Detailed information for compound 1519077

Basic information

Technical information
  • TDR Targets ID: 1519077
  • Name: 4-(4-chlorophenyl)-7,7-dimethyl-3,4,6,8-tetra hydro-1H-quinazoline-2,5-dione
  • MW: 304.771 | Formula: C16H17ClN2O2
  • H donors: 2 H acceptors: 2 LogP: 2.36 Rotable bonds: 1
    Rule of 5 violations (Lipinski): 1
  • SMILES: O=C1NC2=C(C(N1)c1ccc(cc1)Cl)C(=O)CC(C2)(C)C
  • InChi: 1S/C16H17ClN2O2/c1-16(2)7-11-13(12(20)8-16)14(19-15(21)18-11)9-3-5-10(17)6-4-9/h3-6,14H,7-8H2,1-2H3,(H2,18,19,21)
  • InChiKey: SBSQPMYPFOYWPS-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • 4-(4-chlorophenyl)-7,7-dimethyl-3,4,6,8-tetrahydro-1H-quinazoline-2,5-quinone

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens ATPase family, AAA domain containing 5 Starlite/ChEMBL No references
Homo sapiens nuclear factor, erythroid 2-like 2 Starlite/ChEMBL No references

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Echinococcus multilocularis atpase aaa+ type core atpase aaa type core Get druggable targets OG5_139225 All targets in OG5_139225
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
Toxoplasma gondii cell division protein CDC48AP 0.0034 0.0294 0.5292
Onchocerca volvulus 0.0012 0.0066 0.0225
Toxoplasma gondii transitional endoplasmic reticulum ATPase, putative 0.0034 0.0294 0.5292
Loa Loa (eye worm) hypothetical protein 0.0008 0.0032 0.0105
Echinococcus multilocularis hepatocyte nuclear factor 4 alpha 0.001 0.0048 0.0048
Trypanosoma brucei Valosin-containing protein 0.0054 0.0497 1
Loa Loa (eye worm) hypothetical protein 0.0008 0.0032 0.0105
Echinococcus multilocularis neurogenic locus notch protein 0.0008 0.0032 0.0032
Schistosoma mansoni vam6/vps39 related 0.0049 0.0451 0.0655
Loa Loa (eye worm) hypothetical protein 0.0026 0.0211 0.0698
Brugia malayi Serine/threonine-protein kinase Pim-3 0.0157 0.156 0.6784
Echinococcus granulosus mitogen activated protein kinase kinase kinase 0.0051 0.0466 0.0677
Echinococcus multilocularis mitogen activated protein kinase kinase kinase 0.0051 0.0466 0.0466
Echinococcus granulosus slit 2 protein 0.0008 0.0032 0.0046
Echinococcus multilocularis RUN 0.0119 0.1167 0.1167
Echinococcus granulosus fibropellin Ia 0.0008 0.0032 0.0046
Trichomonas vaginalis diacylglycerol kinase, epsilon, putative 0.0012 0.0066 0.1055
Brugia malayi Ceramide kinase 0.0012 0.0066 0.0287
Schistosoma mansoni cell polarity protein 0.0008 0.0032 0.0046
Schistosoma mansoni hypothetical protein 0.0119 0.1167 0.1695
Schistosoma mansoni serine/threonine protein kinase 0.0177 0.1768 0.2568
Trichomonas vaginalis diacylglycerol kinase, zeta, iota, putative 0.0012 0.0066 0.1055
Loa Loa (eye worm) VCP protein 0.0023 0.0186 0.0617
Schistosoma mansoni rab6-interacting 0.0119 0.1167 0.1695
Schistosoma mansoni notch 0.0008 0.0032 0.0046
Toxoplasma gondii cell division protein CDC48CY 0.0057 0.0527 1
Echinococcus multilocularis protein jagged 1 0.0008 0.0032 0.0032
Trypanosoma brucei Vacuolar sorting protein 39 domain 1/Vacuolar sorting protein 39 domain 2, putative 0.0049 0.0451 0.8939
Schistosoma mansoni hypothetical protein 0.0008 0.0032 0.0046
Schistosoma mansoni notch 0.0008 0.0032 0.0046
Echinococcus granulosus histone lysine N methyltransferase MLL3 0.0007 0.0018 0.0026
Brugia malayi Nuclear hormone receptor family member nhr-41 0.001 0.0048 0.0208
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0043 0.0392 0.0392
Loa Loa (eye worm) hypothetical protein 0.001 0.0048 0.0159
Echinococcus granulosus peroxidasin 0.0026 0.0211 0.0306
Echinococcus multilocularis fibropellin Ia 0.0008 0.0032 0.0032
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.001 0.0048 0.0208
Brugia malayi hypothetical protein 0.0026 0.0211 0.0916
Loa Loa (eye worm) notch protein 0.0008 0.0032 0.0105
Loa Loa (eye worm) nuclear hormone receptor family member nhr-41 0.001 0.0048 0.0159
Echinococcus granulosus FTZ F1 alpha 0.001 0.0048 0.007
Brugia malayi ecdysteroid receptor 0.001 0.0048 0.0208
Trichomonas vaginalis sphingosine kinase, putative 0.0012 0.0066 0.1055
Brugia malayi Protein kinase domain containing protein 0.0157 0.156 0.6784
Echinococcus multilocularis proto oncogene serine:threonine protein kinase 0.0157 0.156 0.156
Loa Loa (eye worm) hypothetical protein 0.001 0.0048 0.0159
Loa Loa (eye worm) hypothetical protein 0.0012 0.0066 0.0219
Loa Loa (eye worm) hypothetical protein 0.0026 0.0211 0.0698
Schistosoma mansoni protein kinase 0.0168 0.1668 0.2423
Onchocerca volvulus Dual oxidase homolog 0.0026 0.0211 0.1171
Loa Loa (eye worm) hypothetical protein 0.0008 0.0032 0.0105
Loa Loa (eye worm) animal heme peroxidase 0.0026 0.0211 0.0698
Trichomonas vaginalis bmru protein, putative 0.0012 0.0066 0.1055
Echinococcus multilocularis histone lysine N methyltransferase MLL3 0.0009 0.0036 0.0036
Schistosoma mansoni notch 0.0008 0.0032 0.0046
Schistosoma mansoni transcription factor LCR-F1 0.0043 0.0392 0.057
Echinococcus multilocularis ceramide kinase 0.0012 0.0066 0.0066
Brugia malayi Nuclear hormone receptor family member nhr-3 0.001 0.0048 0.0208
Echinococcus granulosus neurogenic locus notch protein 0.0008 0.0032 0.0046
Echinococcus granulosus retinoic acid receptor rxr beta a 0.001 0.0048 0.007
Brugia malayi Eye-specific diacylglycerol kinase 0.0012 0.0066 0.0287
Loa Loa (eye worm) hypothetical protein 0.0049 0.0451 0.1493
Loa Loa (eye worm) hypothetical protein 0.001 0.0048 0.0159
Entamoeba histolytica hypothetical protein, conserved 0.0299 0.302 1
Echinococcus multilocularis protein jagged 2 0.0008 0.0032 0.0032
Echinococcus multilocularis transitional endoplasmic reticulum atpase 0.0057 0.0527 0.0527
Loa Loa (eye worm) nuclear hormone receptor family member nhr-1 0.001 0.0048 0.0159
Entamoeba histolytica hypothetical protein 0.0043 0.0392 0.1105
Brugia malayi Peroxidasin 0.0026 0.0211 0.0916
Echinococcus multilocularis Diacylglycerol kinase theta 0.0012 0.0066 0.0066
Plasmodium vivax cell division cycle protein 48 homologue, putative 0.0054 0.0497 0.3911
Schistosoma mansoni thyroid hormone receptor 0.001 0.0048 0.007
Trichomonas vaginalis spermatogenesis associated factor, putative 0.0057 0.0527 1
Brugia malayi Calcium binding EGF domain containing protein 0.0008 0.0032 0.0138
Echinococcus multilocularis Diacylglycerol kinase zeta 0.0012 0.0066 0.0066
Echinococcus granulosus mitogen activated protein kinase kinase kinase 0.0051 0.0466 0.0677
Echinococcus granulosus dnaJ subfamily B 0.0401 0.4059 0.5895
Brugia malayi Calcium binding EGF domain containing protein 0.0008 0.0032 0.0138
Schistosoma mansoni septate junction protein 0.0008 0.0032 0.0046
Brugia malayi Nuclear hormone receptor family member nhr-19 0.001 0.0048 0.0208
Loa Loa (eye worm) hypothetical protein 0.0008 0.0032 0.0105
Toxoplasma gondii diacylglycerol kinase, putative 0.0012 0.0066 0.0693
Schistosoma mansoni Pro-neuregulin-4 membrane-bound isoform (Pro-NRG4) [Contains: Neuregulin-4 (NRG-4)] 0.0008 0.0032 0.0046
Onchocerca volvulus Serine\/threonine protein kinase homolog 0.0157 0.156 1
Loa Loa (eye worm) CAMK/PIM protein kinase 0.0157 0.156 0.5165
Brugia malayi diacylglycerol kinase 0.0012 0.0066 0.0287
Brugia malayi EGF-like domain containing protein 0.0008 0.0032 0.0138
Onchocerca volvulus Ceramide kinase 1 homolog 0.0012 0.0066 0.0225
Trypanosoma cruzi Vacuolar sorting protein 39 domain 1/Vacuolar sorting protein 39 domain 2, putative 0.0049 0.0451 0.8939
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0007 0.0018 0.0026
Schistosoma mansoni protein kinase 0.0051 0.0466 0.0677
Echinococcus multilocularis MAP kinase activated protein kinase 2 0.0177 0.1768 0.1768
Trichomonas vaginalis 26S protease regulatory subunit S10b, putative 0.0013 0.0083 0.1394
Loa Loa (eye worm) STE/STE20/KHS protein kinase 0.0051 0.0466 0.1544
Plasmodium vivax cell division cycle ATPase, putative 0.002 0.0156 0.0821
Loa Loa (eye worm) hypothetical protein 0.0026 0.0211 0.0698
Brugia malayi hypothetical protein 0.0043 0.0392 0.1707
Brugia malayi Nuclear hormone receptor family member nhr-40 0.001 0.0048 0.0208
Schistosoma mansoni nuclear receptor 2DBD-gamma 0.001 0.0048 0.007
Loa Loa (eye worm) eye-specific diacylglycerol kinase 0.0012 0.0066 0.0219
Echinococcus granulosus protein jagged 1 0.0008 0.0032 0.0046
Schistosoma mansoni nuclear hormone receptor nor-1/nor-2 0.001 0.0048 0.007
Echinococcus granulosus ceramide kinase 0.0012 0.0066 0.0096
Trichomonas vaginalis diacylglycerol kinase, putative 0.0012 0.0066 0.1055
Loa Loa (eye worm) hypothetical protein 0.0008 0.0032 0.0105
Loa Loa (eye worm) follicle stimulating hormone receptor 0.0229 0.2299 0.7614
Brugia malayi EGF-like domain containing protein 0.0008 0.0032 0.0138
Loa Loa (eye worm) hypothetical protein 0.0026 0.0211 0.0698
Brugia malayi Nuclear hormone receptor family member nhr-31 0.001 0.0048 0.0208
Schistosoma mansoni FTZ-F1 nuclear receptor-like protein 0.001 0.0048 0.007
Loa Loa (eye worm) nuclear hormone receptor family member nhr-40 0.001 0.0048 0.0159
Echinococcus multilocularis microtubule associated protein 2 0.0676 0.6885 0.6885
Echinococcus granulosus neural cadherin 0.0008 0.0032 0.0046
Echinococcus multilocularis acylglycerol kinase, mitochondrial 0.0012 0.0066 0.0066
Entamoeba histolytica hypothetical protein 0.0043 0.0392 0.1105
Schistosoma mansoni slit 0.0008 0.0032 0.0046
Echinococcus multilocularis notch 0.0008 0.0032 0.0032
Echinococcus granulosus cpg binding protein 0.003 0.0252 0.0365
Schistosoma mansoni hypothetical protein 0.0008 0.0032 0.0046
Echinococcus multilocularis sphingosine kinase 1 0.0299 0.302 0.302
Schistosoma mansoni cpg binding protein 0.003 0.0252 0.0365
Echinococcus granulosus acylglycerol kinase mitochondrial 0.0012 0.0066 0.0096
Loa Loa (eye worm) CAMK/PIM protein kinase 0.0157 0.156 0.5165
Plasmodium vivax multidomain scavenger receptor, putative 0.0119 0.1167 1
Loa Loa (eye worm) hypothetical protein 0.0008 0.0032 0.0105
Brugia malayi Doublecortin family protein 0.0119 0.1167 0.5075
Onchocerca volvulus 0.0026 0.0211 0.1171
Echinococcus granulosus MAP kinase activated protein kinase 2 0.0177 0.1768 0.2568
Loa Loa (eye worm) hypothetical protein 0.0119 0.1167 0.3864
Loa Loa (eye worm) hypothetical protein 0.001 0.0048 0.0159
Onchocerca volvulus Peroxidasin homolog 0.0026 0.0211 0.1171
Echinococcus multilocularis Nuclear hormone receptor family member nhr 41 0.001 0.0048 0.0048
Loa Loa (eye worm) doublecortin family protein 0.0119 0.1167 0.3864
Giardia lamblia AAA family ATPase 0.0034 0.0294 1
Onchocerca volvulus 0.001 0.0048 0.0106
Onchocerca volvulus Chorion peroxidase homolog 0.0026 0.0211 0.1171
Schistosoma mansoni proteasome subunit alpha 6 (T01 family) 0.0012 0.0066 0.0096
Onchocerca volvulus 0.0119 0.1167 0.7429
Echinococcus granulosus delta-like protein 1 0.0008 0.0032 0.0046
Echinococcus granulosus nuclear receptor 2DBD gamma 0.001 0.0048 0.007
Schistosoma mansoni peroxidasin 0.0026 0.0211 0.0306
Loa Loa (eye worm) hypothetical protein 0.0026 0.0211 0.0698
Brugia malayi Nuclear hormone receptor family member nhr-25 0.001 0.0048 0.0208
Echinococcus granulosus Diacylglycerol kinase theta 0.0012 0.0066 0.0096
Schistosoma mansoni hypothetical protein 0.0008 0.0032 0.0046
Schistosoma mansoni serine/threonine protein kinase 0.0157 0.156 0.2265
Schistosoma mansoni lipoxygenase 0.0436 0.442 0.642
Schistosoma mansoni thyroid hormone receptor 0.001 0.0048 0.007
Echinococcus granulosus RUN 0.0119 0.1167 0.1695
Brugia malayi valosin containing protein 0.0033 0.0287 0.1246
Brugia malayi Nuclear hormone receptor family member nhr-1 0.001 0.0048 0.0208
Loa Loa (eye worm) hypothetical protein 0.0008 0.0032 0.0105
Schistosoma mansoni microtubule-associated protein tau 0.0676 0.6885 1
Loa Loa (eye worm) hypothetical protein 0.0008 0.0032 0.0105
Brugia malayi steroid hormone receptor 0.001 0.0048 0.0208
Loa Loa (eye worm) nuclear Hormone Receptor family member 0.001 0.0048 0.0159
Echinococcus multilocularis slit 2 protein 0.0008 0.0032 0.0032
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.001 0.0048 0.0048
Brugia malayi nuclear hormone receptor 0.001 0.0048 0.0208
Mycobacterium tuberculosis Putative conserved ATPase 0.0034 0.0294 0.077
Schistosoma mansoni loxhd1 0.0119 0.1167 0.1695
Loa Loa (eye worm) animal heme peroxidase 0.0026 0.0211 0.0698
Brugia malayi map kinase activated protein kinase protein 2 0.0177 0.1768 0.7689
Brugia malayi Calcium binding EGF domain containing protein 0.0008 0.0032 0.0138
Loa Loa (eye worm) hypothetical protein 0.0026 0.0211 0.0698
Echinococcus granulosus arachidonate 5 lipoxygenase 0.065 0.6617 0.9611
Echinococcus multilocularis cpg binding protein 0.003 0.0252 0.0252
Loa Loa (eye worm) hypothetical protein 0.0026 0.0211 0.0698
Brugia malayi Animal haem peroxidase family protein 0.0026 0.0211 0.0916
Loa Loa (eye worm) blistered cuticle protein 3 0.0026 0.0211 0.0698
Entamoeba histolytica cdc48-like protein, putative 0.0054 0.0497 0.1458
Echinococcus granulosus Polycystic kidney disease protein 0.0119 0.1167 0.1695
Schistosoma mansoni cpg binding protein 0.003 0.0252 0.0365
Loa Loa (eye worm) steroid hormone receptor 0.001 0.0048 0.0159
Echinococcus multilocularis Polycystic kidney disease protein 0.0119 0.1167 0.1167
Echinococcus granulosus Serine/threonine-protein kinase Genghis Khan 0.0051 0.0466 0.0677
Toxoplasma gondii diacylglycerol kinase catalytic domain-containing protein 0.0012 0.0066 0.0693
Echinococcus granulosus nuclear receptor 2DBD gamma 0.001 0.0048 0.007
Trichomonas vaginalis bmru protein, putative 0.0012 0.0066 0.1055
Schistosoma mansoni diacylglycerol kinase zeta iota 0.0012 0.0066 0.0096
Brugia malayi hypothetical protein 0.0012 0.0066 0.0287
Brugia malayi Transmembrane cell adhesion receptor mua-3 precursor, putative 0.0008 0.0032 0.0138
Schistosoma mansoni mitogen-activated protein kinase kinase kinase 3 mapkkk3 mekk3 0.0049 0.0451 0.0655
Loa Loa (eye worm) nuclear hormone receptor family member nhr-49 0.001 0.0048 0.0159
Brugia malayi GCC2 and GCC3 family protein 0.0008 0.0032 0.0138
Loa Loa (eye worm) animal heme peroxidase 0.0026 0.0211 0.0698
Echinococcus granulosus COUP TF:Svp nuclear hormone receptor 0.001 0.0048 0.007
Schistosoma mansoni hypothetical protein 0.0008 0.0032 0.0046
Brugia malayi diacylglycerol kinase 0.0012 0.0066 0.0287
Toxoplasma gondii diacylglycerol kinase accessory domain (presumed) domain-containing protein 0.0012 0.0066 0.0693
Toxoplasma gondii histone lysine methyltransferase SET1 0.0053 0.0493 0.9331
Trichomonas vaginalis conserved hypothetical protein 0.0012 0.0066 0.1055
Trichomonas vaginalis diacylglycerol kinase, putative 0.0012 0.0066 0.1055
Schistosoma mansoni mixed-lineage leukemia protein mll 0.006 0.0559 0.0812
Schistosoma mansoni hypothetical protein 0.0008 0.0032 0.0046
Echinococcus granulosus Vam6:Vps39 protein 0.0049 0.0451 0.0655
Schistosoma mansoni Tr4/Tr2 (homologue) 0.001 0.0048 0.007
Loa Loa (eye worm) hypothetical protein 0.0008 0.0032 0.0105
Brugia malayi notch-like transmembrane receptor 0.0008 0.0032 0.0138
Echinococcus multilocularis dnaJ subfamily B 0.0401 0.4059 0.4059
Schistosoma mansoni nuclear hormone receptor 0.001 0.0048 0.007
Brugia malayi Animal haem peroxidase family protein 0.0026 0.0211 0.0916
Onchocerca volvulus 0.0119 0.1167 0.7429
Loa Loa (eye worm) animal heme peroxidase 0.0026 0.0211 0.0698
Echinococcus multilocularis FTZ F1 alpha 0.001 0.0048 0.0048
Brugia malayi Animal haem peroxidase family protein 0.0026 0.0211 0.0916
Loa Loa (eye worm) STE/STE20/MSN protein kinase 0.0119 0.1164 0.3853
Echinococcus granulosus microtubule associated protein 2 0.0676 0.6885 1
Echinococcus granulosus FTZ F1 nuclear receptor protein 0.001 0.0048 0.007
Onchocerca volvulus 0.0026 0.0211 0.1171
Schistosoma mansoni retinoic acid receptor RXR 0.001 0.0048 0.007
Schistosoma mansoni cpg binding protein 0.0028 0.0235 0.0341
Brugia malayi Nuclear hormone receptor family member nhr-14 0.001 0.0048 0.0208
Echinococcus granulosus histone lysine N methyltransferase MLL3 0.0009 0.0036 0.0052
Echinococcus multilocularis 0.0119 0.1164 0.1164
Schistosoma mansoni sphingoid long chain base kinase 0.0299 0.302 0.4386
Onchocerca volvulus 0.0026 0.0211 0.1171
Brugia malayi Delta serrate ligand family protein 0.0008 0.0032 0.0138
Brugia malayi Temporarily assigned gene name protein 59 0.0049 0.0451 0.1961
Brugia malayi Steroid receptor seven-up type 2 0.001 0.0048 0.0208
Echinococcus multilocularis neurogenic locus notch protein 4 0.0008 0.0032 0.0032
Brugia malayi Animal haem peroxidase family protein 0.0026 0.0211 0.0916
Brugia malayi EGF-like domain containing protein 0.0008 0.0032 0.0138
Schistosoma mansoni laminin gamma-3 chain 0.0008 0.0032 0.0046
Brugia malayi EGF-like domain containing protein 0.0008 0.0032 0.0138
Echinococcus multilocularis neurogenic locus notch protein 0.0008 0.0032 0.0032
Schistosoma mansoni hypothetical protein 0.0008 0.0032 0.0046
Echinococcus granulosus proto oncogene serine:threonine protein kinase 0.0157 0.156 0.2265
Onchocerca volvulus Peroxidase homolog 0.0026 0.0211 0.1171
Brugia malayi EGF-like domain containing protein 0.0008 0.0032 0.0138
Schistosoma mansoni protein kinase 0.0119 0.1164 0.169
Echinococcus granulosus sphingosine kinase 1 0.0299 0.302 0.4386
Brugia malayi Blistered cuticle protein 3 0.0026 0.0211 0.0916
Onchocerca volvulus Peroxidase homolog 0.0026 0.0211 0.1171
Echinococcus granulosus neurogenic locus notch protein 0.0008 0.0032 0.0046
Brugia malayi Protein kinase domain containing protein 0.0051 0.0466 0.2029
Echinococcus granulosus lipoxygenase domain containing protein 0.0119 0.1167 0.1695
Onchocerca volvulus 0.0028 0.0235 0.1331
Echinococcus granulosus notch 0.0008 0.0032 0.0046
Loa Loa (eye worm) hypothetical protein 0.0008 0.0032 0.0105
Echinococcus multilocularis transitional endoplasmic reticulum atpase 0.0023 0.0186 0.0186
Trypanosoma cruzi Vacuolar sorting protein 39 domain 1/Vacuolar sorting protein 39 domain 2, putative 0.0049 0.0451 0.8939
Entamoeba histolytica transitional endoplasmic reticulum ATPase, putative 0.0054 0.0497 0.1458
Loa Loa (eye worm) hypothetical protein 0.0008 0.0032 0.0105
Brugia malayi follicle stimulating hormone receptor 0.0229 0.2299 1
Echinococcus granulosus protein jagged 1 0.0008 0.0032 0.0046
Loa Loa (eye worm) hypothetical protein 0.001 0.0048 0.0159
Echinococcus multilocularis FTZ F1 nuclear receptor protein 0.001 0.0048 0.0048
Echinococcus granulosus neurogenic locus notch protein 4 0.0008 0.0032 0.0046
Brugia malayi EGF-like domain containing protein 0.0008 0.0032 0.0138
Loa Loa (eye worm) hypothetical protein 0.0008 0.0032 0.0105
Loa Loa (eye worm) hypothetical protein 0.0008 0.0032 0.0105
Schistosoma mansoni hypothetical protein 0.0012 0.0066 0.0096
Schistosoma mansoni hypothetical protein 0.0401 0.4059 0.5895
Echinococcus granulosus neurogenic locus protein delta 0.0008 0.0032 0.0046
Loa Loa (eye worm) hypothetical protein 0.0299 0.302 1
Schistosoma mansoni coup transcription factor 0.001 0.0048 0.007
Schistosoma mansoni cell division control protein 48 aaa family protein 0.0023 0.0186 0.0271
Onchocerca volvulus Steroid hormone receptor family member cnr14 homolog 0.001 0.0048 0.0106
Echinococcus multilocularis peroxidasin 0.0026 0.0211 0.0211
Brugia malayi vesicle-fusing ATPase 0.0033 0.0287 0.1246
Mycobacterium ulcerans ATPase 0.0034 0.0294 0.077
Loa Loa (eye worm) hypothetical protein 0.0008 0.0032 0.0105
Loa Loa (eye worm) ceramide kinase 0.0012 0.0066 0.0219
Loa Loa (eye worm) Notch2 0.0008 0.0032 0.0105
Echinococcus granulosus serine:threonine protein kinase mig 15 0.0166 0.1653 0.24
Loa Loa (eye worm) hypothetical protein 0.001 0.0048 0.0159
Loa Loa (eye worm) hypothetical protein 0.0008 0.0032 0.0105
Schistosoma mansoni RAR-like nuclear receptor 0.001 0.0048 0.007
Echinococcus multilocularis mitogen activated protein kinase kinase kinase 0.0051 0.0466 0.0466
Brugia malayi photoreceptor-specific nuclear receptor 0.001 0.0048 0.0208
Mycobacterium tuberculosis Conserved protein 0.0299 0.302 1
Trichomonas vaginalis diacylglycerol kinase, zeta, iota, putative 0.0012 0.0066 0.1055
Loa Loa (eye worm) hypothetical protein 0.0033 0.0287 0.0949
Echinococcus multilocularis COUP TF:Svp nuclear hormone receptor 0.001 0.0048 0.0048
Schistosoma mansoni rap gtpase-activating protein 0.0049 0.0451 0.0655
Schistosoma mansoni steroid hormone receptor ad4bp 0.001 0.0048 0.007
Loa Loa (eye worm) hypothetical protein 0.0012 0.0066 0.0219
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.001 0.0048 0.0208
Trichomonas vaginalis proteasome-activating nucleotidase, putative 0.0013 0.0083 0.1394
Loa Loa (eye worm) hypothetical protein 0.0008 0.0032 0.0105
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.001 0.0048 0.0048
Loa Loa (eye worm) hypothetical protein 0.0166 0.1653 0.5473
Echinococcus multilocularis neural cadherin 0.0008 0.0032 0.0032
Schistosoma mansoni diacylglycerol kinase theta 0.0012 0.0066 0.0096
Schistosoma mansoni sphingosine kinase A B 0.0299 0.302 0.4386
Echinococcus multilocularis serine:threonine protein kinase MRCK beta 0.0051 0.0466 0.0466
Echinococcus granulosus protein kinase 0.0119 0.1164 0.169
Brugia malayi hypothetical protein 0.0049 0.0451 0.1961
Echinococcus granulosus lipoxygenase domain containing protein 0.0119 0.1167 0.1695
Trichomonas vaginalis sphingosine kinase, putative 0.0012 0.0066 0.1055
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0043 0.0392 0.057
Echinococcus multilocularis GTPase activating Rap:RanGAP domain 3 0.0049 0.0451 0.0451
Brugia malayi Nuclear hormone receptor family member nhr-25 0.001 0.0048 0.0208
Brugia malayi CXXC zinc finger family protein 0.0028 0.0235 0.1022
Schistosoma mansoni peroxidasin 0.0026 0.0211 0.0306
Brugia malayi hypothetical protein 0.0119 0.1167 0.5075
Echinococcus multilocularis ecdysone induced protein 78C 0.001 0.0048 0.0048
Schistosoma mansoni notch 0.0008 0.0032 0.0046
Loa Loa (eye worm) histone methyltransferase 0.0009 0.0036 0.0118
Echinococcus multilocularis protein jagged 1 0.0008 0.0032 0.0032
Entamoeba histolytica hypothetical protein 0.0043 0.0392 0.1105
Loa Loa (eye worm) hypothetical protein 0.0008 0.0032 0.0105
Loa Loa (eye worm) hypothetical protein 0.0049 0.0451 0.1493
Schistosoma mansoni rab6-interacting 0.0119 0.1167 0.1695
Schistosoma mansoni mitogen-activated protein kinase kinase kinase 3 mapkkk3 mekk3 0.0049 0.0451 0.0655
Loa Loa (eye worm) hypothetical protein 0.0026 0.0211 0.0698
Echinococcus multilocularis mixed lineage leukemia protein mll 0.0007 0.0018 0.0018
Brugia malayi Cadherin domain containing protein 0.0008 0.0032 0.0138
Echinococcus granulosus Nuclear hormone receptor family member nhr 41 0.001 0.0048 0.007
Brugia malayi EGF-like domain containing protein 0.0008 0.0032 0.0138
Echinococcus multilocularis histone lysine N methyltransferase MLL3 0.0007 0.0018 0.0018
Schistosoma mansoni cell division control protein 48 aaa family protein 0.0057 0.0527 0.0765
Echinococcus multilocularis thyroid hormone receptor alpha 0.001 0.0048 0.0048
Brugia malayi Nuclear hormone receptor-like 1 0.001 0.0048 0.0208
Schistosoma mansoni retinoid-x-receptor (RXR) 0.001 0.0048 0.007
Brugia malayi Diacylglycerol kinase protein 2 0.0012 0.0066 0.0287
Loa Loa (eye worm) vesicle-fusing ATPase 0.0033 0.0287 0.0949
Onchocerca volvulus Peroxidasin homolog 0.0026 0.0211 0.1171
Brugia malayi nuclear receptor NHR-88 0.001 0.0048 0.0208
Leishmania major Transitional endoplasmic reticulum ATPase, putative,valosin-containing protein homolog 0.0054 0.0497 1
Loa Loa (eye worm) hypothetical protein 0.001 0.0048 0.0159
Schistosoma mansoni polycystin 1-related 0.0119 0.1167 0.1695
Echinococcus multilocularis lipoxygenase domain containing protein 0.0119 0.1167 0.1167
Echinococcus granulosus Diacylglycerol kinase zeta 0.0012 0.0066 0.0096
Loa Loa (eye worm) hypothetical protein 0.0119 0.1167 0.3864
Echinococcus multilocularis neurogenic locus protein delta 0.0008 0.0032 0.0032
Schistosoma mansoni serine/threonine protein kinase 0.0051 0.0466 0.0677
Echinococcus multilocularis neurogenic locus protein delta 0.0008 0.0032 0.0032
Schistosoma mansoni lipoxygenase 0.065 0.6617 0.9611
Onchocerca volvulus Bile acid receptor homolog 0.001 0.0048 0.0106
Schistosoma mansoni cell division control protein 48 aaa family protein 0.0054 0.0497 0.0721
Loa Loa (eye worm) hypothetical protein 0.0008 0.0032 0.0105
Echinococcus granulosus GTPase activating Rap:RanGAP domain 3 0.0049 0.0451 0.0655
Echinococcus multilocularis fat cadherin tumor suppressor 0.0008 0.0032 0.0032
Schistosoma mansoni photoreceptor-specific nuclear receptor related 0.001 0.0048 0.007
Brugia malayi transitional endoplasmic reticulum ATPase TER94, putative 0.0023 0.0186 0.081
Brugia malayi Nuclear hormone receptor family member nhr-49 0.001 0.0048 0.0208
Loa Loa (eye worm) hypothetical protein 0.001 0.0048 0.0159
Echinococcus granulosus protein jagged 2 0.0008 0.0032 0.0046
Loa Loa (eye worm) hypothetical protein 0.0008 0.0032 0.0105
Echinococcus granulosus transitional endoplasmic reticulum atpase 0.0057 0.0527 0.0765
Loa Loa (eye worm) nuclear hormone receptor family member nhr-14 0.001 0.0048 0.0159
Brugia malayi hypothetical protein 0.0119 0.1167 0.5075
Loa Loa (eye worm) diacylglycerol kinase 2 0.0012 0.0066 0.0219
Loa Loa (eye worm) nuclear hormone receptor family member nhr-31 0.001 0.0048 0.0159
Entamoeba histolytica hypothetical protein 0.0043 0.0392 0.1105
Brugia malayi Nuclear hormone receptor family member nhr-19 0.001 0.0048 0.0208
Loa Loa (eye worm) hypothetical protein 0.0049 0.0451 0.1493
Onchocerca volvulus Transitional endoplasmic reticulum ATPase homolog 0.0057 0.0527 0.3238
Schistosoma mansoni hypothetical protein 0.0049 0.0451 0.0655
Echinococcus granulosus hepatocyte nuclear factor 4 alpha 0.001 0.0048 0.007
Trypanosoma cruzi Valosin-containing protein, putative 0.0054 0.0497 1
Echinococcus granulosus ecdysone induced protein 78C 0.001 0.0048 0.007
Schistosoma mansoni hypothetical protein 0.0008 0.0032 0.0046
Echinococcus granulosus mixed lineage leukemia protein mll 0.0007 0.0018 0.0026
Brugia malayi Cadherin domain containing protein 0.0008 0.0032 0.0138
Schistosoma mansoni notch 0.0008 0.0032 0.0046
Loa Loa (eye worm) CXXC zinc finger family protein 0.0028 0.0235 0.0778
Brugia malayi F/Y-rich N-terminus family protein 0.0009 0.0035 0.015
Mycobacterium ulcerans hypothetical protein 0.0299 0.302 1
Schistosoma mansoni notch 0.0008 0.0032 0.0046
Onchocerca volvulus Protein ultraspiracle homolog 0.001 0.0048 0.0106
Schistosoma mansoni diacylglycerol kinase theta 0.0012 0.0066 0.0096
Loa Loa (eye worm) hypothetical protein 0.0026 0.0211 0.0698
Loa Loa (eye worm) hypothetical protein 0.0026 0.0211 0.0698
Loa Loa (eye worm) hypothetical protein 0.0026 0.0211 0.0698
Echinococcus multilocularis arachidonate 5 lipoxygenase 0.065 0.6617 0.6617
Echinococcus multilocularis lipoxygenase domain containing protein 0.0119 0.1167 0.1167
Loa Loa (eye worm) hypothetical protein 0.0026 0.0211 0.0698
Schistosoma mansoni hypothetical protein 0.0043 0.0392 0.057
Brugia malayi Animal haem peroxidase family protein 0.0026 0.0211 0.0916
Brugia malayi Muscle positioning protein 4 0.0008 0.0032 0.0138
Loa Loa (eye worm) hypothetical protein 0.0026 0.0211 0.0698
Brugia malayi probable protein kinase 0.0168 0.1668 0.7256
Plasmodium falciparum LCCL domain-containing protein 0.0119 0.1167 1
Onchocerca volvulus 0.0049 0.0451 0.2744
Plasmodium falciparum cell division cycle protein 48 homologue, putative 0.0054 0.0497 0.3911
Echinococcus granulosus protein jagged 2 0.0008 0.0032 0.0046
Loa Loa (eye worm) hypothetical protein 0.0008 0.0032 0.0105
Loa Loa (eye worm) hypothetical protein 0.0008 0.0032 0.0105
Loa Loa (eye worm) camk/mapkapk/mapkapk protein kinase 0.0177 0.1768 0.5854
Loa Loa (eye worm) hypothetical protein 0.0026 0.0211 0.0698
Schistosoma mansoni serine/threonine protein kinase 0.0051 0.0466 0.0677
Loa Loa (eye worm) hypothetical protein 0.0012 0.0066 0.0219
Loa Loa (eye worm) hypothetical protein 0.0008 0.0032 0.0105

Activities

Activity type Activity value Assay description Source Reference
Potency (functional) 12.99 uM PUBCHEM_BIOASSAY: qHTS screen for small molecules that inhibit ELG1-dependent DNA repair in human embryonic kidney (HEK293T) cells expressing luciferase-tagged ELG1. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID493107, AID493125] ChEMBL. No reference
Potency (functional) 16.3601 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) 63.0957 uM PubChem BioAssay. qHTS Assay to Find Inhibitors of Pin1. (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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