Detailed information for compound 1660819

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 434.554 | Formula: C24H26N4O2S
  • H donors: 1 H acceptors: 6 LogP: 5.27 Rotable bonds: 9
    Rule of 5 violations (Lipinski): 1
  • SMILES: CCc1c(CCCC(=O)O)nccc1c1nsc(n1)c1ccc(c(c1)C#N)CC(C)C
  • InChi: 1S/C24H26N4O2S/c1-4-19-20(10-11-26-21(19)6-5-7-22(29)30)23-27-24(31-28-23)17-9-8-16(12-15(2)3)18(13-17)14-25/h8-11,13,15H,4-7,12H2,1-3H3,(H,29,30)
  • InChiKey: HJFZIEOLYPNJDJ-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

No synonyms found for this compound

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens sphingosine-1-phosphate receptor 1 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
Echinococcus multilocularis Nuclear hormone receptor HR96 0.002 0.0035 0.0035
Trichomonas vaginalis alpha-glucosidase, putative 0.0035 0.0154 0.0308
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0043 0.0208 0.0686
Echinococcus granulosus tar DNA binding protein 0.0063 0.0362 0.0362
Schistosoma mansoni hypothetical protein 0.0296 0.2159 0.2159
Onchocerca volvulus 0.0092 0.0592 0.1622
Brugia malayi Glycosyl hydrolases family 31 protein 0.0035 0.0154 0.0507
Echinococcus multilocularis bromodomain adjacent to zinc finger domain 0.0059 0.0334 0.0334
Echinococcus granulosus FTZ F1 nuclear receptor protein 0.0043 0.0208 0.0208
Loa Loa (eye worm) nuclear hormone receptor family member nhr-40 0.0043 0.0208 0.0686
Schistosoma mansoni nuclear hormone receptor nor-1/nor-2 0.0043 0.0208 0.0208
Loa Loa (eye worm) hypothetical protein 0.002 0.0035 0.0116
Schistosoma mansoni histone-lysine n-methyltransferase suv9 0.0059 0.0333 0.0333
Brugia malayi nuclear receptor RXR 0.0022 0.0054 0.0177
Echinococcus multilocularis Nuclear hormone receptor family member nhr 41 0.0043 0.0208 0.0208
Schistosoma mansoni chaperonin containing t-complex protein 1 beta subunit tcpb 0.0022 0.0048 0.0048
Echinococcus granulosus methyl CpG binding domain protein 2 0.0017 0.001 0.001
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0043 0.0208 0.0208
Loa Loa (eye worm) hypothetical protein 0.002 0.0035 0.0116
Brugia malayi RNA recognition motif domain containing protein 0.0063 0.0362 0.1194
Echinococcus granulosus retinoic acid receptor rxr beta a 0.0043 0.0208 0.0208
Trypanosoma brucei T-complex protein 1, beta subunit, putative 0.0022 0.0048 0.3143
Schistosoma mansoni tar DNA-binding protein 0.0063 0.0362 0.0362
Loa Loa (eye worm) hypothetical protein 0.002 0.0035 0.0116
Trypanosoma cruzi hypothetical protein, conserved 0.0035 0.0154 1
Schistosoma mansoni retinoid-x-receptor (RXR) 0.0022 0.0054 0.0054
Onchocerca volvulus Bile acid receptor homolog 0.0386 0.2852 0.8211
Schistosoma mansoni thyroid hormone receptor 0.0043 0.0208 0.0208
Echinococcus granulosus muscleblind protein 0.0147 0.1008 0.1008
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0043 0.0208 0.0208
Brugia malayi hypothetical protein 0.0022 0.0054 0.0177
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0084 0.0525 0.0525
Onchocerca volvulus Steroid hormone receptor family member cnr14 homolog 0.0043 0.0208 0.0504
Schistosoma mansoni chaperonin containing t-complex protein 1 beta subunit tcpb 0.0022 0.0048 0.0048
Brugia malayi nuclear hormone receptor family member nhr-6 0.002 0.0035 0.0116
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0043 0.0208 0.0208
Loa Loa (eye worm) pre-SET domain-containing protein family protein 0.041 0.3031 1
Schistosoma mansoni nuclear receptor 0.002 0.0035 0.0035
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0084 0.0525 0.0525
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0059 0.0333 0.0333
Loa Loa (eye worm) nuclear hormone receptor family member nhr-41 0.0043 0.0208 0.0686
Brugia malayi RNA binding protein 0.0063 0.0362 0.1194
Brugia malayi hypothetical protein 0.0022 0.0054 0.0177
Brugia malayi conserved hypotetical protein 0.002 0.0035 0.0116
Brugia malayi T-complex protein 1, beta subunit 0.0022 0.0048 0.0159
Echinococcus granulosus ecdysone induced protein 78C 0.0043 0.0208 0.0208
Brugia malayi hypothetical protein 0.002 0.0035 0.0116
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0084 0.0525 0.0525
Loa Loa (eye worm) glycosyl hydrolase family 31 protein 0.016 0.111 0.3662
Brugia malayi Bromodomain containing protein 0.0074 0.045 0.1486
Loa Loa (eye worm) hypothetical protein 0.0038 0.0172 0.0568
Loa Loa (eye worm) hypothetical protein 0.0043 0.0208 0.0686
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.002 0.0035 0.0035
Brugia malayi photoreceptor-specific nuclear receptor 0.0043 0.0208 0.0686
Echinococcus granulosus histone lysine methyltransferase setb 0.0076 0.0462 0.0462
Trichomonas vaginalis neutral alpha-glucosidase ab precursor, putative 0.0035 0.0154 0.0308
Echinococcus multilocularis retinoic acid receptor rxr beta a retinoic acid receptor rxr alpha a retinoic acid receptor rxr alpha 0.002 0.0035 0.0035
Echinococcus multilocularis zinc finger protein 0.0019 0.0029 0.0029
Echinococcus multilocularis methyl CpG binding domain protein 2 0.0017 0.001 0.001
Brugia malayi Pre-SET motif family protein 0.041 0.3031 1
Trypanosoma brucei glucosidase, putative 0.0035 0.0154 1
Loa Loa (eye worm) PHD-finger family protein 0.002 0.0037 0.0124
Loa Loa (eye worm) hypothetical protein 0.002 0.0035 0.0116
Schistosoma mansoni retinoic acid receptor RXR 0.0043 0.0208 0.0208
Schistosoma mansoni photoreceptor-specific nuclear receptor related 0.0043 0.0208 0.0208
Trypanosoma cruzi T-complex protein 1, beta subunit, putative 0.0022 0.0048 0.3143
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0084 0.0525 0.1731
Onchocerca volvulus 0.0059 0.0333 0.0867
Brugia malayi orphan nuclear receptor NR2E1 0.002 0.0035 0.0116
Loa Loa (eye worm) hypothetical protein 0.0022 0.0054 0.0177
Schistosoma mansoni methyl-cpg binding protein mbd 0.0017 0.001 0.001
Loa Loa (eye worm) hypothetical protein 0.002 0.0035 0.0116
Brugia malayi ecdysone receptor 0.002 0.0035 0.0116
Brugia malayi Nuclear hormone receptor E75 0.002 0.0035 0.0116
Brugia malayi Nuclear hormone receptor family member nhr-3 0.0043 0.0208 0.0686
Brugia malayi nuclear hormone receptor 0.0043 0.0208 0.0686
Echinococcus multilocularis geminin 0.0296 0.2159 0.2159
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.0063 0.0362 0.1194
Toxoplasma gondii histone lysine methyltransferase SET/SUV39 0.0059 0.0333 1
Brugia malayi TAR-binding protein 0.0063 0.0362 0.1194
Loa Loa (eye worm) nuclear hormone receptor family member nhr-49 0.0043 0.0208 0.0686
Echinococcus granulosus hepatocyte nuclear factor 4 alpha 0.0043 0.0208 0.0208
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0084 0.0525 0.0525
Loa Loa (eye worm) hypothetical protein 0.002 0.0035 0.0116
Plasmodium vivax T-complex protein 1 subunit beta, putative 0.0022 0.0048 0.1451
Schistosoma mansoni RAR-like nuclear receptor 0.0043 0.0208 0.0208
Onchocerca volvulus Protein ultraspiracle homolog 0.0043 0.0208 0.0504
Echinococcus multilocularis lysosomal alpha glucosidase 0.016 0.111 0.111
Loa Loa (eye worm) hypothetical protein 0.0022 0.0054 0.0177
Schistosoma mansoni coup transcription factor 0.0043 0.0208 0.0208
Echinococcus granulosus FTZ F1 alpha 0.0043 0.0208 0.0208
Echinococcus multilocularis thyroid hormone receptor alpha 0.0043 0.0208 0.0208
Loa Loa (eye worm) glycosyl hydrolase family 31 protein 0.0035 0.0154 0.0507
Brugia malayi Pre-SET motif family protein 0.0059 0.0333 0.1098
Giardia lamblia TCP-1 chaperonin subunit beta 0.0022 0.0048 0.5
Loa Loa (eye worm) hypothetical protein 0.002 0.0035 0.0116
Echinococcus multilocularis nuclear receptor subfamily 1 group D 0.0022 0.0054 0.0054
Loa Loa (eye worm) hypothetical protein 0.002 0.0035 0.0116
Entamoeba histolytica glycosyl hydrolase, family 31 protein 0.0035 0.0154 1
Echinococcus multilocularis muscleblind protein 0.0147 0.1008 0.1008
Loa Loa (eye worm) nuclear Hormone Receptor family member 0.0043 0.0208 0.0686
Loa Loa (eye worm) nuclear receptor NHR-67 0.002 0.0035 0.0116
Schistosoma mansoni hypothetical protein 0.002 0.0037 0.0037
Echinococcus multilocularis tar DNA binding protein 0.0063 0.0362 0.0362
Loa Loa (eye worm) T-complex protein 1 0.0022 0.0048 0.0159
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0084 0.0525 0.1731
Echinococcus multilocularis histone lysine methyltransferase setb histone lysine methyltransferase eggless 0.0076 0.0462 0.0462
Trichomonas vaginalis alpha-glucosidase, putative 0.0035 0.0154 0.0308
Brugia malayi Nuclear hormone receptor-like 1 0.0022 0.0054 0.0177
Echinococcus granulosus nuclear receptor nhr 48 0.002 0.0035 0.0035
Loa Loa (eye worm) hypothetical protein 0.0043 0.0208 0.0686
Echinococcus granulosus fetal alzheimer antigen falz 0.0022 0.0052 0.0052
Brugia malayi tailless protein 0.002 0.0035 0.0116
Schistosoma mansoni alpha glucosidase 0.0035 0.0154 0.0154
Loa Loa (eye worm) hypothetical protein 0.0043 0.0208 0.0686
Loa Loa (eye worm) hypothetical protein 0.0076 0.0462 0.1525
Loa Loa (eye worm) hypothetical protein 0.0147 0.1008 0.3324
Brugia malayi steroid hormone receptor 0.0043 0.0208 0.0686
Brugia malayi T-complex protein 1, beta subunit 0.0022 0.0048 0.0159
Echinococcus multilocularis nuclear receptor nhr 48 0.002 0.0035 0.0035
Trichomonas vaginalis alpha-glucosidase, putative 0.0035 0.0154 0.0308
Schistosoma mansoni nuclear receptor 0.002 0.0035 0.0035
Schistosoma mansoni microtubule-associated protein tau 0.1316 1 1
Schistosoma mansoni methyl-cpg binding protein mbd 0.0017 0.001 0.001
Brugia malayi Nuclear hormone receptor-like 1 0.0043 0.0208 0.0686
Loa Loa (eye worm) hypothetical protein 0.002 0.0035 0.0116
Loa Loa (eye worm) RNA binding protein 0.0063 0.0362 0.1194
Loa Loa (eye worm) hypothetical protein 0.002 0.0035 0.0116
Loa Loa (eye worm) hypothetical protein 0.0042 0.0205 0.0675
Loa Loa (eye worm) hypothetical protein 0.0022 0.0054 0.0177
Brugia malayi Bromodomain containing protein 0.0038 0.0172 0.0566
Loa Loa (eye worm) hypothetical protein 0.002 0.0035 0.0116
Mycobacterium tuberculosis Probable isocitrate dehydrogenase [NADP] Icd1 (oxalosuccinate decarboxylase) (IDH) (NADP+-specific ICDH) (IDP) 0.0015 0 0.5
Loa Loa (eye worm) hypothetical protein 0.0043 0.0208 0.0686
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0043 0.0208 0.0686
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0076 0.0462 0.0462
Brugia malayi Nuclear hormone receptor family member nhr-41 0.0043 0.0208 0.0686
Loa Loa (eye worm) nuclear hormone receptor family member nhr-31 0.0043 0.0208 0.0686
Schistosoma mansoni tar DNA-binding protein 0.0063 0.0362 0.0362
Schistosoma mansoni tar DNA-binding protein 0.0063 0.0362 0.0362
Echinococcus multilocularis muscleblind protein 1 0.0147 0.1008 0.1008
Plasmodium vivax SET domain protein, putative 0.0059 0.0333 1
Toxoplasma gondii glycosyl hydrolase, family 31 protein 0.0035 0.0154 0.4615
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0084 0.0525 0.0525
Trichomonas vaginalis neutral alpha-glucosidase ab precursor, putative 0.0035 0.0154 0.0308
Echinococcus granulosus geminin 0.0296 0.2159 0.2159
Schistosoma mansoni ecdysone-induced protein 78c (dr-78) 0.0022 0.0054 0.0054
Brugia malayi Nuclear hormone receptor family member nhr-49 0.0043 0.0208 0.0686
Echinococcus granulosus nuclear receptor 2DBD gamma 0.002 0.0035 0.0035
Echinococcus granulosus 5'partial|histone lysine N methyltransferase SETDB2 0.0057 0.0316 0.0316
Entamoeba histolytica glycosyl hydrolase, family 31 protein 0.0035 0.0154 1
Schistosoma mansoni tar DNA-binding protein 0.0063 0.0362 0.0362
Loa Loa (eye worm) hypothetical protein 0.002 0.0035 0.0116
Leishmania major alpha glucosidase II subunit, putative 0.0035 0.0154 1
Schistosoma mansoni acetyl-CoA C-acetyltransferase 0.0022 0.0052 0.0052
Echinococcus granulosus chaperonin containing TCP1 subunit 2 beta 0.0022 0.0048 0.0048
Schistosoma mansoni nuclear receptor 2DBD-gamma 0.0043 0.0208 0.0208
Echinococcus multilocularis neutral alpha glucosidase AB 0.0035 0.0154 0.0154
Onchocerca volvulus 0.0466 0.3466 1
Schistosoma mansoni nuclear hormone receptor 0.0043 0.0208 0.0208
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0084 0.0525 0.0525
Schistosoma mansoni tar DNA-binding protein 0.0063 0.0362 0.0362
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0076 0.0462 0.0462
Brugia malayi Nuclear hormone receptor family member nhr-1 0.0043 0.0208 0.0686
Loa Loa (eye worm) hypothetical protein 0.0022 0.0054 0.0177
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0043 0.0208 0.0686
Brugia malayi Nuclear hormone receptor family member nhr-31 0.0043 0.0208 0.0686
Schistosoma mansoni alpha-glucosidase 0.0138 0.0939 0.0939
Brugia malayi hypothetical protein 0.002 0.0035 0.0116
Echinococcus granulosus zinc finger protein 0.0019 0.0029 0.0029
Schistosoma mansoni alpha-glucosidase 0.0138 0.0939 0.0939
Echinococcus granulosus COUP TF:Svp nuclear hormone receptor 0.0043 0.0208 0.0208
Loa Loa (eye worm) hypothetical protein 0.004 0.019 0.0627
Loa Loa (eye worm) hypothetical protein 0.0043 0.0208 0.0686
Echinococcus granulosus lysosomal alpha glucosidase 0.016 0.111 0.111
Brugia malayi PHD-finger family protein 0.0025 0.007 0.0231
Trichomonas vaginalis alpha-glucosidase, putative 0.0035 0.0154 0.0308
Loa Loa (eye worm) bromodomain containing protein 0.0017 0.0015 0.0049
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0043 0.0208 0.0686
Toxoplasma gondii t-complex protein beta subunit 0.0022 0.0048 0.1451
Schistosoma mansoni retinoid-x-receptor (RXR) 0.0043 0.0208 0.0208
Schistosoma mansoni thyroid hormone receptor 0.0043 0.0208 0.0208
Brugia malayi Nuclear hormone receptor family member nhr-14 0.0043 0.0208 0.0686
Schistosoma mansoni nuclear receptor nhr-48 0.002 0.0035 0.0035
Brugia malayi nuclear receptor NHR-88 0.002 0.0035 0.0116
Echinococcus multilocularis FTZ F1 nuclear receptor protein 0.0043 0.0208 0.0208
Loa Loa (eye worm) nuclear receptor nhr-7B 0.002 0.0035 0.0116
Loa Loa (eye worm) nuclear hormone receptor-like 1 0.0022 0.0054 0.0177
Loa Loa (eye worm) hypothetical protein 0.007 0.0418 0.1378
Plasmodium falciparum T-complex protein 1 subunit beta 0.0022 0.0048 1
Echinococcus granulosus Nuclear hormone receptor HR96 0.002 0.0035 0.0035
Echinococcus granulosus Nuclear hormone receptor HR96 0.002 0.0035 0.0035
Echinococcus multilocularis ecdysone induced protein 78C 0.0043 0.0208 0.0208
Loa Loa (eye worm) DR-78 0.002 0.0035 0.0116
Loa Loa (eye worm) hypothetical protein 0.0022 0.0054 0.0177
Trypanosoma cruzi hypothetical protein, conserved 0.0035 0.0154 1
Brugia malayi nuclear receptor RXR 0.002 0.0035 0.0116
Echinococcus granulosus nuclear receptor subfamily 4 group A 0.002 0.0035 0.0035
Echinococcus granulosus bromodomain adjacent to zinc finger domain 0.0035 0.0154 0.0154
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0084 0.0525 0.0525
Echinococcus multilocularis COUP TF:Svp nuclear hormone receptor 0.0043 0.0208 0.0208
Schistosoma mansoni hepatocyte nuclear factor 4-alpha (hnf-4-alpha) 0.002 0.0035 0.0035
Brugia malayi Steroid receptor seven-up type 2 0.0043 0.0208 0.0686
Leishmania major T-complex protein 1, beta subunit, putative 0.0022 0.0048 0.3143
Trichomonas vaginalis set domain proteins, putative 0.0466 0.3466 1
Echinococcus multilocularis fetal alzheimer antigen, falz 0.0022 0.0052 0.0052
Loa Loa (eye worm) TAR-binding protein 0.0063 0.0362 0.1194
Loa Loa (eye worm) hypothetical protein 0.002 0.0035 0.0116
Loa Loa (eye worm) nuclear hormone receptor family member nhr-1 0.0043 0.0208 0.0686
Loa Loa (eye worm) nuclear hormone receptor 0.002 0.0035 0.0116
Brugia malayi Nuclear hormone receptor family member nhr-40 0.0043 0.0208 0.0686
Echinococcus granulosus nuclear receptor subfamily 1 group D 0.0022 0.0054 0.0054
Echinococcus granulosus neutral alpha glucosidase AB 0.0035 0.0154 0.0154
Schistosoma mansoni FTZ-F1 nuclear receptor-like protein 0.0043 0.0208 0.0208
Brugia malayi Glycosyl hydrolases family 31 protein 0.016 0.111 0.3662
Loa Loa (eye worm) nuclear hormone receptor family member nhr-14 0.0043 0.0208 0.0686
Schistosoma mansoni nuclear hormone receptor 0.002 0.0035 0.0035
Schistosoma mansoni chaperonin containing t-complex protein 1 beta subunit tcpb 0.0022 0.0048 0.0048
Schistosoma mansoni zinc finger protein 0.0019 0.0029 0.0029
Brugia malayi Nuclear hormone receptor E75 0.002 0.0035 0.0116
Brugia malayi nuclear receptor NHR-67 0.002 0.0035 0.0116
Loa Loa (eye worm) hypothetical protein 0.0386 0.2852 0.941
Brugia malayi nuclear hormone receptor 0.002 0.0035 0.0116
Trichomonas vaginalis alpha-glucosidase, putative 0.0035 0.0154 0.0308
Echinococcus granulosus bromodomain adjacent to zinc finger domain 0.0059 0.0334 0.0334
Echinococcus multilocularis bromodomain adjacent to zinc finger domain 0.0035 0.0154 0.0154
Brugia malayi nuclear receptor NHR-88 0.0043 0.0208 0.0686
Echinococcus multilocularis hepatocyte nuclear factor 4 alpha 0.0043 0.0208 0.0208
Loa Loa (eye worm) hypothetical protein 0.0147 0.1008 0.3324
Brugia malayi Nuclear hormone receptor-like 1 0.0022 0.0054 0.0177
Echinococcus multilocularis microtubule associated protein 2 0.1316 1 1
Echinococcus multilocularis FTZ F1 alpha 0.0043 0.0208 0.0208
Loa Loa (eye worm) hypothetical protein 0.0043 0.0208 0.0686
Onchocerca volvulus 0.0043 0.0208 0.0504
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0043 0.0208 0.0686
Schistosoma mansoni nuclear hormone receptor superfamily protein-related 0.002 0.0035 0.0035
Brugia malayi nuclear receptor subfamily 1, group D, member 1, putative 0.002 0.0035 0.0116
Trichomonas vaginalis sucrase-isomaltase, putative 0.0035 0.0154 0.0308
Brugia malayi nuclear hormone receptor family member odr-7 0.002 0.0035 0.0116
Echinococcus multilocularis Nuclear hormone receptor HR96 0.002 0.0035 0.0035
Echinococcus multilocularis nuclear receptor subfamily 4 group A 0.002 0.0035 0.0035
Schistosoma mansoni zinc finger protein 0.002 0.0035 0.0035
Trichomonas vaginalis maltase-glucoamylase, putative 0.0035 0.0154 0.0308
Brugia malayi Muscleblind-like protein 0.0147 0.1008 0.3324
Schistosoma mansoni nuclear hormone receptor 0.002 0.0035 0.0035
Schistosoma mansoni hypothetical protein 0.0296 0.2159 0.2159
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0043 0.0208 0.0686
Echinococcus multilocularis histone lysine N methyltransferase SETMAR 0.0059 0.0333 0.0333
Loa Loa (eye worm) hypothetical protein 0.0043 0.0208 0.0686
Brugia malayi ecdysteroid receptor 0.0386 0.2852 0.941
Echinococcus multilocularis lysosomal alpha glucosidase 0.016 0.111 0.111
Loa Loa (eye worm) steroid hormone receptor 0.0043 0.0208 0.0686
Schistosoma mansoni bromodomain containing protein 0.0062 0.0361 0.0361
Echinococcus multilocularis chaperonin containing TCP1, subunit 2 (beta) 0.0022 0.0048 0.0048
Echinococcus granulosus Nuclear hormone receptor family member nhr 41 0.0043 0.0208 0.0208
Schistosoma mansoni steroid hormone receptor ad4bp 0.0043 0.0208 0.0208
Echinococcus multilocularis atpase aaa+ type core atpase aaa type core 0.0801 0.6038 0.6038
Echinococcus granulosus thyroid hormone receptor alpha 0.002 0.0035 0.0035
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0043 0.0208 0.0208
Schistosoma mansoni Tr4/Tr2 (homologue) 0.0043 0.0208 0.0208

Activities

Activity type Activity value Assay description Source Reference
EC50 (functional) = 6.8 Agonist activity against S1P1 receptor by cell based FRET assay ChEMBL. 22500954
Fu (ADMET) = 0.19 % Fraction unbound in human plasma ChEMBL. 22500954

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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