
Echinococcus granulosus neuropeptide Y receptor 0.0152 0.0968 0.0968
Loa Loa (eye worm) hypothetical protein 0.0152 0.0968 0.0968
Schistosoma mansoni muscarinic acetylcholine (GAR) receptor 0.0152 0.0968 0.0968
Loa Loa (eye worm) hypothetical protein 0.0275 0.2092 0.2092
Schistosoma mansoni biogenic amine (dopamine) receptor 0.0152 0.0968 0.0968
Brugia malayi G protein-coupled receptor F59B2.13 0.0152 0.0968 0.0968
Echinococcus multilocularis Glutamate receptor, ionotropic kainate 2 0.0292 0.2255 0.2255
Echinococcus multilocularis G protein coupled 5 hydroxytryptamine receptor 0.0152 0.0968 0.0968
Echinococcus multilocularis peptide (allatostatin:somatostatin) 0.0152 0.0968 0.0968
Schistosoma mansoni adenoreceptor 0.0152 0.0968 0.0968
Loa Loa (eye worm) hypothetical protein 0.0152 0.0968 0.0968
Echinococcus granulosus glutamate receptor 2 0.0292 0.2255 0.2255
Schistosoma mansoni biogenic amine (octopamine/dopamine) receptor 0.0152 0.0968 0.0968
Loa Loa (eye worm) G-protein-linked acetylcholine receptor protein 2 0.0152 0.0968 0.0968
Brugia malayi follicle stimulating hormone receptor 0.0152 0.0968 0.0968
Loa Loa (eye worm) hypothetical protein 0.0152 0.0968 0.0968
Echinococcus granulosus peptide allatostatin:somatostatin 0.0152 0.0968 0.0968
Echinococcus multilocularis Glutamate receptor, ionotropic kainate 2 0.0292 0.2255 0.2255
Loa Loa (eye worm) hypothetical protein 0.0152 0.0968 0.0968
Echinococcus granulosus g protein coupled receptor 0.0152 0.0968 0.0968
Echinococcus granulosus glutamate receptor ionotropic kainate 0.0113 0.0607 0.0607
Echinococcus multilocularis nmda type glutamate receptor 0.0262 0.1981 0.1981
Echinococcus multilocularis NMDA receptor 0.0113 0.0607 0.0607
Echinococcus granulosus g protein coupled receptor 0.0152 0.0968 0.0968
Schistosoma mansoni neuropeptide F-like receptor 0.0152 0.0968 0.0968
Echinococcus multilocularis tm gpcr rhodopsin gpcr rhodopsin superfamily 0.0152 0.0968 0.0968
Schistosoma mansoni hypothetical protein 0.0113 0.0607 0.0607
Brugia malayi gonadotropin-releasing hormone receptor 2 0.0152 0.0968 0.0968
Echinococcus granulosus nmda type glutamate receptor 0.0116 0.0639 0.0639
Loa Loa (eye worm) hypothetical protein 0.066 0.5633 0.5633
Echinococcus multilocularis synaptic vesicular amine transporter 0.1136 1 1
Brugia malayi sulfakinin receptor protein 0.0152 0.0968 0.0968
Echinococcus multilocularis neuropeptide receptor 0.0152 0.0968 0.0968
Brugia malayi Serotonin receptor 0.0598 0.5067 0.5067
Echinococcus multilocularis pyroglutamylated rfamide peptide receptor 0.0152 0.0968 0.0968
Echinococcus multilocularis neuropeptide receptor A26 0.0152 0.0968 0.0968
Loa Loa (eye worm) hypothetical protein 0.0152 0.0968 0.0968
Echinococcus multilocularis somatostatin receptor 0.0152 0.0968 0.0968
Schistosoma mansoni histamine h1 receptor 0.0152 0.0968 0.0968
Schistosoma mansoni glutamate receptor kainate 0.0263 0.1986 0.1986
Loa Loa (eye worm) neuropeptide F receptor 0.0152 0.0968 0.0968
Onchocerca volvulus 0.0152 0.0968 0.5
Loa Loa (eye worm) hypothetical protein 0.0152 0.0968 0.0968
Echinococcus multilocularis neuropeptide receptor 0.0152 0.0968 0.0968
Onchocerca volvulus Dopamine\/Ecdysteroid receptor homolog 0.0152 0.0968 0.5
Schistosoma mansoni lipoxygenase 0.008 0.0303 0.0303
Schistosoma mansoni neuropeptide f receptor 76f 0.0152 0.0968 0.0968
Schistosoma mansoni neuropeptide receptor 0.0152 0.0968 0.0968
Echinococcus multilocularis alpha 1A adrenergic receptor 0.0152 0.0968 0.0968
Echinococcus granulosus neuropeptides capa receptor 0.0152 0.0968 0.0968
Schistosoma mansoni glutamate receptor AMPA 0.0263 0.1986 0.1986
Loa Loa (eye worm) hypothetical protein 0.0152 0.0968 0.0968
Schistosoma mansoni neuropeptide receptor 0.0152 0.0968 0.0968
Echinococcus granulosus glutamate receptor NMDA 0.0087 0.037 0.037
Onchocerca volvulus 0.0152 0.0968 0.5
Echinococcus multilocularis rhodopsin orphan GPCR 0.0152 0.0968 0.0968
Schistosoma mansoni biogenic amine (5HT) receptor 0.0152 0.0968 0.0968
Schistosoma mansoni biogenic amine (dopamine) receptor 0.0152 0.0968 0.0968
Echinococcus multilocularis rhodopsin orphan GPCR 0.0152 0.0968 0.0968
Echinococcus granulosus thyrotropin releasing hormone receptor 0.0152 0.0968 0.0968
Echinococcus granulosus allatostatin A receptor 0.0152 0.0968 0.0968
Schistosoma mansoni hypothetical protein 0.066 0.5633 0.5633
Loa Loa (eye worm) hypothetical protein 0.0152 0.0968 0.0968
Schistosoma mansoni glutamate receptor AMPA 0.0263 0.1986 0.1986
Echinococcus multilocularis thyrotropin releasing hormone receptor 0.0152 0.0968 0.0968
Echinococcus multilocularis allatostatin A receptor 0.0152 0.0968 0.0968
Brugia malayi Dopamine receptor protein 1 0.0152 0.0968 0.0968
Echinococcus granulosus glutamate NMDA receptor subunit 0.0446 0.3663 0.3663
Echinococcus multilocularis glutamate receptor ionotropic kainate 0.0113 0.0607 0.0607
Loa Loa (eye worm) hypothetical protein 0.0152 0.0968 0.0968
Brugia malayi hypothetical protein 0.0152 0.0968 0.0968
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0152 0.0968 0.0968
Brugia malayi GnHR receptor homolog 0.0152 0.0968 0.0968
Brugia malayi Dopamine receptor 0.0152 0.0968 0.0968
Echinococcus granulosus 7tm_1 domain containing protein 0.0152 0.0968 0.0968
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0152 0.0968 0.0968
Echinococcus granulosus g protein linked acetylcholine receptor gar 2a 0.0152 0.0968 0.0968
Onchocerca volvulus 0.0152 0.0968 0.5
Schistosoma mansoni myosin xvIII 0.0152 0.0968 0.0968
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0152 0.0968 0.0968
Echinococcus granulosus neuropeptide Y receptor 0.0152 0.0968 0.0968
Schistosoma mansoni thyrotropin-releasing hormone receptor 0.0152 0.0968 0.0968
Echinococcus multilocularis serotonin receptor 0.0152 0.0968 0.0968
Echinococcus granulosus G protein coupled receptor 139 0.0152 0.0968 0.0968
Echinococcus multilocularis g protein coupled receptor 0.0152 0.0968 0.0968
Loa Loa (eye worm) hypothetical protein 0.0152 0.0968 0.0968
Schistosoma mansoni hypothetical protein 0.0152 0.0968 0.0968
Echinococcus granulosus orexin receptor type 2 0.0152 0.0968 0.0968
Echinococcus granulosus glutamate receptor ionotropic kainate 3 0.0113 0.0607 0.0607
Echinococcus multilocularis g protein coupled receptor 0.0152 0.0968 0.0968
Treponema pallidum amino acid ABC transporter, periplasmic binding protein 0.0063 0.0148 0.5
Echinococcus granulosus alpha 1A adrenergic receptor 0.0152 0.0968 0.0968
Echinococcus multilocularis rhodopsin orphan GPCR 0.0152 0.0968 0.0968
Echinococcus granulosus glutamate receptor ionotrophic AMPA 3 0.0292 0.2255 0.2255
Echinococcus multilocularis rhodopsin orphan GPCR 0.0152 0.0968 0.0968
Loa Loa (eye worm) 5-hydroxytryptamine 2C receptor 0.0152 0.0968 0.0968
Echinococcus multilocularis neuropeptides capa receptor 0.0152 0.0968 0.0968
Brugia malayi hypothetical protein 0.0152 0.0968 0.0968
Echinococcus multilocularis arachidonate 5 lipoxygenase 0.0114 0.0618 0.0618
Loa Loa (eye worm) hypothetical protein 0.0152 0.0968 0.0968
Onchocerca volvulus 0.0152 0.0968 0.5
Loa Loa (eye worm) glutamate receptor 1 0.0263 0.1986 0.1986
Loa Loa (eye worm) hypothetical protein 0.0152 0.0968 0.0968
Loa Loa (eye worm) hypothetical protein 0.0152 0.0968 0.0968
Echinococcus multilocularis serotonin receptor 0.0152 0.0968 0.0968
Echinococcus granulosus tm gpcr rhodopsin 0.0152 0.0968 0.0968
Brugia malayi Glutamate receptor 2 precursor 0.0263 0.1986 0.1986
Schistosoma mansoni glutamate receptor NMDA 0.0446 0.3663 0.3663
Loa Loa (eye worm) hypothetical protein 0.0152 0.0968 0.0968
Echinococcus granulosus neuropeptide receptor 0.0152 0.0968 0.0968
Schistosoma mansoni ancient conserved domain protein 2 (cyclin m2) 0.0152 0.0968 0.0968
Onchocerca volvulus Neuropeptide F receptor homolog 0.0152 0.0968 0.5
Onchocerca volvulus 0.0152 0.0968 0.5
Echinococcus granulosus biogenic amine 5HT receptor 0.0152 0.0968 0.0968
Loa Loa (eye worm) hypothetical protein 0.0152 0.0968 0.0968
Echinococcus granulosus arachidonate 5 lipoxygenase 0.0114 0.0618 0.0618
Echinococcus granulosus tm gpcr rhodopsin 0.0152 0.0968 0.0968
Chlamydia trachomatis glutamine binding protein 0.0063 0.0148 0.5
Echinococcus multilocularis sex peptide receptor 0.0152 0.0968 0.0968
Treponema pallidum amino acid ABC transporter, periplasmic binding protein (hisJ) 0.0063 0.0148 0.5
Schistosoma mansoni neuropeptide receptor 0.0152 0.0968 0.0968
Echinococcus multilocularis G protein coupled receptor 139 0.0152 0.0968 0.0968
Echinococcus granulosus neuropeptide s receptor 0.0152 0.0968 0.0968
Echinococcus granulosus neuropeptide receptor 0.0152 0.0968 0.0968
Brugia malayi hypothetical protein 0.0152 0.0968 0.0968
Loa Loa (eye worm) hypothetical protein 0.0152 0.0968 0.0968
Loa Loa (eye worm) hypothetical protein 0.0178 0.1202 0.1202
Echinococcus granulosus rhodopsin orphan GPCR 0.0152 0.0968 0.0968
Echinococcus multilocularis nmda type glutamate receptor 0.0116 0.0639 0.0639

Activities

Activity type Activity value Assay description Source Reference
K (binding) = 14.4 M Binding constant for ET-1 induced isolated rat aortal strip contraction ChEMBL. 8201588
K (binding) = 14.4 M Binding constant for ET-1 induced isolated rat aortal strip contraction ChEMBL. 8201588
Ki (binding) = 43 nM Inhibition of [125I]-ET-1 binding to cloned human ET-A receptor ChEMBL. 8201588
Ki (binding) = 43 nM Inhibition of [125I]-ET-1 binding to cloned human ET-A receptor ChEMBL. 8201588
Ki (binding) = 757 nM Inhibition of [125I]-ET-1 binding to cloned human ET-B receptor ChEMBL. 8201588
Ki (binding) = 757 nM Inhibition of [125I]-ET-1 binding to cloned human ET-B receptor ChEMBL. 8201588

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.

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