Detailed information for compound 1419943

Basic information

Technical information
  • TDR Targets ID: 1419943
  • Name: N-(3-methoxyphenyl)-3-[(3-oxo-4H-1,4-benzoxaz in-6-yl)sulfonyl]butanamide
  • MW: 404.437 | Formula: C19H20N2O6S
  • H donors: 2 H acceptors: 4 LogP: 1.32 Rotable bonds: 7
    Rule of 5 violations (Lipinski): 1
  • SMILES: COc1cccc(c1)NC(=O)CC(S(=O)(=O)c1ccc2c(c1)NC(=O)CO2)C
  • InChi: 1S/C19H20N2O6S/c1-12(8-18(22)20-13-4-3-5-14(9-13)26-2)28(24,25)15-6-7-17-16(10-15)21-19(23)11-27-17/h3-7,9-10,12H,8,11H2,1-2H3,(H,20,22)(H,21,23)
  • InChiKey: GBQCEZHBJDLHOY-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • 3-[(3-keto-4H-1,4-benzoxazin-6-yl)sulfonyl]-N-(3-methoxyphenyl)butyramide
  • E667-1048
  • NCGC00124301-01

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens parathyroid hormone 1 receptor Starlite/ChEMBL No references
Homo sapiens thyroid hormone receptor, beta Starlite/ChEMBL No references
Homo sapiens ubiquitin specific peptidase 1 Starlite/ChEMBL No references
Equus caballus Ferritin light chain Starlite/ChEMBL No references

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Schistosoma japonicum expressed protein Get druggable targets OG5_134830 All targets in OG5_134830
Echinococcus multilocularis Mitotic checkpoint protein PRCC, C terminal Get druggable targets OG5_134830 All targets in OG5_134830
Schistosoma mansoni thyroid hormone receptor Get druggable targets OG5_134830 All targets in OG5_134830
Schistosoma japonicum Thyroid hormone receptor alpha, putative Get druggable targets OG5_134830 All targets in OG5_134830
Schistosoma mansoni hypothetical protein Get druggable targets OG5_134830 All targets in OG5_134830
Schistosoma japonicum Thyroid hormone receptor alpha, putative Get druggable targets OG5_134830 All targets in OG5_134830
Echinococcus granulosus Mitotic checkpoint protein PRCC C terminal Get druggable targets OG5_134830 All targets in OG5_134830
Schistosoma japonicum ko:K08362 nuclear receptor, subfamily 1, group A, member 2, putative Get druggable targets OG5_134830 All targets in OG5_134830
Schistosoma japonicum ko:K04588 secretin receptor, putative Get druggable targets OG5_139196 All targets in OG5_139196
Schistosoma mansoni thyroid hormone receptor Get druggable targets OG5_134830 All targets in OG5_134830
Echinococcus multilocularis thyroid hormone receptor alpha Get druggable targets OG5_134830 All targets in OG5_134830
By sequence similarity to non orthologous known druggable targets
Species Potential target Known druggable target Length Alignment span Identity
Schistosoma mansoni ferritin Ferritin light chain   175 aa 171 aa 43.9 %
Brugia malayi photoreceptor-specific nuclear receptor thyroid hormone receptor, beta 461 aa 414 aa 24.6 %
Schistosoma japonicum Ferritin, putative Ferritin light chain   175 aa 144 aa 24.3 %
Schistosoma mansoni apoferritin-2 Ferritin light chain   175 aa 146 aa 28.8 %
Echinococcus granulosus expressed protein Ferritin light chain   175 aa 146 aa 28.8 %
Schistosoma mansoni ferritin Ferritin light chain   175 aa 171 aa 44.4 %
Schistosoma mansoni apoferritin-2 Ferritin light chain   175 aa 142 aa 29.6 %
Echinococcus multilocularis expressed protein Ferritin light chain   175 aa 146 aa 30.1 %
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Schistosoma mansoni nuclear hormone receptor 0.0012 0.0122 0.0122
Loa Loa (eye worm) ATP-binding cassette sub-family B member 2 0.014 0.6926 0.6926
Echinococcus multilocularis ATP binding cassette subfamily B (MDR:TAP) 0.014 0.6926 0.6921
Entamoeba histolytica P-glycoprotein 6, putative 0.0044 0.1809 0.2526
Brugia malayi ABC transporter family protein 0.0044 0.1809 0.1809
Echinococcus multilocularis Mitotic checkpoint protein PRCC, C terminal 0.0152 0.7556 0.7551
Mycobacterium tuberculosis Probable transmembrane multidrug efflux pump 0.014 0.6926 1
Brugia malayi ABC transporter family protein 0.0044 0.1809 0.1809
Brugia malayi Nuclear hormone receptor family member nhr-31 0.0012 0.0122 0.0122
Loa Loa (eye worm) nuclear hormone receptor family member nhr-1 0.0012 0.0122 0.0122
Schistosoma mansoni ferritin light chain 0.001 0.0018 0.0018
Schistosoma mansoni RAR-like nuclear receptor 0.0012 0.0122 0.0122
Loa Loa (eye worm) hypothetical protein 0.0012 0.0122 0.0122
Brugia malayi ABC transporter family protein 0.014 0.6926 0.6926
Brugia malayi multidrug resistance protein 3 0.014 0.6926 0.6926
Toxoplasma gondii ABC transporter transmembrane region domain-containing protein 0.014 0.6926 1
Trichomonas vaginalis lipid A export ATP-binding/permease protein msba, putative 0.014 0.6926 1
Entamoeba histolytica P-glycoprotein-1 0.014 0.6926 1
Entamoeba histolytica P-glycoprotein 5, putative 0.014 0.6926 1
Schistosoma mansoni thyroid hormone receptor 0.0164 0.8204 0.8204
Giardia lamblia Multidrug resistance-associated protein 1 0.0044 0.1809 1
Trichomonas vaginalis multidrug resistance protein 1, 2, putative 0.0042 0.1722 0.2467
Echinococcus granulosus multidrug resistance associated protein 1 0.0044 0.1809 0.1795
Echinococcus multilocularis ecdysone induced protein 78C 0.0012 0.0122 0.0105
Schistosoma mansoni hypothetical protein 0.0019 0.0486 0.0486
Loa Loa (eye worm) hypothetical protein 0.0012 0.0122 0.0122
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.0019 0.0486 0.0486
Loa Loa (eye worm) steroid hormone receptor 0.0012 0.0122 0.0122
Brugia malayi ABC transporter family protein 0.0044 0.1809 0.1809
Loa Loa (eye worm) hypothetical protein 0.0019 0.0486 0.0486
Mycobacterium ulcerans transmembrane ABC transporter ATP-binding protein 0.0011 0.008 0.0347
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0012 0.0122 0.0122
Plasmodium vivax ABC transporter B family member 6, putative 0.0044 0.1809 0.2526
Loa Loa (eye worm) hypothetical protein 0.014 0.6926 0.6926
Mycobacterium ulcerans component linked with the assembly of cytochrome transport transmembrane ATP-binding protein ABC transporter CydD 0.0044 0.1809 1
Trichomonas vaginalis abcb9, putative 0.014 0.6926 1
Trichomonas vaginalis multidrug resistance protein 1, 2, putative 0.014 0.6926 1
Loa Loa (eye worm) hypothetical protein 0.0012 0.0122 0.0122
Trichomonas vaginalis ATP-binding cassette transporter, putative 0.0042 0.1722 0.2467
Brugia malayi photoreceptor-specific nuclear receptor 0.0012 0.0122 0.0122
Mycobacterium ulcerans drugs-transport transmembrane ATP-binding protein ABC transporter 0.0044 0.1809 1
Entamoeba histolytica P-glycoprotein-2, putative 0.014 0.6926 1
Brugia malayi Nuclear hormone receptor family member nhr-1 0.0012 0.0122 0.0122
Echinococcus multilocularis FTZ F1 alpha 0.0012 0.0122 0.0105
Brugia malayi steroid hormone receptor 0.0012 0.0122 0.0122
Echinococcus multilocularis cadherin EGF LAG seven pass G type receptor 0.0019 0.0486 0.0469
Echinococcus multilocularis multidrug resistance associated protein 1 0.0044 0.1809 0.1795
Schistosoma mansoni tar DNA-binding protein 0.0198 1 1
Brugia malayi Steroid receptor seven-up type 2 0.0012 0.0122 0.0122
Plasmodium falciparum ABC transporter B family member 6, putative 0.0044 0.1809 0.2526
Echinococcus granulosus ATP binding cassette sub family G 0.0011 0.008 0.0062
Loa Loa (eye worm) hypothetical protein 0.0044 0.1809 0.1809
Schistosoma mansoni smdr1 0.0044 0.1809 0.1809
Brugia malayi Nuclear hormone receptor family member nhr-3 0.0012 0.0122 0.0122
Schistosoma mansoni hypothetical protein 0.0019 0.0486 0.0486
Loa Loa (eye worm) hypothetical protein 0.0044 0.1809 0.1809
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0145 0.7167 0.7167
Trichomonas vaginalis multidrug resistance protein 1, 2, putative 0.014 0.6926 1
Brugia malayi Nuclear hormone receptor family member nhr-40 0.0012 0.0122 0.0122
Echinococcus granulosus ecdysone induced protein 78C 0.0012 0.0122 0.0105
Schistosoma mansoni multidrug resistance protein 0.0042 0.1722 0.1722
Schistosoma mansoni multidrug resistance protein 0.0044 0.1809 0.1809
Trichomonas vaginalis ABC transporter, putative 0.014 0.6926 1
Schistosoma mansoni multidrug resistance protein 0.0044 0.1809 0.1809
Brugia malayi multidrug resistance related protein 1 0.0044 0.1809 0.1809
Echinococcus granulosus multidrug resistance protein 1 0.014 0.6926 0.6921
Toxoplasma gondii ABC transporter transmembrane region domain-containing protein 0.0044 0.1809 0.2526
Brugia malayi Nuclear hormone receptor family member nhr-14 0.0012 0.0122 0.0122
Loa Loa (eye worm) pigment dispersing factor receptor c 0.006 0.2674 0.2674
Plasmodium falciparum multidrug resistance-associated protein 1 0.0044 0.1809 0.2526
Trichomonas vaginalis ABC transporter, putative 0.014 0.6926 1
Loa Loa (eye worm) nuclear Hormone Receptor family member 0.0012 0.0122 0.0122
Loa Loa (eye worm) hypothetical protein 0.0041 0.1661 0.1661
Mycobacterium leprae PROBABLE DRUGS-TRANSPORT TRANSMEMBRANE ATP-BINDING PROTEIN ABC TRANSPORTER 0.0044 0.1809 1
Echinococcus granulosus ATP binding cassette subfamily B MDR:TAP 0.014 0.6926 0.6921
Entamoeba histolytica P-glycoprotein-2, putative 0.0042 0.1722 0.2399
Echinococcus granulosus ATP binding cassette sub family G 0.0011 0.008 0.0062
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0145 0.7167 0.7167
Echinococcus granulosus multidrug resistance protein 1 0.0098 0.4678 0.4668
Mycobacterium ulcerans transmembrane ABC transporter ATP-binding protein 0.0011 0.008 0.0347
Trypanosoma cruzi multidrug resistance-associated protein, putative 0.0044 0.1809 1
Plasmodium vivax multidrug resistance-associated protein 1, putative 0.0044 0.1809 0.2526
Loa Loa (eye worm) latrophilin receptor protein 2 0.0019 0.0486 0.0486
Mycobacterium tuberculosis Probable drugs-transport transmembrane ATP-binding protein ABC transporter 0.0044 0.1809 0.2593
Trichomonas vaginalis taga, putative 0.014 0.6926 1
Loa Loa (eye worm) hypothetical protein 0.0012 0.0122 0.0122
Echinococcus granulosus COUP TF:Svp nuclear hormone receptor 0.0012 0.0122 0.0105
Loa Loa (eye worm) ABC transporter transmembrane region family protein 0.0044 0.1809 0.1809
Chlamydia trachomatis ABC transporter ATP binding protein/permease 0.014 0.6926 0.5
Brugia malayi hypothetical protein 0.0044 0.1809 0.1809
Loa Loa (eye worm) multidrug resistance protein 3 0.014 0.6926 0.6926
Echinococcus multilocularis ATP binding cassette sub family G 0.0011 0.008 0.0062
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0145 0.7167 0.7162
Toxoplasma gondii ATP-binding cassette transporter ABC.B1 0.014 0.6926 1
Brugia malayi P-glycoprotein-like protein 0.0044 0.1809 0.1809
Leishmania major p-glycoprotein 0.014 0.6926 1
Loa Loa (eye worm) hypothetical protein 0.014 0.6926 0.6926
Toxoplasma gondii ABC transporter transmembrane region domain-containing protein 0.0044 0.1809 0.2526
Schistosoma mansoni ferritin 0.001 0.0018 0.0018
Schistosoma mansoni tar DNA-binding protein 0.0198 1 1
Brugia malayi multidrug Resistance Protein family member (mrp-5), putative 0.0044 0.1809 0.1809
Echinococcus granulosus GPCR family 2 0.0019 0.0486 0.0469
Trichomonas vaginalis ATP-binding cassette transporter, putative 0.014 0.6926 1
Schistosoma mansoni nuclear receptor 2DBD-gamma 0.0012 0.0122 0.0122
Brugia malayi Nuclear hormone receptor-like 1 0.0012 0.0122 0.0122
Schistosoma mansoni Tr4/Tr2 (homologue) 0.0012 0.0122 0.0122
Plasmodium vivax ABC transporter B family member 5, putative 0.0044 0.1809 0.2526
Loa Loa (eye worm) hypothetical protein 0.0139 0.6839 0.6839
Brugia malayi ABC transporter 0.0042 0.1722 0.1722
Echinococcus granulosus ATP binding cassette subfamily B MDR:TAP 0.014 0.6926 0.6921
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0012 0.0122 0.0105
Trypanosoma cruzi ABC transporter of the mitochondrion, putative 0.0044 0.1809 1
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0012 0.0122 0.0105
Echinococcus multilocularis multidrug resistance protein 1 0.0098 0.4678 0.4668
Plasmodium vivax multidrug resistance protein 1, putative 0.014 0.6926 1
Echinococcus granulosus 5'partial|ATP binding cassette sub family B 0.0139 0.6839 0.6833
Brugia malayi ABC transporter transmembrane region family protein 0.0044 0.1809 0.1809
Trichomonas vaginalis lipid A export ATP-binding/permease protein msba, putative 0.0044 0.1809 0.2593
Schistosoma mansoni ATP-binding cassette sub-family B member 6 mitochondrial precursor (abc6) 0.0042 0.1722 0.1722
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0012 0.0122 0.0105
Toxoplasma gondii ABC transporter transmembrane region domain-containing protein 0.0044 0.1809 0.2526
Echinococcus multilocularis multidrug resistance protein 1 0.014 0.6926 0.6921
Echinococcus granulosus ATP binding cassette subfamily B MDR:TAP 0.014 0.6926 0.6921
Trichomonas vaginalis ATP-binding cassette transporter, putative 0.014 0.6926 1
Echinococcus granulosus Nuclear hormone receptor family member nhr 41 0.0012 0.0122 0.0105
Trichomonas vaginalis multidrug resistance protein 1, 2, putative 0.014 0.6926 1
Echinococcus multilocularis thyroid hormone receptor alpha 0.0164 0.8204 0.8201
Entamoeba histolytica ATP-binding cassette protein, putative 0.0044 0.1809 0.2526
Schistosoma mansoni multidrug resistance protein 0.014 0.6926 0.6926
Schistosoma mansoni photoreceptor-specific nuclear receptor related 0.0012 0.0122 0.0122
Echinococcus multilocularis ATP binding cassette sub family B 0.0044 0.1809 0.1795
Trichomonas vaginalis ATP-binding cassette transporter, putative 0.0042 0.1722 0.2467
Schistosoma mansoni steroid hormone receptor ad4bp 0.0012 0.0122 0.0122
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0012 0.0122 0.0122
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.0019 0.0486 0.0469
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0012 0.0122 0.0122
Schistosoma mansoni retinoid-x-receptor (RXR) 0.0012 0.0122 0.0122
Brugia malayi ecdysteroid receptor 0.0012 0.0122 0.0122
Toxoplasma gondii ABC transporter, putative 0.0044 0.1809 0.2526
Loa Loa (eye worm) TAR-binding protein 0.0198 1 1
Loa Loa (eye worm) hypothetical protein 0.0012 0.0122 0.0122
Entamoeba histolytica ATP-binding cassette protein, putative 0.0044 0.1809 0.2526
Trypanosoma brucei ABC transporter, mitochondrial, putative 0.0044 0.1809 1
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0012 0.0122 0.0105
Loa Loa (eye worm) nuclear hormone receptor family member nhr-31 0.0012 0.0122 0.0122
Mycobacterium ulcerans transmembrane ABC transporter ATP-binding protein 0.0044 0.1809 1
Trichomonas vaginalis abcb9, putative 0.014 0.6926 1
Plasmodium falciparum ABC transporter B family member 3, putative 0.0044 0.1809 0.2526
Brugia malayi nuclear hormone receptor 0.0012 0.0122 0.0122
Trichomonas vaginalis lipid A export ATP-binding/permease protein msba, putative 0.014 0.6926 1
Mycobacterium ulcerans transmembrane ABC transporter ATP-binding protein 0.0044 0.1809 1
Trichomonas vaginalis multidrug resistance protein 1, 2, putative 0.014 0.6926 1
Trichomonas vaginalis ATP-binding cassette transporter, putative 0.014 0.6926 1
Schistosoma mansoni hypothetical protein 0.0152 0.7556 0.7556
Schistosoma mansoni hypothetical protein 0.0019 0.0486 0.0486
Echinococcus multilocularis FTZ F1 nuclear receptor protein 0.0012 0.0122 0.0105
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0012 0.0122 0.0122
Echinococcus multilocularis multidrug resistance protein 1 0.014 0.6926 0.6921
Wolbachia endosymbiont of Brugia malayi ABC-type protease secretion system, ATPase and permease component, AprD 0.0044 0.1809 1
Schistosoma mansoni coup transcription factor 0.0012 0.0122 0.0122
Echinococcus multilocularis ATP binding cassette subfamily B (MDR:TAP) 0.014 0.6926 0.6921
Schistosoma mansoni apoferritin-2 0.001 0.0018 0.0018
Trypanosoma cruzi multidrug resistance-associated protein, putative 0.0044 0.1809 1
Echinococcus granulosus FTZ F1 nuclear receptor protein 0.0012 0.0122 0.0105
Loa Loa (eye worm) hypothetical protein 0.006 0.2674 0.2674
Entamoeba histolytica P-glyco protein 6, putative 0.014 0.6926 1
Schistosoma mansoni multidrug resistance protein 0.0044 0.1809 0.1809
Schistosoma mansoni ferritin 0.001 0.0018 0.0018
Trichomonas vaginalis multidrug resistance protein 1, 2, putative 0.014 0.6926 1
Schistosoma mansoni hypothetical protein 0.0019 0.0486 0.0486
Trichomonas vaginalis ATP-binding cassette transporter, putative 0.014 0.6926 1
Brugia malayi TAR-binding protein 0.0198 1 1
Echinococcus multilocularis ATP binding cassette sub family B 0.0044 0.1809 0.1795
Echinococcus multilocularis 0.0044 0.1809 0.1795
Schistosoma mansoni retinoic acid receptor RXR 0.0012 0.0122 0.0122
Toxoplasma gondii ABC transporter transmembrane region domain-containing protein 0.0044 0.1809 0.2526
Echinococcus multilocularis ATP binding cassette sub family G 0.0011 0.008 0.0062
Leishmania major ATP-binding cassette protein subfamily C, member 2, putative 0.0044 0.1809 0.2526
Schistosoma mansoni multidrug resistance protein 0.014 0.6926 0.6926
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.0019 0.0486 0.0469
Treponema pallidum bacterioferrin (TpF1) 0.001 0.0018 0.5
Trichomonas vaginalis conserved hypothetical protein 0.0042 0.1722 0.2467
Schistosoma mansoni ATP-binding cassette sub-family B member 7 mitochondrial precursor (abc7) 0.0044 0.1809 0.1809
Loa Loa (eye worm) nuclear hormone receptor family member nhr-40 0.0012 0.0122 0.0122
Brugia malayi RNA recognition motif domain containing protein 0.0198 1 1
Mycobacterium ulcerans transmembrane ABC transporter ATP-binding protein 0.0011 0.008 0.0347
Echinococcus granulosus Mitotic checkpoint protein PRCC C terminal 0.0152 0.7556 0.7551
Echinococcus multilocularis ATP binding cassette subfamily B (MDR:TAP) 0.014 0.6926 0.6921
Trypanosoma cruzi ABC transporter, mitochondrial, putative 0.0044 0.1809 1
Trypanosoma brucei ABC transporter of the mitochondrion, putative 0.0044 0.1809 1
Echinococcus granulosus multidrug resistance associated protein 7 0.0044 0.1809 0.1795
Plasmodium vivax multidrug resistance protein 2, putative 0.0044 0.1809 0.2526
Toxoplasma gondii ABC transporter transmembrane region domain-containing protein 0.0044 0.1809 0.2526
Entamoeba histolytica ABC transporter, putative 0.0044 0.1809 0.2526
Brugia malayi Latrophilin receptor protein 2 0.0019 0.0486 0.0486
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0012 0.0122 0.0122
Leishmania major ATP-binding cassette protein subfamily B, member 2, putative 0.014 0.6926 1
Brugia malayi latrophilin 2 splice variant baaae 0.0041 0.1661 0.1661
Schistosoma mansoni ferritin light chain 0.001 0.0018 0.0018
Schistosoma mansoni apoferritin-2 0.001 0.0018 0.0018
Brugia malayi Nuclear hormone receptor family member nhr-49 0.0012 0.0122 0.0122
Trichomonas vaginalis multidrug resistance protein 1, 2, putative 0.014 0.6926 1
Wolbachia endosymbiont of Brugia malayi ABC-type multidrug transport system, ATPase and permease component 0.0044 0.1809 1
Echinococcus multilocularis tar DNA binding protein 0.0198 1 1
Plasmodium falciparum ABC transporter B family member 5, putative 0.0044 0.1809 0.2526
Brugia malayi ABC transporter transmembrane region family protein 0.0044 0.1809 0.1809
Echinococcus granulosus ATP binding cassette sub family B 0.0044 0.1809 0.1795
Leishmania major ATP-binding cassette protein subfamily C, member 5, putative 0.0044 0.1809 0.2526
Trichomonas vaginalis lipid A export ATP-binding/permease protein msba, putative 0.014 0.6926 1
Trichomonas vaginalis ABC transporter, half transporter, putative 0.014 0.6926 1
Brugia malayi Nuclear hormone receptor family member nhr-41 0.0012 0.0122 0.0122
Loa Loa (eye worm) nuclear hormone receptor family member nhr-41 0.0012 0.0122 0.0122
Schistosoma mansoni multidrug resistance protein 0.0044 0.1809 0.1809
Schistosoma mansoni FTZ-F1 nuclear receptor-like protein 0.0012 0.0122 0.0122
Leishmania major ATP-binding cassette protein subfamily B, member 3, putative 0.0044 0.1809 0.2526
Toxoplasma gondii ATP-binding cassette sub-family B member 5 0.0044 0.1809 0.2526
Echinococcus granulosus ATP binding cassette sub family G 0.0011 0.008 0.0062
Echinococcus multilocularis GPCR, family 2 0.0019 0.0486 0.0469
Giardia lamblia ABC transporter, putative 0.0044 0.1809 1
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.0198 1 1
Echinococcus granulosus ATP binding cassette sub family B 0.0044 0.1809 0.1795
Trichomonas vaginalis lipid A export ATP-binding/permease protein msba, putative 0.014 0.6926 1
Schistosoma mansoni multidrug resistance protein 0.0044 0.1809 0.1809
Trichomonas vaginalis abcb9, putative 0.014 0.6926 1
Brugia malayi ABC transporter 0.0044 0.1809 0.1809
Entamoeba histolytica P-glycoprotein-2 0.014 0.6926 1
Loa Loa (eye worm) nuclear hormone receptor family member nhr-49 0.0012 0.0122 0.0122
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.006 0.2674 0.2674
Trichomonas vaginalis lipid A export ATP-binding/permease protein msba, putative 0.014 0.6926 1
Schistosoma mansoni nuclear hormone receptor nor-1/nor-2 0.0012 0.0122 0.0122
Schistosoma mansoni tar DNA-binding protein 0.0198 1 1
Schistosoma mansoni thyroid hormone receptor 0.0164 0.8204 0.8204
Giardia lamblia MRP-like ABC transporter 0.0044 0.1809 1
Entamoeba histolytica P-glycoprotein-2 0.014 0.6926 1
Schistosoma mansoni tar DNA-binding protein 0.0198 1 1
Plasmodium falciparum ABC transporter B family member 4, putative 0.0044 0.1809 0.2526
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0145 0.7167 0.7162
Leishmania major ATP-binding cassette protein subfamily B, member 1, putative 0.0044 0.1809 0.2526
Plasmodium falciparum multidrug resistance protein 2 0.0044 0.1809 0.2526
Leishmania major ABC-thiol transporter 0.0044 0.1809 0.2526
Trypanosoma brucei multidrug resistance protein E 0.0044 0.1809 1
Entamoeba histolytica multidrug resistance protein, putative 0.0044 0.1809 0.2526
Leishmania major ATP-binding cassette protein subfamily C, member 1, putative 0.0044 0.1809 0.2526
Trypanosoma brucei p-glycoprotein 0.0044 0.1809 1
Loa Loa (eye worm) hypothetical protein 0.0044 0.1809 0.1809
Loa Loa (eye worm) hypothetical protein 0.0042 0.1722 0.1722
Echinococcus multilocularis ATP binding cassette sub family B 0.0139 0.6839 0.6833
Trichomonas vaginalis lipid A export ATP-binding/permease protein msba, putative 0.014 0.6926 1
Brugia malayi Calcitonin receptor-like protein seb-1 0.006 0.2674 0.2674
Schistosoma mansoni tar DNA-binding protein 0.0198 1 1
Trypanosoma cruzi multidrug resistance protein E, putative 0.0044 0.1809 1
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0145 0.7167 0.7167
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0012 0.0122 0.0122
Trichomonas vaginalis ABC transporter, putative 0.014 0.6926 1
Brugia malayi nuclear receptor NHR-88 0.0012 0.0122 0.0122
Entamoeba histolytica ATP-binding cassette protein, putative 0.0044 0.1809 0.2526
Loa Loa (eye worm) hypothetical protein 0.0012 0.0122 0.0122
Plasmodium vivax ABC transporter B family member 4, putative 0.0044 0.1809 0.2526
Plasmodium falciparum multidrug resistance protein 1 0.014 0.6926 1
Loa Loa (eye worm) RNA binding protein 0.0198 1 1
Schistosoma mansoni hypothetical protein 0.0041 0.1661 0.1661
Toxoplasma gondii ABC transporter transmembrane region domain-containing protein 0.0044 0.1809 0.2526
Leishmania major ATP-binding cassette protein subfamily C, member 6, putative 0.0044 0.1809 0.2526
Leishmania major p-glycoprotein e 0.0044 0.1809 0.2526
Echinococcus granulosus multidrug resistance protein 1 0.014 0.6926 0.6921
Plasmodium vivax multidrug resistance-associated protein 2, putative 0.0044 0.1809 0.2526
Echinococcus granulosus hepatocyte nuclear factor 4 alpha 0.0012 0.0122 0.0105
Echinococcus granulosus ATP binding cassette subfamily B MDR:TAP 0.014 0.6926 0.6921
Plasmodium falciparum ABC transporter B family member 7, putative 0.0044 0.1809 0.2526
Toxoplasma gondii ABC transporter family protein 0.0044 0.1809 0.2526
Mycobacterium tuberculosis Iron-regulated transporter IrtA 0.0044 0.1809 0.2593
Echinococcus granulosus tar DNA binding protein 0.0198 1 1
Trichomonas vaginalis lipid A export ATP-binding/permease protein msba, putative 0.014 0.6926 1
Plasmodium vivax ABC transporter B family member 7, putative 0.0044 0.1809 0.2526
Schistosoma mansoni smdr2 0.014 0.6926 0.6926
Echinococcus multilocularis ATP binding cassette sub family G 0.0011 0.008 0.0062
Trypanosoma brucei multidrug resistance-associated protein, putative 0.0044 0.1809 1
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0145 0.7167 0.7162
Echinococcus granulosus multidrug resistance protein 1 0.014 0.6926 0.6921
Schistosoma mansoni ATP-binding cassette sub-family g2 (white protein) (abcg2) 0.0011 0.008 0.008
Schistosoma mansoni ferritin 0.001 0.0018 0.0018
Loa Loa (eye worm) ABC transporter 0.0044 0.1809 0.1809
Echinococcus multilocularis ATP binding cassette subfamily B (MDR:TAP) 0.014 0.6926 0.6921
Trichomonas vaginalis ABC transporter, putative 0.014 0.6926 1
Schistosoma mansoni multidrug resistance protein 0.014 0.6926 0.6926
Loa Loa (eye worm) ABC transporter 0.0044 0.1809 0.1809
Echinococcus granulosus multidrug resistance protein 1 0.0098 0.4678 0.4668
Echinococcus multilocularis COUP TF:Svp nuclear hormone receptor 0.0012 0.0122 0.0105
Echinococcus granulosus retinoic acid receptor rxr beta a 0.0012 0.0122 0.0105
Loa Loa (eye worm) hypothetical protein 0.0012 0.0122 0.0122
Loa Loa (eye worm) nuclear hormone receptor family member nhr-14 0.0012 0.0122 0.0122
Mycobacterium ulcerans transmembrane ABC transporter ATP-binding protein 0.0044 0.1809 1
Plasmodium falciparum multidrug resistance-associated protein 2 0.0044 0.1809 0.2526
Echinococcus granulosus FTZ F1 alpha 0.0012 0.0122 0.0105
Trichomonas vaginalis multidrug resistance protein 1, 2, putative 0.014 0.6926 1
Entamoeba histolytica P-glycoprotein 5, putative 0.0042 0.1722 0.2399
Brugia malayi ABC transporter transmembrane region family protein 0.0042 0.1722 0.1722
Trichomonas vaginalis lipid A export ATP-binding/permease protein msba, putative 0.014 0.6926 1
Leishmania major ATP-binding cassette protein subfamily C, member 8, putative 0.0044 0.1809 0.2526
Echinococcus granulosus cadherin EGF LAG seven pass G type receptor 0.0019 0.0486 0.0469
Leishmania major pentamidine resistance protein 1 0.0044 0.1809 0.2526
Loa Loa (eye worm) hypothetical protein 0.0042 0.1722 0.1722
Echinococcus granulosus ATP binding cassette sub family B 0.0042 0.1722 0.1707
Trichomonas vaginalis ATP-binding cassette transporter, putative 0.014 0.6926 1
Echinococcus multilocularis ATP binding cassette sub family B 0.0044 0.1809 0.1795
Echinococcus multilocularis ATP binding cassette sub family B 0.0044 0.1809 0.1795
Schistosoma mansoni ferritin 0.001 0.0018 0.0018
Loa Loa (eye worm) ABC transporter 0.0044 0.1809 0.1809
Trypanosoma brucei multidrug resistance-associated protein, putative 0.0044 0.1809 1
Echinococcus multilocularis Nuclear hormone receptor family member nhr 41 0.0012 0.0122 0.0105
Entamoeba histolytica hypothetical protein 0.0044 0.1809 0.2526
Plasmodium vivax ABC transporter B family member 3, putative 0.0044 0.1809 0.2526
Echinococcus multilocularis multidrug resistance associated protein 7 0.0044 0.1809 0.1795
Trichomonas vaginalis ATP-binding cassette transporter, putative 0.0098 0.4678 0.6745
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0145 0.7167 0.7167
Echinococcus multilocularis ATP binding cassette subfamily B (MDR:TAP) 0.014 0.6926 0.6921
Entamoeba histolytica ATP-binding cassette protein, putative 0.0044 0.1809 0.2526
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0145 0.7167 0.7167
Loa Loa (eye worm) hypothetical protein 0.0012 0.0122 0.0122
Echinococcus multilocularis hepatocyte nuclear factor 4 alpha 0.0012 0.0122 0.0105
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0145 0.7167 0.7162
Onchocerca volvulus 0.014 0.6926 1
Mycobacterium leprae PROBABLE DRUGS-TRANSPORT TRANSMEMBRANE ATP-BINDING PROTEIN ABC TRANSPORTER 0.0044 0.1809 1
Entamoeba histolytica P-glycoprotein 6, putative 0.0044 0.1809 0.2526
Trichomonas vaginalis ABC transporter, half transporter, putative 0.014 0.6926 1
Giardia lamblia Multidrug resistance-associated protein 1 0.0044 0.1809 1
Entamoeba histolytica P-glycoprotein-5 0.014 0.6926 1

Activities

Activity type Activity value Assay description Source Reference
Potency (functional) 3.9811 uM PubChem BioAssay. Inhibitors of USP1/UAF1: Primary Screen. (Class of assay: confirmatory) ChEMBL. No reference
Potency (binding) = 11.2202 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) 17.7828 uM PubChem BioAssay. qHTS of PTHR Inhibitors: Primary Screen. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) = 19.9526 um PUBCHEM_BIOASSAY: Total Fluorescence Counterscreen for Inhibitors of the Interaction of Thyroid Hormone Receptor and Steroid Receptor Coregulator 2. (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.
 
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External resources for this compound

Bibliographic References

No literature references available for this target.

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