Detailed information for compound 1384199

Basic information

Technical information
  • TDR Targets ID: 1384199
  • Name: methyl 4-(2,3-dichlorophenyl)sulfanylpyridine -2-carboxylate
  • MW: 314.187 | Formula: C13H9Cl2NO2S
  • H donors: 0 H acceptors: 2 LogP: 4.36 Rotable bonds: 4
    Rule of 5 violations (Lipinski): 1
  • SMILES: COC(=O)c1nccc(c1)Sc1cccc(c1Cl)Cl
  • InChi: 1S/C13H9Cl2NO2S/c1-18-13(17)10-7-8(5-6-16-10)19-11-4-2-3-9(14)12(11)15/h2-7H,1H3
  • InChiKey: QFVCVZNMGLAFNJ-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • 4-[(2,3-dichlorophenyl)thio]-2-pyridinecarboxylic acid methyl ester
  • 4-[(2,3-dichlorophenyl)thio]picolinic acid methyl ester
  • MLS000764268
  • SMR000335090
  • methyl 4-[(2,3-dichlorophenyl)sulfanyl]-2-pyridinecarboxylate
  • 4M-562S
  • ZINC01389111
  • Oprea1_187861

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Influenza A virus Nonstructural protein 1 Starlite/ChEMBL No references
Human immunodeficiency virus 1 Aberrant vpr protein Starlite/ChEMBL No references
Homo sapiens glucagon-like peptide 1 receptor Starlite/ChEMBL No references
Homo sapiens TAR DNA binding protein Starlite/ChEMBL No references
Mus musculus RAR-related orphan receptor gamma Starlite/ChEMBL No references
Homo sapiens GNAS complex locus Starlite/ChEMBL No references
Homo sapiens Rap guanine nucleotide exchange factor (GEF) 4 Starlite/ChEMBL No references

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Schistosoma japonicum ko:K04632 guanine nucleotide binding protein (G protein), alpha stimulating, putative Get druggable targets OG5_131088 All targets in OG5_131088
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit Get druggable targets OG5_131088 All targets in OG5_131088
Brugia malayi RNA recognition motif domain containing protein Get druggable targets OG5_132461 All targets in OG5_132461
Brugia malayi RNA binding protein Get druggable targets OG5_132461 All targets in OG5_132461
Onchocerca volvulus Rap guanine nucleotide exchange factor 1 homolog Get druggable targets OG5_131726 All targets in OG5_131726
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_131726 All targets in OG5_131726
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain Get druggable targets OG5_131088 All targets in OG5_131088
Loa Loa (eye worm) TAR-binding protein Get druggable targets OG5_132461 All targets in OG5_132461
Echinococcus granulosus guanine nucleotide binding protein Gs subunit Get druggable targets OG5_131088 All targets in OG5_131088
Schistosoma mansoni tar DNA-binding protein Get druggable targets OG5_132461 All targets in OG5_132461
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative Get druggable targets OG5_131088 All targets in OG5_131088
Echinococcus granulosus guanine nucleotide binding protein Gs subunit Get druggable targets OG5_131088 All targets in OG5_131088
Echinococcus multilocularis tar DNA binding protein Get druggable targets OG5_132461 All targets in OG5_132461
Brugia malayi N-terminal motif family protein Get druggable targets OG5_131726 All targets in OG5_131726
Loa Loa (eye worm) RNA binding protein Get druggable targets OG5_132461 All targets in OG5_132461
Echinococcus granulosus tar DNA binding protein Get druggable targets OG5_132461 All targets in OG5_132461
Schistosoma mansoni tar DNA-binding protein Get druggable targets OG5_132461 All targets in OG5_132461
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) Get druggable targets OG5_131088 All targets in OG5_131088
Schistosoma mansoni tar DNA-binding protein Get druggable targets OG5_132461 All targets in OG5_132461
Schistosoma japonicum TAR DNA-binding protein 43, putative Get druggable targets OG5_132461 All targets in OG5_132461
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit Get druggable targets OG5_131088 All targets in OG5_131088
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) Get druggable targets OG5_131088 All targets in OG5_131088
Schistosoma mansoni tar DNA-binding protein Get druggable targets OG5_132461 All targets in OG5_132461
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein Get druggable targets OG5_132461 All targets in OG5_132461
Schistosoma japonicum TAR DNA-binding protein 43, putative Get druggable targets OG5_132461 All targets in OG5_132461
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) Get druggable targets OG5_131088 All targets in OG5_131088
Brugia malayi TAR-binding protein Get druggable targets OG5_132461 All targets in OG5_132461
Schistosoma mansoni tar DNA-binding protein Get druggable targets OG5_132461 All targets in OG5_132461
By sequence similarity to non orthologous known druggable targets
Species Potential target Known druggable target Length Alignment span Identity
Mycobacterium tuberculosis Hypothetical protein Nonstructural protein 1   230 aa 202 aa 23.8 %
Schistosoma mansoni GTP-binding protein alpha subunit gna GNAS complex locus 394 aa 450 aa 28.7 %
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
Brugia malayi Melatonin receptor type 1A 0.0035 0.0784 0.0766
Echinococcus granulosus cyclic nucleotide gated cation channel alpha 3 0.0028 0.044 0.087
Echinococcus multilocularis alpha 1A adrenergic receptor 0.0035 0.0784 0.1584
Schistosoma mansoni hypothetical protein 0.0041 0.1048 0.1958
Loa Loa (eye worm) hypothetical protein 0.0035 0.0784 0.0766
Echinococcus granulosus cyclic nucleotide gated cation channel 0.0028 0.044 0.087
Schistosoma mansoni biogenic amine receptor 0.0035 0.0784 0.1465
Echinococcus granulosus hyperpolarization activated cyclic 0.0028 0.044 0.087
Echinococcus multilocularis rhodopsin orphan GPCR 0.0035 0.0784 0.1584
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0055 0.1703 0.1687
Mycobacterium tuberculosis Probable glutamine-transport ATP-binding protein ABC transporter GlnQ 0.002 0.0078 0.5
Trypanosoma brucei protein kinase A regulatory subunit 0.002 0.0078 0.5
Brugia malayi GnHR receptor homolog 0.0035 0.0784 0.0766
Echinococcus multilocularis sex peptide receptor 0.0035 0.0784 0.1584
Schistosoma mansoni biogenic amine receptor 0.0035 0.0784 0.1465
Loa Loa (eye worm) hypothetical protein 0.0039 0.0945 0.0927
Echinococcus granulosus cAMP dependent protein kinase regulatory 0.002 0.0078 0.0121
Echinococcus granulosus tachykinin peptides receptor 99D 0.0035 0.0784 0.1584
Mycobacterium ulcerans hypothetical protein 0.002 0.0078 0.5
Leishmania major regulatory subunit of protein kinase a-like protein 0.002 0.0078 0.5
Echinococcus multilocularis cGMP dependent protein kinase 1 0.002 0.0078 0.0121
Trypanosoma cruzi regulatory subunit of protein kinase a-like protein, putative 0.002 0.0078 0.5
Echinococcus granulosus rhodopsin orphan GPCR 0.0035 0.0784 0.1584
Echinococcus granulosus peptide allatostatin:somatostatin 0.0035 0.0784 0.1584
Loa Loa (eye worm) hypothetical protein 0.0035 0.0784 0.0766
Loa Loa (eye worm) hypothetical protein 0.0028 0.044 0.0421
Mycobacterium tuberculosis Conserved hypothetical protein 0.002 0.0078 0.5
Echinococcus granulosus 7TM GPCR rhodopsin 0.0035 0.0784 0.1584
Schistosoma mansoni myosin xvIII 0.0035 0.0784 0.1465
Loa Loa (eye worm) hypothetical protein 0.0035 0.0784 0.0766
Echinococcus multilocularis neuropeptide Y receptor 0.0035 0.0784 0.1584
Brugia malayi Dopamine receptor protein 2 0.0035 0.0784 0.0766
Schistosoma mansoni hyperpolarization activated cyclic nucleotide-gated potassium channel 0.002 0.0078 0.0146
Onchocerca volvulus 0.0035 0.0784 0.0712
Loa Loa (eye worm) hypothetical protein 0.0035 0.0784 0.0766
Schistosoma mansoni neuropeptide receptor 0.0035 0.0784 0.1465
Schistosoma mansoni camp-dependent protein kinase type I-beta regulatory subunit 0.002 0.0078 0.0146
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0035 0.0784 0.1465
Trypanosoma brucei cAMP binding protein, putative 0.002 0.0078 0.5
Echinococcus granulosus potassium:sodium hyperpolarization activated 0.0028 0.044 0.087
Echinococcus multilocularis neuropeptide receptor 0.0035 0.0784 0.1584
Echinococcus multilocularis g-protein coupled receptor 0.0035 0.0784 0.1584
Echinococcus multilocularis allatostatin A receptor 0.0035 0.0784 0.1584
Loa Loa (eye worm) G-protein coupled receptor 0.0035 0.0784 0.0766
Brugia malayi putative neuropeptide receptor 0.0035 0.0784 0.0766
Onchocerca volvulus Dopamine\/Ecdysteroid receptor homolog 0.0035 0.0784 0.0712
Echinococcus multilocularis growth hormone secretagogue receptor type 1 0.0035 0.0784 0.1584
Schistosoma mansoni peptide (FMRFamide/neurokinin-3)-like receptor 0.0035 0.0784 0.1465
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.0076 0.2692 0.2678
Schistosoma mansoni voltage-gated potassium channel 0.0039 0.0945 0.1765
Loa Loa (eye worm) hypothetical protein 0.0035 0.0784 0.0766
Echinococcus multilocularis serotonin receptor 0.0035 0.0784 0.1584
Brugia malayi Voltage-gated potassium channel, HERG (KCNH2)-related. C. elegans unc-103 ortholog 0.0123 0.4848 0.4838
Brugia malayi RNA recognition motif domain containing protein 0.0076 0.2692 0.2678
Brugia malayi hypothetical protein 0.0035 0.0784 0.0766
Echinococcus granulosus patatin phospholipase domain containing protein 0.002 0.0078 0.0121
Trypanosoma cruzi hypothetical protein, conserved 0.002 0.0078 0.5
Schistosoma mansoni biogenic amine (dopamine) receptor 0.0035 0.0784 0.1465
Loa Loa (eye worm) hypothetical protein 0.0035 0.0784 0.0766
Leishmania major protein kinase, putative 0.002 0.0078 0.5
Schistosoma mansoni camp-dependent protein kinase type I-beta regulatory subunit 0.002 0.0078 0.0146
Echinococcus granulosus g protein coupled receptor 0.0035 0.0784 0.1584
Loa Loa (eye worm) hypothetical protein 0.0035 0.0784 0.0766
Brugia malayi neuropeptide F receptor 0.0035 0.0784 0.0766
Schistosoma mansoni hypothetical protein 0.0035 0.0784 0.1465
Echinococcus multilocularis rhodopsin orphan GPCR 0.0035 0.0784 0.1584
Brugia malayi Voltage-gated potassium channel, EAG (KCNH1)-related. C. elegans egl-2 ortholog 0.0039 0.0945 0.0927
Mycobacterium ulcerans hypothetical protein 0.002 0.0078 0.5
Loa Loa (eye worm) TYRA-2 protein 0.0035 0.0784 0.0766
Echinococcus granulosus neuropeptides capa receptor 0.0035 0.0784 0.1584
Echinococcus multilocularis tar DNA binding protein 0.0076 0.2692 0.5535
Schistosoma mansoni histamine h1 receptor 0.0035 0.0784 0.1465
Echinococcus multilocularis cyclic nucleotide gated cation channel 0.0028 0.044 0.087
Onchocerca volvulus 0.0035 0.0784 0.0712
Mycobacterium tuberculosis Probable conserved transmembrane transport protein 0.002 0.0078 0.5
Loa Loa (eye worm) hypothetical protein 0.0035 0.0784 0.0766
Schistosoma mansoni amine GPCR 0.0035 0.0784 0.1465
Mycobacterium ulcerans transcriptional regulatory protein 0.002 0.0078 0.5
Echinococcus granulosus rhodopsin orphan GPCR 0.0035 0.0784 0.1584
Brugia malayi sulfakinin receptor protein 0.0035 0.0784 0.0766
Trypanosoma cruzi cAMP response protein 1 0.002 0.0078 0.5
Echinococcus multilocularis thyrotropin releasing hormone receptor 0.0035 0.0784 0.1584
Loa Loa (eye worm) hypothetical protein 0.006 0.1934 0.1918
Echinococcus multilocularis cGMP dependent protein kinase 1 0.002 0.0078 0.0121
Schistosoma mansoni hyperpolarization activated cyclic nucleotide-gated potassium channel 0.0028 0.044 0.0822
Echinococcus granulosus rhodopsin orphan GPCR 0.0035 0.0784 0.1584
Brugia malayi G-protein-linked acetylcholine receptor protein 2, putative 0.0035 0.0784 0.0766
Echinococcus multilocularis fmrfamide receptor 0.0035 0.0784 0.1584
Loa Loa (eye worm) neuropeptide F receptor 0.0035 0.0784 0.0766
Trypanosoma brucei cyclic nucleotide-binding domain containing protein, putative 0.002 0.0078 0.5
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0055 0.1703 0.3487
Brugia malayi ORL1-like opioid receptor 0.0035 0.0784 0.0766
Leishmania major hypothetical protein, unknown function 0.002 0.0078 0.5
Brugia malayi hypothetical protein 0.0035 0.0784 0.0766
Brugia malayi putative neuropeptide receptor NPR1 0.0035 0.0784 0.0766
Loa Loa (eye worm) hypothetical protein 0.0035 0.0784 0.0766
Schistosoma mansoni hypothetical protein 0.0019 0.002 0.0037
Brugia malayi Serotonin/octopamine receptor family protein 7 0.0035 0.0784 0.0766
Echinococcus multilocularis g protein coupled receptor 0.0035 0.0784 0.1584
Trypanosoma brucei Flagellar Member 6 0.002 0.0078 0.5
Echinococcus granulosus G protein coupled 5 hydroxytryptamine receptor 0.0035 0.0784 0.1584
Schistosoma mansoni biogenic amine (dopamine) receptor 0.0035 0.0784 0.1465
Schistosoma mansoni hypothetical protein 0.0019 0.002 0.0037
Echinococcus granulosus G protein coupled receptor 139 0.0035 0.0784 0.1584
Schistosoma mansoni hypothetical protein 0.002 0.0078 0.0146
Schistosoma mansoni opsin-like receptor 0.0035 0.0784 0.1465
Echinococcus multilocularis neuropeptides capa receptor 0.0035 0.0784 0.1584
Loa Loa (eye worm) hypothetical protein 0.0035 0.0784 0.0766
Schistosoma mansoni neuropeptide f receptor 76f 0.0035 0.0784 0.1465
Trichomonas vaginalis voltage and ligand gated potassium channel, putative 0.0028 0.044 0.082
Onchocerca volvulus 0.0035 0.0784 0.0712
Loa Loa (eye worm) hypothetical protein 0.0035 0.0784 0.0766
Schistosoma mansoni hypothetical protein 0.0019 0.002 0.0037
Loa Loa (eye worm) hypothetical protein 0.0035 0.0784 0.0766
Loa Loa (eye worm) hypothetical protein 0.0035 0.0784 0.0766
Schistosoma mansoni biogenic amine (5HT) receptor 0.0035 0.0784 0.1465
Echinococcus granulosus neuropeptide FF receptor 2 0.0035 0.0784 0.1584
Echinococcus multilocularis G protein coupled receptor 139 0.0035 0.0784 0.1584
Toxoplasma gondii cyclic nucleotide-binding domain-containing protein 0.002 0.0078 0.5
Echinococcus granulosus 7tm_1 domain containing protein 0.0035 0.0784 0.1584
Brugia malayi hypothetical protein 0.0035 0.0784 0.0766
Loa Loa (eye worm) cAMP-dependent protein kinase regulatory subunit 0.002 0.0078 0.0059
Echinococcus multilocularis potassium voltage gated channel subfamily H 0.0039 0.0945 0.1916
Trichomonas vaginalis voltage and ligand gated potassium channel, putative 0.0115 0.4486 1
Echinococcus multilocularis cAMP dependent protein kinase regulatory 0.002 0.0078 0.0121
Leishmania major hypothetical protein, conserved 0.002 0.0078 0.5
Echinococcus granulosus voltage gated potassium channel 0.0039 0.0945 0.1916
Loa Loa (eye worm) hypothetical protein 0.0035 0.0784 0.0766
Schistosoma mansoni thyrotropin-releasing hormone receptor 0.0035 0.0784 0.1465
Echinococcus granulosus rhodopsin orphan GPCR 0.0035 0.0784 0.1584
Loa Loa (eye worm) hypothetical protein 0.0035 0.0784 0.0766
Treponema pallidum cyclic nucleotide binding protein 0.002 0.0078 0.5
Schistosoma mansoni peptide (FMRFamide/somatostatin)-like receptor 0.0035 0.0784 0.1465
Brugia malayi hypothetical protein 0.0035 0.0784 0.0766
Schistosoma mansoni peptide (allatostatin/somatostatin)-like receptor 0.0035 0.0784 0.1465
Toxoplasma gondii cyclic nucleotide-binding domain-containing protein 0.002 0.0078 0.5
Echinococcus multilocularis neuropeptide Y receptor 0.0035 0.0784 0.1584
Echinococcus granulosus hyperpolarization activated cyclic 0.0028 0.044 0.087
Echinococcus multilocularis g protein linked acetylcholine receptor gar 2a 0.0035 0.0784 0.1584
Schistosoma mansoni neuropeptide F-like receptor 0.0035 0.0784 0.1465
Onchocerca volvulus 0.0035 0.0784 0.0712
Plasmodium falciparum cGMP-dependent protein kinase 0.002 0.0078 0.5
Onchocerca volvulus 0.0035 0.0784 0.0712
Onchocerca volvulus 0.0035 0.0784 0.0712
Echinococcus granulosus potassium voltage gated channel subfamily H 0.0123 0.4848 1
Trypanosoma cruzi cyclic nucleotide-binding domain containing protein, putative 0.002 0.0078 0.5
Echinococcus granulosus growth hormone secretagogue receptor type 1 0.0035 0.0784 0.1584
Echinococcus multilocularis potassium:sodium hyperpolarization activated 0.0028 0.044 0.087
Schistosoma mansoni hypothetical protein 0.0035 0.0784 0.1465
Mycobacterium ulcerans regulatory protein 0.002 0.0078 0.5
Echinococcus multilocularis cyclic nucleotide gated cation channel 0.002 0.0078 0.0121
Schistosoma mansoni neuropeptide F-like receptor 0.0035 0.0784 0.1465
Echinococcus multilocularis cAMP dependent protein kinase type II regulatory 0.002 0.0078 0.0121
Brugia malayi Serotonin receptor 0.0035 0.0784 0.0766
Onchocerca volvulus 0.0035 0.0784 0.0712
Echinococcus granulosus g protein coupled receptor 0.0035 0.0784 0.1584
Loa Loa (eye worm) cyclic-nucleotide gated cation channel 0.0028 0.044 0.0421
Schistosoma mansoni growth hormone secretagogue receptor 0.0035 0.0784 0.1465
Schistosoma mansoni similar to Protein C20orf152 homolog 0.002 0.0078 0.0146
Plasmodium falciparum cAMP-dependent protein kinase regulatory subunit 0.002 0.0078 0.5
Echinococcus granulosus cAMP dependent protein kinase type I beta 0.002 0.0078 0.0121
Brugia malayi TAR-binding protein 0.0076 0.2692 0.2678
Brugia malayi AKH receptor 0.0035 0.0784 0.0766
Trypanosoma cruzi regulatory subunit of protein kinase a-like protein, putative 0.002 0.0078 0.5
Schistosoma mansoni cyclic-nucleotide-gated cation channel 0.0028 0.044 0.0822
Loa Loa (eye worm) hypothetical protein 0.0035 0.0784 0.0766
Brugia malayi latrophilin 2 splice variant baaae 0.0041 0.1048 0.103
Echinococcus granulosus g protein linked acetylcholine receptor gar 2a 0.0035 0.0784 0.1584
Brugia malayi Egg laying defective protein 4 0.002 0.0078 0.0059
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0035 0.0784 0.1465
Echinococcus granulosus hypothetical protein 0.0035 0.0784 0.1584
Echinococcus granulosus g protein coupled receptor 0.0035 0.0784 0.1584
Echinococcus multilocularis G protein coupled 5 hydroxytryptamine receptor 0.0035 0.0784 0.1584
Loa Loa (eye worm) TAR-binding protein 0.0076 0.2692 0.2678
Echinococcus multilocularis neuropeptide receptor A26 0.0035 0.0784 0.1584
Toxoplasma gondii cyclic nucleotide-binding domain-containing protein 0.002 0.0078 0.5
Echinococcus multilocularis peptide (allatostatin:somatostatin) 0.0035 0.0784 0.1584
Schistosoma mansoni tar DNA-binding protein 0.0076 0.2692 0.5029
Loa Loa (eye worm) hypothetical protein 0.0234 1 1
Schistosoma mansoni biogenic amine receptor 0.0035 0.0784 0.1465
Loa Loa (eye worm) hypothetical protein 0.0035 0.0784 0.0766
Echinococcus granulosus orexin receptor type 2 0.0035 0.0784 0.1584
Schistosoma mansoni biogenic amine (octopamine/dopamine) receptor 0.0035 0.0784 0.1465
Schistosoma mansoni serine/threonine protein kinase 0.002 0.0078 0.0146
Echinococcus multilocularis cAMP dependent protein kinase type I beta 0.002 0.0078 0.0121
Mycobacterium tuberculosis Probable conserved transmembrane protein 0.002 0.0078 0.5
Schistosoma mansoni hypothetical protein 0.0019 0.002 0.0037
Schistosoma mansoni camp-dependent protein kinase regulatory chain 0.002 0.0078 0.0146
Mycobacterium tuberculosis Conserved protein 0.002 0.0078 0.5
Echinococcus granulosus tar DNA binding protein 0.0076 0.2692 0.5535
Brugia malayi Dopamine receptor protein 1 0.0035 0.0784 0.0766
Echinococcus granulosus neuropeptide receptor 0.0035 0.0784 0.1584
Trypanosoma brucei cyclic nucleotide-binding domain containing protein, putative 0.002 0.0078 0.5
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0035 0.0784 0.1465
Onchocerca volvulus 0.0035 0.0784 0.0712
Schistosoma mansoni amine GPCR 0.0035 0.0784 0.1465
Echinococcus multilocularis g protein coupled receptor 0.0035 0.0784 0.1584
Schistosoma mansoni cyclic nucleotide-gated ion channel 0.002 0.0078 0.0146
Loa Loa (eye worm) hypothetical protein 0.0035 0.0784 0.0766
Echinococcus multilocularis voltage gated potassium channel 0.0039 0.0945 0.1916
Brugia malayi Cyclic-nucleotide gated cation channel, C. elegans tax-4 ortholog 0.002 0.0078 0.0059
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0035 0.0784 0.1465
Brugia malayi Dopamine receptor 0.0035 0.0784 0.0766
Leishmania major protein kinase A regulatory subunit, putative 0.002 0.0078 0.5
Schistosoma mansoni amine GPCR 0.0035 0.0784 0.1465
Echinococcus multilocularis g protein coupled receptor 0.0035 0.0784 0.1584
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0055 0.1703 0.3182
Echinococcus granulosus neuropeptide receptor A26 0.0035 0.0784 0.1584
Echinococcus multilocularis tachykinin peptides receptor 99D 0.0035 0.0784 0.1584
Echinococcus multilocularis rhodopsin orphan GPCR 0.0035 0.0784 0.1584
Schistosoma mansoni tar DNA-binding protein 0.0076 0.2692 0.5029
Schistosoma mansoni neuropeptide receptor 0.0035 0.0784 0.1465
Echinococcus multilocularis cyclic nucleotide gated cation channel 0.002 0.0078 0.0121
Schistosoma mansoni cyclic-nucleotide-gated cation channel 0.002 0.0078 0.0146
Mycobacterium ulcerans hypothetical protein 0.002 0.0078 0.5
Treponema pallidum cyclic nucleotide binding protein 0.002 0.0078 0.5
Echinococcus multilocularis rhodopsin orphan GPCR 0.0035 0.0784 0.1584
Brugia malayi gonadotropin-releasing hormone receptor 2 0.0035 0.0784 0.0766
Schistosoma mansoni biogenic amine (5HT) receptor 0.0035 0.0784 0.1465
Onchocerca volvulus Rap guanine nucleotide exchange factor 1 homolog 0.0234 1 1
Schistosoma mansoni cyclic-nucleotide-gated cation channel 0.0028 0.044 0.0822
Brugia malayi hypothetical protein 0.0035 0.0784 0.0766
Brugia malayi Cyclic-nucleotide gated cation channel 0.0028 0.044 0.0421
Brugia malayi larval opioid receptor 0.0035 0.0784 0.0766
Schistosoma mansoni tar DNA-binding protein 0.0076 0.2692 0.5029
Echinococcus granulosus neuropeptide s receptor 0.0035 0.0784 0.1584
Echinococcus multilocularis tm gpcr rhodopsin gpcr rhodopsin superfamily 0.0035 0.0784 0.1584
Echinococcus multilocularis neuropeptides capa receptor 0.0035 0.0784 0.1584
Echinococcus granulosus cyclic nucleotide gated cation channel 0.0028 0.044 0.087
Echinococcus granulosus thyrotropin releasing hormone receptor 0.0035 0.0784 0.1584
Brugia malayi follicle stimulating hormone receptor 0.0035 0.0784 0.0766
Schistosoma mansoni opsin-like receptor 0.0035 0.0784 0.1465
Onchocerca volvulus 0.0035 0.0784 0.0712
Echinococcus multilocularis 7TM GPCR, rhodopsin 0.0035 0.0784 0.1584
Loa Loa (eye worm) hypothetical protein 0.0035 0.0784 0.0766
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0055 0.1703 0.3182
Brugia malayi RE15519p 0.0035 0.0784 0.0766
Schistosoma mansoni neuropeptide receptor 0.0035 0.0784 0.1465
Echinococcus multilocularis hyperpolarization activated cyclic 0.0028 0.044 0.087
Echinococcus multilocularis neuropeptide receptor 0.0035 0.0784 0.1584
Echinococcus granulosus cGMP dependent protein kinase 1 0.002 0.0078 0.0121
Brugia malayi Serotonin receptor 0.0035 0.0784 0.0766
Loa Loa (eye worm) pigment dispersing factor receptor c 0.006 0.1934 0.1918
Loa Loa (eye worm) hypothetical protein 0.0035 0.0784 0.0766
Echinococcus multilocularis neuropeptide FF receptor 2 0.0035 0.0784 0.1584
Loa Loa (eye worm) hypothetical protein 0.0035 0.0784 0.0766
Toxoplasma gondii cyclic nucleotide-binding domain-containing protein 0.002 0.0078 0.5
Trypanosoma brucei cAMP response protein 1, putative 0.002 0.0078 0.5
Loa Loa (eye worm) hypothetical protein 0.0035 0.0784 0.0766
Schistosoma mansoni amine GPCR 0.0035 0.0784 0.1465
Brugia malayi hypothetical protein 0.0035 0.0784 0.0766
Echinococcus granulosus rhodopsin orphan GPCR 0.0035 0.0784 0.1584
Echinococcus granulosus neuropeptide receptor 0.0035 0.0784 0.1584
Loa Loa (eye worm) hypothetical protein 0.0035 0.0784 0.0766
Echinococcus granulosus neuropeptide Y receptor 0.0035 0.0784 0.1584
Schistosoma mansoni adenoreceptor 0.0035 0.0784 0.1465
Loa Loa (eye worm) hypothetical protein 0.0035 0.0784 0.0766
Echinococcus granulosus pyroglutamylated rfamide peptide receptor 0.0035 0.0784 0.1584
Echinococcus granulosus g-protein coupled receptor 0.0035 0.0784 0.1584
Echinococcus multilocularis neuropeptide s receptor 0.0035 0.0784 0.1584
Echinococcus multilocularis orexin receptor type 2 0.0035 0.0784 0.1584
Echinococcus multilocularis G-protein coupled receptor, putative 0.0035 0.0784 0.1584
Echinococcus granulosus rhodopsin orphan GPCR 0.0035 0.0784 0.1584
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0055 0.1703 0.3487
Mycobacterium leprae Conserved hypothetical protein 0.002 0.0078 0.5
Plasmodium vivax rap guanine nucleotide exchange factor, putative 0.002 0.0078 0.5
Brugia malayi G protein-coupled receptor 0.0035 0.0784 0.0766
Schistosoma mansoni peptide (allatostatin)-like receptor 0.0035 0.0784 0.1465
Echinococcus granulosus neuropeptide Y receptor 0.0035 0.0784 0.1584
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0055 0.1703 0.3487
Echinococcus multilocularis rhodopsin orphan GPCR 0.0035 0.0784 0.1584
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0055 0.1703 0.1687
Trypanosoma cruzi cAMP response protein 1, putative 0.002 0.0078 0.5
Echinococcus granulosus g protein linked acetylcholine receptor gar 2a 0.0035 0.0784 0.1584
Echinococcus granulosus neuropeptides capa receptor 0.0035 0.0784 0.1584
Leishmania major hypothetical protein, conserved 0.002 0.0078 0.5
Loa Loa (eye worm) hypothetical protein 0.0035 0.0784 0.0766
Brugia malayi cAMP-dependent protein kinase regulatory chain, putative 0.002 0.0078 0.0059
Schistosoma mansoni voltage-gated potassium channel 0.0134 0.5352 1
Echinococcus multilocularis pyroglutamylated rfamide peptide receptor 0.0035 0.0784 0.1584
Loa Loa (eye worm) hypothetical protein 0.0035 0.0784 0.0766
Schistosoma mansoni camp-dependent rap1 guanine-nucleotide exchange factor 0.0023 0.0198 0.0369
Loa Loa (eye worm) neuropeptide F receptor 0.0035 0.0784 0.0766
Leishmania major hypothetical protein, conserved 0.002 0.0078 0.5
Loa Loa (eye worm) hypothetical protein 0.0035 0.0784 0.0766
Loa Loa (eye worm) hypothetical protein 0.0035 0.0784 0.0766
Echinococcus multilocularis biogenic amine (5HT) receptor 0.0035 0.0784 0.1584
Schistosoma mansoni serine/threonine protein kinase 0.002 0.0078 0.0146
Loa Loa (eye worm) hypothetical protein 0.0035 0.0784 0.0766
Loa Loa (eye worm) hypothetical protein 0.0035 0.0784 0.0766
Schistosoma mansoni muscarinic acetylcholine (GAR) receptor 0.0035 0.0784 0.1465
Loa Loa (eye worm) G-protein-linked acetylcholine receptor protein 2 0.0035 0.0784 0.0766
Schistosoma mansoni neuropathy target esterase/swiss cheese-related protein 0.002 0.0078 0.0146
Echinococcus multilocularis hyperpolarization activated cyclic 0.0028 0.044 0.087
Echinococcus multilocularis tm gpcr rhodopsin gpcr rhodopsin superfamily 0.0035 0.0784 0.1584
Echinococcus multilocularis cyclic nucleotide gated cation channel alpha 3 0.0028 0.044 0.087
Schistosoma mansoni tar DNA-binding protein 0.0076 0.2692 0.5029
Echinococcus granulosus fmrfamide receptor 0.0035 0.0784 0.1584
Loa Loa (eye worm) hypothetical protein 0.0035 0.0784 0.0766
Echinococcus multilocularis fmrfamide receptor 0.0035 0.0784 0.1584
Onchocerca volvulus 0.0035 0.0784 0.0712
Schistosoma mansoni histamine-responsive GPCR (AAF21638) 0.0035 0.0784 0.1465
Echinococcus multilocularis potassium voltage gated channel subfamily H 0.0123 0.4848 1
Loa Loa (eye worm) hypothetical protein 0.0035 0.0784 0.0766
Loa Loa (eye worm) hypothetical protein 0.002 0.0078 0.0059
Toxoplasma gondii protein kinase G AGC kinase family member PKG 0.002 0.0078 0.5
Schistosoma mansoni tar DNA-binding protein 0.0076 0.2692 0.5029
Loa Loa (eye worm) hypothetical protein 0.0035 0.0784 0.0766
Schistosoma mansoni hypothetical protein 0.0035 0.0784 0.1465
Loa Loa (eye worm) hypothetical protein 0.0103 0.3903 0.3891
Brugia malayi Calcitonin receptor-like protein seb-1 0.006 0.1934 0.1918
Echinococcus multilocularis tm gpcr rhodopsin gpcr rhodopsin superfamily 0.0035 0.0784 0.1584
Echinococcus granulosus allatostatin A receptor 0.0035 0.0784 0.1584
Loa Loa (eye worm) hypothetical protein 0.0035 0.0784 0.0766
Brugia malayi hypothetical protein 0.0035 0.0784 0.0766
Onchocerca volvulus 0.0035 0.0784 0.0712
Loa Loa (eye worm) G-protein coupled receptor 0.0035 0.0784 0.0766
Loa Loa (eye worm) cyclic-nucleotide gated cation channel 0.0028 0.044 0.0421
Echinococcus granulosus alpha 1A adrenergic receptor 0.0035 0.0784 0.1584
Echinococcus granulosus tm gpcr rhodopsin 0.0035 0.0784 0.1584
Loa Loa (eye worm) hypothetical protein 0.0035 0.0784 0.0766
Schistosoma mansoni opsin-like receptor 0.0035 0.0784 0.1465
Brugia malayi G-protein coupled receptor 0.0035 0.0784 0.0766
Treponema pallidum catabolite gene activator 0.002 0.0078 0.5
Loa Loa (eye worm) follicle stimulating hormone receptor 0.0035 0.0784 0.0766
Schistosoma mansoni hypothetical protein 0.0035 0.0784 0.1465
Loa Loa (eye worm) hypothetical protein 0.0035 0.0784 0.0766
Loa Loa (eye worm) hypothetical protein 0.0035 0.0784 0.0766
Trichomonas vaginalis voltage and ligand gated potassium channel, putative 0.0028 0.044 0.082
Echinococcus multilocularis rhodopsin orphan GPCR 0.0035 0.0784 0.1584
Echinococcus granulosus somatostatin receptor 0.0035 0.0784 0.1584
Onchocerca volvulus 0.0035 0.0784 0.0712
Schistosoma mansoni neuropathy target esterase/swiss cheese-related protein 0.002 0.0078 0.0146
Echinococcus granulosus rhodopsin orphan GPCR 0.0035 0.0784 0.1584
Echinococcus granulosus serotonin receptor 0.0035 0.0784 0.1584
Mycobacterium tuberculosis Probable transcriptional regulatory protein Cmr 0.002 0.0078 0.5
Onchocerca volvulus 0.0035 0.0784 0.0712
Plasmodium vivax CAMP-dependent protein kinase regulatory subunit, putative 0.002 0.0078 0.5
Brugia malayi hypothetical protein 0.0035 0.0784 0.0766
Echinococcus multilocularis g protein linked acetylcholine receptor gar 2a 0.0035 0.0784 0.1584
Echinococcus granulosus cGMP dependent protein kinase 1 0.002 0.0078 0.0121
Onchocerca volvulus 0.0035 0.0784 0.0712
Echinococcus multilocularis rhodopsin orphan GPCR 0.0035 0.0784 0.1584
Loa Loa (eye worm) hypothetical protein 0.0041 0.1048 0.103
Brugia malayi Hypothetical UPF0028 protein ZK370.4 in chromosome III, putative 0.002 0.0078 0.0059
Schistosoma mansoni neuropeptide receptor 0.0035 0.0784 0.1465
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0055 0.1703 0.3182
Loa Loa (eye worm) 5-hydroxytryptamine 2C receptor 0.0035 0.0784 0.0766
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0035 0.0784 0.1465
Loa Loa (eye worm) AGC/PKG protein kinase 0.002 0.0078 0.0059
Toxoplasma gondii cAMP-dependent protein kinase regulatory subunit 0.002 0.0078 0.5
Schistosoma mansoni cyclic-nucleotide-gated cation channel 0.0028 0.044 0.0822
Schistosoma mansoni serine/threonine protein kinase 0.002 0.0078 0.0146
Echinococcus granulosus tm gpcr rhodopsin 0.0035 0.0784 0.1584
Brugia malayi G-protein coupled receptor 0.0035 0.0784 0.0766
Schistosoma mansoni voltage-gated potassium channel 0.0134 0.5352 1
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0035 0.0784 0.1465
Echinococcus granulosus tm gpcr rhodopsin 0.0035 0.0784 0.1584
Brugia malayi hypothetical protein 0.0035 0.0784 0.0766
Loa Loa (eye worm) hypothetical protein 0.0035 0.0784 0.0766
Schistosoma mansoni voltage-gated potassium channel 0.0039 0.0945 0.1765
Chlamydia trachomatis cAMP-dependent protein kinase regulatory subunit 0.002 0.0078 0.5
Brugia malayi neuropeptide F receptor 0.0035 0.0784 0.0766
Loa Loa (eye worm) hypothetical protein 0.0035 0.0784 0.0766
Brugia malayi Unidentified vitellogenin-linked transcript protein 6, putative 0.0035 0.0784 0.0766
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0055 0.1703 0.3487
Echinococcus multilocularis serotonin receptor 0.0035 0.0784 0.1584
Schistosoma mansoni camp-dependent protein kinase type II-alpha regulatory subunit 0.002 0.0078 0.0146
Schistosoma mansoni voltage-gated potassium channel 0.0028 0.044 0.0822
Trypanosoma cruzi protein kinase A regulatory subunit 0.002 0.0078 0.5
Schistosoma mansoni hyperpolarization activated cyclic nucleotide-gated potassium channel 0.0028 0.044 0.0822
Loa Loa (eye worm) hypothetical protein 0.0035 0.0784 0.0766
Schistosoma mansoni amine GPCR 0.0035 0.0784 0.1465
Mycobacterium ulcerans hypothetical protein 0.002 0.0078 0.5
Leishmania major cyclic nucleotide-binding protein-like protein 0.002 0.0078 0.5
Schistosoma mansoni alpha-1 adrenergic receptor 0.0035 0.0784 0.1465
Loa Loa (eye worm) hypothetical protein 0.0035 0.0784 0.0766
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0035 0.0784 0.1465
Echinococcus granulosus potassium voltage gated channel subfamily H 0.0039 0.0945 0.1916
Echinococcus multilocularis rhodopsin orphan GPCR 0.0035 0.0784 0.1584
Brugia malayi Dopamine receptor protein 1, putative (partial) 0.0035 0.0784 0.0766
Mycobacterium tuberculosis Conserved hypothetical protein 0.002 0.0078 0.5
Loa Loa (eye worm) hypothetical protein 0.0035 0.0784 0.0766
Leishmania major protein kinase, putative 0.002 0.0078 0.5
Echinococcus multilocularis expressed conserved protein 0.002 0.0078 0.0121
Schistosoma mansoni peptide (FMRFamide/somatostatin)-like receptor 0.0035 0.0784 0.1465
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.006 0.1934 0.1918
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0035 0.0784 0.1465
Schistosoma mansoni camp-dependent protein kinase type II regulatory subunit 0.002 0.0078 0.0146
Loa Loa (eye worm) unidentified vitellogenin-linked transcript protein 6 0.0035 0.0784 0.0766
Echinococcus granulosus cyclic nucleotide gated cation channel 0.002 0.0078 0.0121
Trichomonas vaginalis voltage and ligand gated potassium channel, putative 0.0115 0.4486 1
Echinococcus granulosus biogenic amine 5HT receptor 0.0035 0.0784 0.1584
Echinococcus multilocularis dro:myosuppressin receptor 0.0035 0.0784 0.1584
Brugia malayi hypothetical protein 0.0035 0.0784 0.0766
Trypanosoma cruzi cAMP binding protein, putative 0.002 0.0078 0.5
Echinococcus granulosus dro:myosuppressin receptor 0.0035 0.0784 0.1584
Onchocerca volvulus Neuropeptide F receptor homolog 0.0035 0.0784 0.0712
Mycobacterium ulcerans transmembrane transport protein 0.002 0.0078 0.5
Schistosoma mansoni ancient conserved domain protein 2 (cyclin m2) 0.0035 0.0784 0.1465
Trypanosoma cruzi Flagellar Member 6 0.002 0.0078 0.5
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0035 0.0784 0.1465
Loa Loa (eye worm) hypothetical protein 0.0035 0.0784 0.0766
Onchocerca volvulus 0.0035 0.0784 0.0712
Loa Loa (eye worm) hypothetical protein 0.0035 0.0784 0.0766
Loa Loa (eye worm) melatonin receptor type 1A 0.0035 0.0784 0.0766
Brugia malayi G protein-coupled receptor F59B2.13 0.0035 0.0784 0.0766
Echinococcus granulosus cGMP dependent protein kinase 0.002 0.0078 0.0121
Loa Loa (eye worm) voltage and ligand gated potassium channel 0.0123 0.4848 0.4838
Loa Loa (eye worm) RNA binding protein 0.0076 0.2692 0.2678
Schistosoma mansoni biogenic amine (dopamine) receptor 0.0035 0.0784 0.1465
Loa Loa (eye worm) hypothetical protein 0.0035 0.0784 0.0766
Echinococcus granulosus cAMP dependent protein kinase type II regulatory 0.002 0.0078 0.0121
Echinococcus granulosus sex peptide receptor 0.0035 0.0784 0.1584
Echinococcus multilocularis patatin phospholipase domain containing protein 0.002 0.0078 0.0121
Echinococcus granulosus biogenic amine 5HT receptor 0.0035 0.0784 0.1584
Brugia malayi Tachykinin-like peptides receptor 99D 0.0035 0.0784 0.0766
Giardia lamblia CAMP-dependent protein kinase regulatory chain 0.002 0.0078 0.5
Treponema pallidum catabolite gene activator (Crp) 0.002 0.0078 0.5
Onchocerca volvulus 0.0035 0.0784 0.0712
Onchocerca volvulus 0.0035 0.0784 0.0712
Echinococcus multilocularis somatostatin receptor 0.0035 0.0784 0.1584
Loa Loa (eye worm) gonadotropin-releasing hormone receptor 2 0.0035 0.0784 0.0766
Brugia malayi RNA binding protein 0.0076 0.2692 0.2678

Activities

Activity type Activity value Assay description Source Reference
AbsAC40_uM (functional) 14.68 uM PubChem BioAssay. In vivo-based yeast HTS counterscreen to detect compounds rescuing yeast growth/survival of Saccharomyces cerevisiae SKN7-mediated toxicity Measured in Whole Organism System Using Plate Reader - 2120-02_Inhibitor_Dose_CherryPick_Activity. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 3.9811 uM PubChem BioAssay. qHTS of GLP-1 Receptor Inverse Agonists (Inhibition Mode). (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 7.0795 uM PubChem BioAssay. qHTS for Agonist of gsp, the Etiologic Mutation Responsible for Fibrous Dysplasia/McCune-Albright Syndrome: qHTS. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) = 10 um PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Influenza NS1 Protein Function. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) = 11.2202 um PUBCHEM_BIOASSAY: VP16 counterscreen qHTS for inhibitors of ROR gamma transcriptional activity. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 12.5893 uM PubChem BioAssay. qHTS Assay for Inhibitors of the HIV-1 protein Vpr. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 12.5893 uM PubChem BioAssay. qHTS of TDP-43 Inhibitors. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 12.5893 uM PubChem BioAssay. qHTS for Antagonist of cAMP-regulated guanine nucleotide exchange factor 2 (EPAC2): primary screen. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) = 15.8489 um PUBCHEM_BIOASSAY: qHTS for inhibitors of ROR gamma transcriptional activity. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 25.929 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 (binding) = 35.4813 um PUBCHEM_BIOASSAY: qHTS Assay for Identification of Novel General Anesthetics. In this assay, a GABAergic mimetic model system, apoferritin and a profluorescent 1-aminoanthracene ligand (1-AMA), was used to construct a competitive binding assay for identification of novel general anesthetics (Class of assay: confirmatory) [Related pubchem assays: 2385 (Probe Development Summary for Identification of Novel General Anesthetics), 2323 (Validation apoferritin assay run on SigmaAldrich LOPAC1280 collection)] ChEMBL. No reference
Potency (functional) 112.2018 uM PubChem BioAssay. qHTS for Antagonist of cAMP-regulated guanine nucleotide exchange factor 3 (EPAC1): primary screen. (Class of assay: confirmatory) ChEMBL. No reference

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

No literature references available for this target.

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