Detailed information for compound 1446419

Basic information

Technical information
  • TDR Targets ID: 1446419
  • Name: 1-(3-hydroxypropyl)-4,6-di(phenyl)pyridin-2-o ne
  • MW: 305.37 | Formula: C20H19NO2
  • H donors: 1 H acceptors: 2 LogP: 2.87 Rotable bonds: 5
    Rule of 5 violations (Lipinski): 1
  • SMILES: OCCCn1c(=O)cc(cc1c1ccccc1)c1ccccc1
  • InChi: 1S/C20H19NO2/c22-13-7-12-21-19(17-10-5-2-6-11-17)14-18(15-20(21)23)16-8-3-1-4-9-16/h1-6,8-11,14-15,22H,7,12-13H2
  • InChiKey: JASDXZHJPOLLDG-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • 1-(3-hydroxypropyl)-4,6-di(phenyl)-2-pyridinone
  • 1-(3-hydroxypropyl)-4,6-di(phenyl)-2-pyridone

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens nuclear factor, erythroid 2-like 2 Starlite/ChEMBL No references
Homo sapiens geminin, DNA replication inhibitor Starlite/ChEMBL No references
Homo sapiens glucagon-like peptide 1 receptor Starlite/ChEMBL No references
Homo sapiens SMAD family member 2 Starlite/ChEMBL No references

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Brugia malayi MH2 domain containing protein Get druggable targets OG5_131716 All targets in OG5_131716
Loa Loa (eye worm) MH2 domain-containing protein Get druggable targets OG5_131716 All targets in OG5_131716
Loa Loa (eye worm) transcription factor SMAD2 Get druggable targets OG5_131716 All targets in OG5_131716
By sequence similarity to non orthologous known druggable targets
Species Potential target Known druggable target Length Alignment span Identity
Brugia malayi Hypothetical 65.5 kDa Trp-Asp repeats containing protein F02E8.5 inchromosome X geminin, DNA replication inhibitor 209 aa 176 aa 27.8 %
Brugia malayi MH2 domain containing protein SMAD family member 2 467 aa 405 aa 31.6 %
Loa Loa (eye worm) pigment dispersing factor receptor c glucagon-like peptide 1 receptor 463 aa 388 aa 25.8 %
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Loa Loa (eye worm) hypothetical protein 0.0927 0.5786 0.5786
Trypanosoma cruzi mitochondrial DNA polymerase beta, putative 0.0294 0.1752 1
Brugia malayi hypothetical protein 0.0025 0.0038 0.0066
Schistosoma mansoni peptide (FMRFamide/somatostatin)-like receptor 0.0029 0.0062 0.0106
Loa Loa (eye worm) pigment dispersing factor receptor c 0.006 0.0262 0.0262
Loa Loa (eye worm) hypothetical protein 0.0039 0.0126 0.0126
Schistosoma mansoni chromobox protein 0.0069 0.0319 0.0548
Echinococcus granulosus dro:myosuppressin receptor 0.0029 0.0062 0.0106
Brugia malayi hypothetical protein 0.0029 0.0062 0.0107
Loa Loa (eye worm) gonadotropin-releasing hormone receptor 2 0.0029 0.0062 0.0062
Loa Loa (eye worm) hypothetical protein 0.0029 0.0062 0.0062
Loa Loa (eye worm) hypothetical protein 0.0029 0.0062 0.0062
Echinococcus multilocularis serotonin receptor 0.0399 0.2419 0.4154
Trypanosoma brucei Aminopeptidase M1, putative 0.005 0.0194 0.0912
Loa Loa (eye worm) hypothetical protein 0.0042 0.0148 0.0148
Echinococcus granulosus somatostatin receptor 0.0029 0.0062 0.0106
Trypanosoma cruzi DNA polymerase beta thumb, putative 0.0041 0.0142 0.0607
Echinococcus multilocularis neuropeptides capa receptor 0.0029 0.0062 0.0106
Schistosoma mansoni peptide (FMRFamide/neurokinin-3)-like receptor 0.0029 0.0062 0.0106
Schistosoma mansoni hypothetical protein 0.0029 0.0062 0.0106
Brugia malayi Peptidase family M1 containing protein 0.005 0.0194 0.0336
Loa Loa (eye worm) hypothetical protein 0.0029 0.0062 0.0062
Loa Loa (eye worm) hypothetical protein 0.0029 0.0062 0.0062
Schistosoma mansoni acetyl-CoA C-acetyltransferase 0.0022 0.0021 0.0036
Loa Loa (eye worm) hypothetical protein 0.0029 0.0062 0.0062
Echinococcus granulosus fmrfamide receptor 0.0029 0.0062 0.0106
Schistosoma mansoni hypothetical protein 0.0205 0.1183 0.2031
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0029 0.0062 0.0106
Echinococcus multilocularis allatostatin A receptor 0.0029 0.0062 0.0106
Echinococcus granulosus chromobox protein 1 0.0069 0.0319 0.0548
Onchocerca volvulus 0.005 0.0194 0.3384
Schistosoma mansoni neuropeptide F-like receptor 0.0029 0.0062 0.0106
Brugia malayi RE15519p 0.0029 0.0062 0.0107
Brugia malayi Dopamine receptor 0.0029 0.0062 0.0107
Trichomonas vaginalis chromobox protein, putative 0.0069 0.0319 1
Echinococcus multilocularis g protein coupled receptor 0.0029 0.0062 0.0106
Loa Loa (eye worm) hypothetical protein 0.0029 0.0062 0.0062
Echinococcus multilocularis bromodomain adjacent to zinc finger domain 0.0036 0.0106 0.0182
Plasmodium falciparum M1-family alanyl aminopeptidase, putative 0.005 0.0194 1
Brugia malayi G protein-coupled receptor F59B2.13 0.0029 0.0062 0.0107
Loa Loa (eye worm) hypothetical protein 0.0029 0.0062 0.0062
Loa Loa (eye worm) hypothetical protein 0.0029 0.0062 0.0062
Echinococcus multilocularis atpase aaa+ type core atpase aaa type core 0.0805 0.5007 0.8599
Schistosoma mansoni aminopeptidase PILS (M01 family) 0.005 0.0194 0.0334
Loa Loa (eye worm) hypothetical protein 0.0025 0.0038 0.0038
Toxoplasma gondii aminopeptidase N, putative 0.005 0.0194 1
Echinococcus multilocularis rhodopsin orphan GPCR 0.0029 0.0062 0.0106
Echinococcus multilocularis rhodopsin orphan GPCR 0.0029 0.0062 0.0106
Trypanosoma brucei Aminopeptidase M1, putative 0.005 0.0194 0.0912
Entamoeba histolytica aminopeptidase, putative 0.005 0.0194 1
Echinococcus granulosus rhodopsin orphan GPCR 0.0029 0.0062 0.0106
Trichomonas vaginalis chromobox protein, putative 0.0069 0.0319 1
Trypanosoma cruzi puromycin-sensitive aminopeptidase-like protein, putative 0.005 0.0194 0.0912
Brugia malayi putative neuropeptide receptor 0.0029 0.0062 0.0107
Echinococcus multilocularis leukotriene A 4 hydrolase 0.0933 0.5823 1
Echinococcus multilocularis rhodopsin orphan GPCR 0.0029 0.0062 0.0106
Schistosoma mansoni neuropeptide receptor 0.0029 0.0062 0.0106
Echinococcus granulosus neuropeptide receptor A26 0.0029 0.0062 0.0106
Trypanosoma cruzi metallo-peptidase, clan MA(E), family M1, putative 0.005 0.0194 0.0912
Echinococcus multilocularis tachykinin peptides receptor 99D 0.0029 0.0062 0.0106
Echinococcus granulosus tachykinin peptides receptor 99D 0.0029 0.0062 0.0106
Brugia malayi Heterochromatin protein 1 0.0069 0.0319 0.0552
Schistosoma mansoni biogenic amine (dopamine) receptor 0.0029 0.0062 0.0106
Echinococcus granulosus thyrotropin releasing hormone receptor 0.0029 0.0062 0.0106
Schistosoma mansoni amine GPCR 0.0029 0.0062 0.0106
Brugia malayi MH2 domain containing protein 0.0144 0.0797 0.1378
Echinococcus granulosus fetal alzheimer antigen falz 0.0022 0.0021 0.0036
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0045 0.0168 0.029
Echinococcus multilocularis G protein coupled receptor 139 0.0029 0.0062 0.0106
Echinococcus granulosus G protein coupled receptor 139 0.0029 0.0062 0.0106
Trypanosoma cruzi DNA polymerase beta thumb, putative 0.0041 0.0142 0.0607
Plasmodium vivax M1-family alanyl aminopeptidase, putative 0.005 0.0194 1
Loa Loa (eye worm) follicle stimulating hormone receptor 0.0029 0.0062 0.0062
Loa Loa (eye worm) aminopeptidase N 0.005 0.0194 0.0194
Schistosoma mansoni histamine h1 receptor 0.0029 0.0062 0.0106
Loa Loa (eye worm) hypothetical protein 0.0029 0.0062 0.0062
Echinococcus granulosus alpha 1A adrenergic receptor 0.0029 0.0062 0.0106
Echinococcus granulosus neuropeptide s receptor 0.0029 0.0062 0.0106
Brugia malayi hypothetical protein 0.0029 0.0062 0.0107
Brugia malayi hypothetical protein 0.0029 0.0062 0.0107
Onchocerca volvulus 0.005 0.0194 0.3384
Echinococcus granulosus tm gpcr rhodopsin 0.0029 0.0062 0.0106
Brugia malayi hypothetical protein 0.0029 0.0062 0.0107
Trypanosoma cruzi mitochondrial DNA polymerase beta-PAK, putative 0.0139 0.0765 0.4243
Onchocerca volvulus Phospholipase A2 homolog 0.009 0.0454 1
Echinococcus multilocularis tm gpcr rhodopsin gpcr rhodopsin superfamily 0.0029 0.0062 0.0106
Schistosoma mansoni hypothetical protein 0.0041 0.0141 0.0242
Echinococcus granulosus neuropeptide receptor 0.0029 0.0062 0.0106
Echinococcus multilocularis g protein coupled receptor 0.0029 0.0062 0.0106
Loa Loa (eye worm) hypothetical protein 0.0029 0.0062 0.0062
Onchocerca volvulus Heterochromatin protein 1 homolog 0.0039 0.0126 0.1627
Trypanosoma cruzi Aminopeptidase M1, putative 0.005 0.0194 0.0912
Leishmania major puromycin-sensitive aminopeptidase-like protein,metallo-peptidase, Clan MA(E), Family M1 0.005 0.0194 0.0912
Loa Loa (eye worm) hypothetical protein 0.0029 0.0062 0.0062
Loa Loa (eye worm) hypothetical protein 0.0029 0.0062 0.0062
Schistosoma mansoni aminopeptidase A (M01 family) 0.005 0.0194 0.0334
Echinococcus multilocularis rhodopsin orphan GPCR 0.0029 0.0062 0.0106
Echinococcus multilocularis microtubule associated protein 2 0.0726 0.4505 0.7736
Mycobacterium tuberculosis Conserved hypothetical protein 0.0155 0.0865 0.5
Onchocerca volvulus 0.003 0.0072 0.0264
Echinococcus multilocularis neuropeptide receptor 0.0029 0.0062 0.0106
Trypanosoma brucei mitochondrial DNA polymerase beta 0.0294 0.1752 1
Echinococcus granulosus zinc finger protein 0.0019 0.0002 0.0004
Brugia malayi Melatonin receptor type 1A 0.0029 0.0062 0.0107
Loa Loa (eye worm) hypothetical protein 0.0041 0.0141 0.0141
Echinococcus multilocularis rhodopsin orphan GPCR 0.0029 0.0062 0.0106
Schistosoma mansoni Tata binding protein associated factor (M01 family) 0.005 0.0194 0.0334
Schistosoma mansoni biogenic amine (octopamine/dopamine) receptor 0.0927 0.5786 0.9937
Brugia malayi Dopamine receptor protein 2 0.0029 0.0062 0.0107
Loa Loa (eye worm) heterochromatin protein 1 0.0069 0.0319 0.0319
Echinococcus granulosus sex peptide receptor 0.0029 0.0062 0.0106
Echinococcus granulosus biogenic amine 5HT receptor 0.0399 0.2419 0.4154
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0029 0.0062 0.0106
Schistosoma mansoni hypothetical protein 0.002 0.0009 0.0016
Loa Loa (eye worm) unidentified vitellogenin-linked transcript protein 6 0.0029 0.0062 0.0062
Echinococcus granulosus neuropeptide Y receptor 0.0029 0.0062 0.0106
Echinococcus multilocularis puromycin sensitive aminopeptidase 0.005 0.0194 0.0334
Loa Loa (eye worm) hypothetical protein 0.005 0.0194 0.0194
Trypanosoma brucei metallo-peptidase, Clan MA(E) Family M1 0.005 0.0194 0.0912
Schistosoma mansoni hypothetical protein 0.0029 0.0062 0.0106
Echinococcus multilocularis rhodopsin orphan GPCR 0.0029 0.0062 0.0106
Echinococcus multilocularis tm gpcr rhodopsin gpcr rhodopsin superfamily 0.0029 0.0062 0.0106
Trichomonas vaginalis conserved hypothetical protein 0.0039 0.0126 0.2714
Echinococcus granulosus peptide allatostatin:somatostatin 0.0029 0.0062 0.0106
Echinococcus granulosus puromycin sensitive aminopeptidase 0.005 0.0194 0.0334
Loa Loa (eye worm) hypothetical protein 0.0029 0.0062 0.0062
Echinococcus granulosus rhodopsin orphan GPCR 0.0029 0.0062 0.0106
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0045 0.0168 0.0288
Leishmania major mitochondrial DNA polymerase beta-PAK, putative 0.0139 0.0765 0.4243
Brugia malayi Phospholipase A2 family protein 0.009 0.0454 0.0784
Brugia malayi Dopamine receptor protein 1, putative (partial) 0.0029 0.0062 0.0107
Brugia malayi Peptidase family M1 containing protein 0.005 0.0194 0.0336
Echinococcus multilocularis G-protein coupled receptor, putative 0.0029 0.0062 0.0106
Mycobacterium ulcerans hypothetical protein 0.0155 0.0865 1
Schistosoma mansoni adenoreceptor 0.0029 0.0062 0.0106
Schistosoma mansoni opsin-like receptor 0.0029 0.0062 0.0106
Toxoplasma gondii hypothetical protein 0.0047 0.0181 0.9126
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0045 0.0168 0.0288
Echinococcus granulosus g protein linked acetylcholine receptor gar 2a 0.0029 0.0062 0.0106
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0045 0.0168 0.0288
Plasmodium vivax M1-family alanyl aminopeptidase, putative 0.005 0.0194 1
Echinococcus granulosus puromycin sensitive aminopeptidase 0.005 0.0194 0.0334
Toxoplasma gondii aminopeptidase N protein 0.005 0.0194 1
Schistosoma mansoni neuropeptide F-like receptor 0.0029 0.0062 0.0106
Echinococcus granulosus orexin receptor type 2 0.0029 0.0062 0.0106
Loa Loa (eye worm) hypothetical protein 0.0029 0.0062 0.0062
Brugia malayi sulfakinin receptor protein 0.0029 0.0062 0.0107
Loa Loa (eye worm) hypothetical protein 0.0029 0.0062 0.0062
Schistosoma mansoni zinc finger protein 0.0019 0.0002 0.0004
Brugia malayi hypothetical protein 0.0029 0.0062 0.0107
Loa Loa (eye worm) G-protein coupled receptor 0.0029 0.0062 0.0062
Echinococcus granulosus tm gpcr rhodopsin 0.0029 0.0062 0.0106
Schistosoma mansoni cytosol alanyl aminopeptidase (M01 family) 0.005 0.0194 0.0334
Loa Loa (eye worm) neuropeptide F receptor 0.0029 0.0062 0.0062
Brugia malayi gonadotropin-releasing hormone receptor 2 0.0029 0.0062 0.0107
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0045 0.0168 0.0288
Echinococcus granulosus leukotriene A 4 hydrolase 0.0933 0.5823 1
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0029 0.0062 0.0106
Trypanosoma cruzi mitochondrial DNA polymerase beta-PAK, putative 0.005 0.02 0.0943
Brugia malayi larval opioid receptor 0.0029 0.0062 0.0107
Brugia malayi Dopamine receptor protein 1 0.0029 0.0062 0.0107
Brugia malayi PHD-finger family protein 0.0025 0.0036 0.0062
Echinococcus multilocularis geminin 0.0205 0.1183 0.2031
Brugia malayi neuropeptide F receptor 0.0029 0.0062 0.0107
Schistosoma mansoni amine GPCR 0.0029 0.0062 0.0106
Brugia malayi hypothetical protein 0.0029 0.0062 0.0107
Brugia malayi ORL1-like opioid receptor 0.0029 0.0062 0.0107
Loa Loa (eye worm) hypothetical protein 0.0029 0.0062 0.0062
Trypanosoma brucei mitochondrial DNA polymerase beta-PAK 0.0139 0.0765 0.4243
Brugia malayi hypothetical protein 0.005 0.0194 0.0336
Schistosoma mansoni biogenic amine (5HT) receptor 0.0029 0.0062 0.0106
Loa Loa (eye worm) G-protein-linked acetylcholine receptor protein 2 0.0029 0.0062 0.0062
Loa Loa (eye worm) hypothetical protein 0.005 0.0194 0.0194
Echinococcus multilocularis biogenic amine (5HT) receptor 0.0029 0.0062 0.0106
Echinococcus granulosus puromycin sensitive aminopeptidase 0.005 0.0194 0.0334
Echinococcus granulosus neuropeptides capa receptor 0.0029 0.0062 0.0106
Echinococcus granulosus rhodopsin orphan GPCR 0.0029 0.0062 0.0106
Echinococcus granulosus puromycin sensitive aminopeptidase 0.005 0.0194 0.0334
Echinococcus multilocularis fetal alzheimer antigen, falz 0.0022 0.0021 0.0036
Schistosoma mansoni transcription factor LCR-F1 0.0043 0.0156 0.0267
Echinococcus granulosus serotonin receptor 0.0029 0.0062 0.0106
Loa Loa (eye worm) PHD-finger family protein 0.002 0.0009 0.0009
Brugia malayi GnHR receptor homolog 0.0029 0.0062 0.0107
Leishmania major mitochondrial DNA polymerase beta 0.0294 0.1752 1
Loa Loa (eye worm) peptidase family M1 containing protein 0.005 0.0194 0.0194
Echinococcus multilocularis puromycin sensitive aminopeptidase 0.005 0.0194 0.0334
Loa Loa (eye worm) MH2 domain-containing protein 0.0144 0.0797 0.0797
Schistosoma mansoni hypothetical protein 0.0043 0.0156 0.0267
Loa Loa (eye worm) hypothetical protein 0.0029 0.0062 0.0062
Echinococcus granulosus pyroglutamylated rfamide peptide receptor 0.0029 0.0062 0.0106
Echinococcus multilocularis neuropeptides capa receptor 0.0029 0.0062 0.0106
Echinococcus multilocularis neuropeptide s receptor 0.0029 0.0062 0.0106
Onchocerca volvulus Heterochromatin protein 1 homolog 0.0042 0.0144 0.2106
Echinococcus multilocularis alpha 1A adrenergic receptor 0.0029 0.0062 0.0106
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0029 0.0062 0.0106
Brugia malayi G protein-coupled receptor 0.0029 0.0062 0.0107
Brugia malayi TATA binding protein associated factor 0.005 0.0194 0.0336
Schistosoma mansoni hypothetical protein 0.0029 0.0062 0.0106
Schistosoma mansoni neuropeptide f receptor 76f 0.0029 0.0062 0.0106
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0043 0.0156 0.0267
Loa Loa (eye worm) hypothetical protein 0.0399 0.2419 0.2419
Schistosoma mansoni histamine-responsive GPCR (AAF21638) 0.0029 0.0062 0.0106
Brugia malayi follicle stimulating hormone receptor 0.0029 0.0062 0.0107
Loa Loa (eye worm) leukotriene A4 hydrolase 0.0933 0.5823 0.5823
Echinococcus multilocularis g protein linked acetylcholine receptor gar 2a 0.0029 0.0062 0.0106
Plasmodium falciparum M1-family alanyl aminopeptidase 0.005 0.0194 1
Brugia malayi hypothetical protein 0.0029 0.0062 0.0107
Echinococcus multilocularis neuropeptide receptor 0.0029 0.0062 0.0106
Schistosoma mansoni opsin-like receptor 0.0029 0.0062 0.0106
Echinococcus granulosus neuropeptide FF receptor 2 0.0029 0.0062 0.0106
Echinococcus granulosus rhodopsin orphan GPCR 0.0029 0.0062 0.0106
Echinococcus granulosus growth hormone secretagogue receptor type 1 0.0029 0.0062 0.0106
Leishmania major aminopeptidase-like protein,metallo-peptidase, Clan MA(E), Family M1 0.005 0.0194 0.0912
Loa Loa (eye worm) hypothetical protein 0.0029 0.0062 0.0062
Brugia malayi Unidentified vitellogenin-linked transcript protein 6, putative 0.0029 0.0062 0.0107
Echinococcus multilocularis bromodomain adjacent to zinc finger domain 0.0059 0.0256 0.044
Schistosoma mansoni leukotriene A4 hydrolase (M01 family) 0.0933 0.5823 1
Echinococcus granulosus allatostatin A receptor 0.0029 0.0062 0.0106
Echinococcus granulosus aminopeptidase N 0.005 0.0194 0.0334
Echinococcus multilocularis chromobox protein 1 0.0069 0.0319 0.0548
Loa Loa (eye worm) hypothetical protein 0.0029 0.0062 0.0062
Brugia malayi latrophilin 2 splice variant baaae 0.0041 0.0141 0.0243
Loa Loa (eye worm) G-protein coupled receptor 0.0029 0.0062 0.0062
Schistosoma mansoni amine GPCR 0.0029 0.0062 0.0106
Echinococcus granulosus puromycin sensitive aminopeptidase 0.005 0.0194 0.0334
Loa Loa (eye worm) hypothetical protein 0.0029 0.0062 0.0062
Echinococcus multilocularis growth hormone secretagogue receptor type 1 0.0029 0.0062 0.0106
Echinococcus granulosus g protein coupled receptor 0.0029 0.0062 0.0106
Schistosoma mansoni biogenic amine (5HT) receptor 0.0399 0.2419 0.4154
Echinococcus multilocularis neuropeptide Y receptor 0.0029 0.0062 0.0106
Loa Loa (eye worm) hypothetical protein 0.0029 0.0062 0.0062
Schistosoma mansoni hypothetical protein 0.0205 0.1183 0.2031
Echinococcus multilocularis zinc finger protein 0.0019 0.0002 0.0004
Schistosoma mansoni neuropeptide receptor 0.0029 0.0062 0.0106
Loa Loa (eye worm) 5-hydroxytryptamine 2C receptor 0.0029 0.0062 0.0062
Echinococcus multilocularis g-protein coupled receptor 0.0029 0.0062 0.0106
Schistosoma mansoni peptide (FMRFamide/somatostatin)-like receptor 0.0029 0.0062 0.0106
Loa Loa (eye worm) hypothetical protein 0.0029 0.0062 0.0062
Brugia malayi G-protein coupled receptor 0.0029 0.0062 0.0107
Schistosoma mansoni biogenic amine receptor 0.0029 0.0062 0.0106
Echinococcus multilocularis rhodopsin orphan GPCR 0.0029 0.0062 0.0106
Loa Loa (eye worm) hypothetical protein 0.0038 0.0121 0.0121
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0043 0.0156 0.0267
Loa Loa (eye worm) hypothetical protein 0.0029 0.0062 0.0062
Brugia malayi hypothetical protein 0.0429 0.2612 0.4513
Echinococcus granulosus G protein coupled 5 hydroxytryptamine receptor 0.0029 0.0062 0.0106
Echinococcus multilocularis aminopeptidase N 0.005 0.0194 0.0334
Trypanosoma cruzi mitochondrial DNA polymerase beta, putative 0.0294 0.1752 1
Echinococcus multilocularis puromycin sensitive aminopeptidase 0.005 0.0194 0.0334
Schistosoma mansoni thyrotropin-releasing hormone receptor 0.0029 0.0062 0.0106
Schistosoma mansoni muscarinic acetylcholine (GAR) receptor 0.0029 0.0062 0.0106
Onchocerca volvulus Phospholipase A2 homolog 0.009 0.0454 1
Schistosoma mansoni neuropeptide receptor 0.0029 0.0062 0.0106
Toxoplasma gondii aminopeptidase n, putative 0.005 0.0194 1
Echinococcus multilocularis somatostatin receptor 0.0029 0.0062 0.0106
Schistosoma mansoni biogenic amine (dopamine) receptor 0.0029 0.0062 0.0106
Brugia malayi G-protein-linked acetylcholine receptor protein 2, putative 0.0029 0.0062 0.0107
Echinococcus granulosus puromycin sensitive aminopeptidase 0.005 0.0194 0.0334
Trypanosoma brucei aminopeptidase, putative 0.005 0.0194 0.0912
Schistosoma mansoni amine GPCR 0.0029 0.0062 0.0106
Echinococcus granulosus hypothetical protein 0.0029 0.0062 0.0106
Brugia malayi hypothetical protein 0.0029 0.0062 0.0107
Schistosoma mansoni chromobox protein 0.0069 0.0319 0.0548
Loa Loa (eye worm) hypothetical protein 0.005 0.0194 0.0194
Echinococcus granulosus chromobox protein 1 0.0069 0.0319 0.0548
Schistosoma mansoni microtubule-associated protein tau 0.0726 0.4505 0.7736
Loa Loa (eye worm) hypothetical protein 0.0029 0.0062 0.0062
Echinococcus granulosus g protein coupled receptor 0.0029 0.0062 0.0106
Loa Loa (eye worm) hypothetical protein 0.0029 0.0062 0.0062
Schistosoma mansoni peptide (allatostatin)-like receptor 0.0029 0.0062 0.0106
Loa Loa (eye worm) hypothetical protein 0.0029 0.0062 0.0062
Brugia malayi Serotonin/octopamine receptor family protein 7 0.0927 0.5786 1
Echinococcus multilocularis puromycin sensitive aminopeptidase 0.005 0.0194 0.0334
Schistosoma mansoni hypothetical protein 0.0029 0.0062 0.0106
Brugia malayi Bromodomain containing protein 0.0038 0.0121 0.0209
Brugia malayi chromobox protein homolog 3 0.0039 0.0126 0.0217
Echinococcus granulosus g protein coupled receptor 0.0029 0.0062 0.0106
Brugia malayi AKH receptor 0.0029 0.0062 0.0107
Trypanosoma brucei DNA polymerase beta thumb, putative 0.0041 0.0142 0.0607
Loa Loa (eye worm) hypothetical protein 0.0029 0.0062 0.0062
Schistosoma mansoni opsin-like receptor 0.0029 0.0062 0.0106
Schistosoma mansoni myosin xvIII 0.0029 0.0062 0.0106
Trichomonas vaginalis chromobox protein, putative 0.0042 0.0144 0.3419
Echinococcus multilocularis pyroglutamylated rfamide peptide receptor 0.0029 0.0062 0.0106
Leishmania major aminopeptidase, putative,metallo-peptidase, Clan MA(E), Family M1 0.005 0.0194 0.0912
Schistosoma mansoni neuropeptide receptor 0.0029 0.0062 0.0106
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0045 0.0168 0.0288
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0029 0.0062 0.0106
Trypanosoma cruzi aminopeptidase, putative 0.005 0.0194 0.0912
Echinococcus multilocularis 7TM GPCR, rhodopsin 0.0029 0.0062 0.0106
Echinococcus granulosus neuropeptide receptor 0.0029 0.0062 0.0106
Loa Loa (eye worm) melatonin receptor type 1A 0.0029 0.0062 0.0062
Trypanosoma cruzi puromycin-sensitive aminopeptidase-like protein, putative 0.005 0.0194 0.0912
Brugia malayi hypothetical protein 0.005 0.0194 0.0336
Echinococcus multilocularis fmrfamide receptor 0.0029 0.0062 0.0106
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0045 0.0168 0.0288
Echinococcus granulosus biogenic amine 5HT receptor 0.0029 0.0062 0.0106
Loa Loa (eye worm) TATA binding protein associated factor 0.005 0.0194 0.0194
Schistosoma mansoni bromodomain containing protein 0.0063 0.0279 0.0479
Loa Loa (eye worm) hypothetical protein 0.0029 0.0062 0.0062
Loa Loa (eye worm) hypothetical protein 0.006 0.0262 0.0262
Schistosoma mansoni biogenic amine receptor 0.0029 0.0062 0.0106
Echinococcus multilocularis sex peptide receptor 0.0029 0.0062 0.0106
Trypanosoma cruzi metallo-peptidase, clan MA(E), family M1, putative 0.005 0.0194 0.0912
Brugia malayi putative neuropeptide receptor NPR1 0.0029 0.0062 0.0107
Echinococcus granulosus geminin 0.0205 0.1183 0.2031
Loa Loa (eye worm) TYRA-2 protein 0.0029 0.0062 0.0062
Echinococcus multilocularis g protein linked acetylcholine receptor gar 2a 0.0029 0.0062 0.0106
Brugia malayi Serotonin receptor 0.0029 0.0062 0.0107
Onchocerca volvulus 0.005 0.0194 0.3384
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.006 0.0262 0.0453
Brugia malayi G-protein coupled receptor 0.0029 0.0062 0.0107
Loa Loa (eye worm) hypothetical protein 0.0029 0.0062 0.0062
Trichomonas vaginalis conserved hypothetical protein 0.0039 0.0126 0.2714
Schistosoma mansoni peptide (allatostatin/somatostatin)-like receptor 0.0029 0.0062 0.0106
Loa Loa (eye worm) hypothetical protein 0.0029 0.0062 0.0062
Echinococcus multilocularis thyrotropin releasing hormone receptor 0.0029 0.0062 0.0106
Echinococcus multilocularis g protein coupled receptor 0.0029 0.0062 0.0106
Brugia malayi hypothetical protein 0.0029 0.0062 0.0107
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0029 0.0062 0.0106
Loa Loa (eye worm) transcription factor SMAD2 0.0144 0.0797 0.0797
Loa Loa (eye worm) hypothetical protein 0.0029 0.0062 0.0062
Brugia malayi Serotonin receptor 0.0029 0.0062 0.0107
Loa Loa (eye worm) hypothetical protein 0.0029 0.0062 0.0062
Loa Loa (eye worm) hypothetical protein 0.0029 0.0062 0.0062
Schistosoma mansoni biogenic amine (dopamine) receptor 0.0029 0.0062 0.0106
Echinococcus multilocularis tm gpcr rhodopsin gpcr rhodopsin superfamily 0.0029 0.0062 0.0106
Schistosoma mansoni ancient conserved domain protein 2 (cyclin m2) 0.0029 0.0062 0.0106
Loa Loa (eye worm) hypothetical protein 0.007 0.0326 0.0326
Loa Loa (eye worm) hypothetical protein 0.0029 0.0062 0.0062
Echinococcus granulosus microtubule associated protein 2 0.0726 0.4505 0.7736
Brugia malayi neuropeptide F receptor 0.0029 0.0062 0.0107
Loa Loa (eye worm) hypothetical protein 0.0399 0.2419 0.2419
Loa Loa (eye worm) hypothetical protein 0.0927 0.5786 0.5786
Brugia malayi Tachykinin-like peptides receptor 99D 0.0029 0.0062 0.0107
Trypanosoma cruzi mitochondrial DNA polymerase beta-PAK, putative 0.0041 0.0142 0.0607
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0045 0.0168 0.0168
Echinococcus multilocularis peptide (allatostatin:somatostatin) 0.0029 0.0062 0.0106
Echinococcus granulosus bromodomain adjacent to zinc finger domain 0.0059 0.0256 0.044
Echinococcus granulosus 7TM GPCR rhodopsin 0.0029 0.0062 0.0106
Echinococcus granulosus rhodopsin orphan GPCR 0.0029 0.0062 0.0106
Echinococcus multilocularis fmrfamide receptor 0.0029 0.0062 0.0106
Echinococcus multilocularis serotonin receptor 0.0399 0.2419 0.4154
Brugia malayi Bromodomain containing protein 0.0074 0.0353 0.061
Echinococcus multilocularis neuropeptide Y receptor 0.0029 0.0062 0.0106
Schistosoma mansoni biogenic amine receptor 0.0029 0.0062 0.0106
Echinococcus granulosus bromodomain adjacent to zinc finger domain 0.0036 0.0106 0.0182
Trichomonas vaginalis Clan MA, family M1, aminopeptidase N-like metallopeptidase 0.005 0.0194 0.5302
Schistosoma mansoni growth hormone secretagogue receptor 0.0029 0.0062 0.0106
Brugia malayi Calcitonin receptor-like protein seb-1 0.006 0.0262 0.0453
Trypanosoma cruzi aminopeptidase, putative 0.005 0.0194 0.0912
Echinococcus multilocularis G protein coupled 5 hydroxytryptamine receptor 0.0029 0.0062 0.0106
Leishmania major aminopeptidase, putative,metallo-peptidase, Clan MA(E), Family M1 0.005 0.0194 0.0912
Echinococcus granulosus tm gpcr rhodopsin 0.0029 0.0062 0.0106
Loa Loa (eye worm) hypothetical protein 0.0029 0.0062 0.0062
Trypanosoma cruzi metallo-peptidase, Clan MA(E) Family M1 0.005 0.0194 0.0912
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0029 0.0062 0.0106
Trichomonas vaginalis Clan MA, family M1, aminopeptidase N-like metallopeptidase 0.005 0.0194 0.5302
Echinococcus granulosus 7tm_1 domain containing protein 0.0029 0.0062 0.0106
Brugia malayi hypothetical protein 0.0029 0.0062 0.0107
Schistosoma mansoni amine GPCR 0.0029 0.0062 0.0106
Loa Loa (eye worm) neuropeptide F receptor 0.0029 0.0062 0.0062
Loa Loa (eye worm) hypothetical protein 0.004 0.0136 0.0136
Echinococcus multilocularis puromycin sensitive aminopeptidase 0.005 0.0194 0.0334
Echinococcus granulosus g-protein coupled receptor 0.0029 0.0062 0.0106
Echinococcus granulosus rhodopsin orphan GPCR 0.0029 0.0062 0.0106
Echinococcus multilocularis orexin receptor type 2 0.0029 0.0062 0.0106
Loa Loa (eye worm) hypothetical protein 0.0029 0.0062 0.0062
Loa Loa (eye worm) hypothetical protein 0.0029 0.0062 0.0062
Trichomonas vaginalis Clan MA, family M1, aminopeptidase N-like metallopeptidase 0.005 0.0194 0.5302
Echinococcus granulosus neuropeptide Y receptor 0.0029 0.0062 0.0106
Brugia malayi hypothetical protein 0.0043 0.0156 0.0269
Echinococcus multilocularis dro:myosuppressin receptor 0.0029 0.0062 0.0106
Trichomonas vaginalis chromobox protein, putative 0.0042 0.0144 0.3419
Echinococcus granulosus neuropeptides capa receptor 0.0029 0.0062 0.0106
Echinococcus multilocularis neuropeptide receptor A26 0.0029 0.0062 0.0106
Loa Loa (eye worm) hypothetical protein 0.0029 0.0062 0.0062
Loa Loa (eye worm) hypothetical protein 0.009 0.0454 0.0454
Loa Loa (eye worm) hypothetical protein 0.003 0.0072 0.0072
Schistosoma mansoni alpha-1 adrenergic receptor 0.0029 0.0062 0.0106
Echinococcus granulosus g protein linked acetylcholine receptor gar 2a 0.0029 0.0062 0.0106
Loa Loa (eye worm) hypothetical protein 0.0029 0.0062 0.0062
Echinococcus multilocularis Peptidase M1, membrane alanine aminopeptidase, N terminal 0.005 0.0194 0.0334
Echinococcus granulosus rhodopsin orphan GPCR 0.0029 0.0062 0.0106
Echinococcus multilocularis neuropeptide FF receptor 2 0.0029 0.0062 0.0106
Echinococcus multilocularis chromobox protein 1 0.0069 0.0319 0.0548
Brugia malayi Peptidase family M1 containing protein 0.005 0.0194 0.0336
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0029 0.0062 0.0106
Loa Loa (eye worm) hypothetical protein 0.0029 0.0062 0.0062
Echinococcus multilocularis rhodopsin orphan GPCR 0.0029 0.0062 0.0106
Loa Loa (eye worm) hypothetical protein 0.009 0.0454 0.0454
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0045 0.0168 0.0288
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0029 0.0062 0.0106

Activities

Activity type Activity value Assay description Source Reference
Potency (functional) 0.6513 uM PubChem BioAssay. A quantitative high throughput screen for small molecules that induce DNA re-replication in MCF 10a normal breast cells. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 2.0596 uM PUBCHEM_BIOASSAY: Nrf2 qHTS screen for inhibitors. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID493153, AID493163, AID504648] ChEMBL. No reference
Potency (functional) 5.0119 uM PubChem BioAssay. qHTS of GLP-1 Receptor Inverse Agonists (Inhibition Mode). (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 9.285 uM PUBCHEM_BIOASSAY: Primary qHTS for delayed death inhibitors of the malarial parasite plastid, 48 hour incubation. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488752, AID488774, AID504848, AID504850] ChEMBL. No reference
Potency (functional) 11.2202 uM PUBCHEM_BIOASSAY: qHTS for Inhibitors of TGF-b. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID588856, AID588860] ChEMBL. No reference
Potency (functional) 14.7157 uM PUBCHEM_BIOASSAY: Primary qHTS for delayed death inhibitors of the malarial parasite plastid, 96 hour incubation. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488745, AID488752, AID488774, AID504848, AID504850] ChEMBL. No reference
Potency (functional) = 25.1189 um PUBCHEM_BIOASSAY: qHTS Inhibitors of AmpC Beta-Lactamase (assay with detergent). (Class of assay: confirmatory) [Related pubchem assays: 1002 (Confirmation Concentration-Response Assay for Inhibitors of AmpC Beta-Lactamase (assay with detergent)), 585 (Promiscuous and Specific Inhibitors of AmpC Beta-Lactamase (assay without detergent) - a screen old NIH MLSMR collection), 584 (Promiscuous and Specific Inhibitors of AmpC Beta-Lactamase (assay with detergent) - a screen of the old NIH MLSMR collection), 1003 (Confirmation Cuvette-Based Assay for Inhibitors of AmpC Beta-Lactamase (assay with detergent))] ChEMBL. No reference
Potency (functional) 79.4328 uM PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of the Phosphatase Activity of Eya2. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488939] ChEMBL. No reference
Potency (functional) 89.1251 uM PubChem BioAssay. qHTS for Antagonist of cAMP-regulated guanine nucleotide exchange factor 2 (EPAC2): primary screen. (Class of assay: confirmatory) ChEMBL. No reference

Phenotypes

Whole-cell/tissue/organism interactions

Species name Source Reference Is orphan
Plasmodium falciparum ChEMBL23

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

No literature references available for this target.

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