Detailed information for compound 524516

Basic information

Technical information
  • TDR Targets ID: 524516
  • Name: (5E)-5-[(4-dimethylaminophenyl)methylidene]-2 -(4-methoxyanilino)-1,3-thiazol-4-one
  • MW: 353.438 | Formula: C19H19N3O2S
  • H donors: 1 H acceptors: 1 LogP: 4.13 Rotable bonds: 4
    Rule of 5 violations (Lipinski): 1
  • SMILES: COc1ccc(cc1)N=C1S/C(=C/c2ccc(cc2)N(C)C)/C(=O)N1
  • InChi: 1S/C19H19N3O2S/c1-22(2)15-8-4-13(5-9-15)12-17-18(23)21-19(25-17)20-14-6-10-16(24-3)11-7-14/h4-12H,1-3H3,(H,20,21,23)/b17-12+
  • InChiKey: FVZRWFFFQHNCRW-SFQUDFHCSA-N  


Substructure search Similarity search

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Synonyms

  • (5E)-5-[(4-dimethylaminophenyl)methylene]-2-(4-methoxyanilino)thiazol-4-one
  • (5E)-5-[(4-dimethylaminophenyl)methylene]-2-(4-methoxyanilino)-4-thiazolone
  • (5E)-5-[(4-dimethylaminophenyl)methylidene]-2-[(4-methoxyphenyl)amino]-1,3-thiazol-4-one
  • (5E)-5-[4-(dimethylamino)benzylidene]-2-(p-anisidino)-2-thiazolin-4-one
  • 5-[(4-dimethylaminophenyl)methylidene]-2-[(4-methoxyphenyl)amino]-1,3-thiazol-4-one
  • (5E)-5-[(4-dimethylaminophenyl)methylene]-2-[(4-methoxyphenyl)amino]thiazol-4-one
  • 5-[(4-dimethylaminophenyl)methylene]-2-[(4-methoxyphenyl)amino]thiazol-4-one
  • (5E)-5-[(4-dimethylaminophenyl)methylene]-2-[(4-methoxyphenyl)amino]-4-thiazolone
  • 5-[(4-dimethylaminophenyl)methylene]-2-[(4-methoxyphenyl)amino]-4-thiazolone
  • (5E)-5-(4-dimethylaminobenzylidene)-2-[(4-methoxyphenyl)amino]thiazol-4-one
  • 5-(4-dimethylaminobenzylidene)-2-[(4-methoxyphenyl)amino]thiazol-4-one
  • ChemDivAM_000511
  • T0506-2355
  • ZINC01469690
  • CBMicro_040413
  • ChemDiv1_011492
  • AG-205/11945016
  • ZINC01023407
  • ZINC04468414
  • A1801/0076160

Targets

Known targets for this compound

No curated genes were found associated with this compound

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
Trichomonas vaginalis ATP-binding cassette transporter, putative 0.00572203 0.259962 0.953516
Trypanosoma cruzi multidrug resistance-associated protein, putative 0.00120498 0.0541513 0.198622
Echinococcus granulosus ATP binding cassette subfamily B MDR:TAP 0.00572203 0.259962 0.259962
Echinococcus granulosus eukaryotic initiation factor 4A 0.00600017 0.272635 0.272635
Plasmodium vivax multidrug resistance protein 1, putative 0.00572203 0.259962 0.953516
Schistosoma mansoni multidrug resistance protein 0.00572203 0.259962 0.953516
Echinococcus multilocularis ATP binding cassette sub family B 0.00570554 0.259211 0.259211
Schistosoma mansoni multidrug resistance protein 0.00572203 0.259962 0.953516
Brugia malayi ABC transporter transmembrane region family protein 0.00118849 0.0534001 0.195867
Mycobacterium ulcerans drugs-transport transmembrane ATP-binding protein ABC transporter 0.00120498 0.0541513 1
Plasmodium falciparum multidrug resistance protein 2 0.00120498 0.0541513 0.198622
Brugia malayi multidrug resistance protein 3 0.00572203 0.259962 0.953516
Entamoeba histolytica P-glycoprotein 6, putative 0.00120498 0.0541513 0.198622
Trichomonas vaginalis abcb9, putative 0.00572203 0.259962 0.953516
Toxoplasma gondii ABC transporter transmembrane region domain-containing protein 0.00120498 0.0541513 0.198622
Plasmodium falciparum ABC transporter B family member 6, putative 0.00120498 0.0541513 0.198622
Plasmodium falciparum ABC transporter B family member 5, putative 0.00120498 0.0541513 0.198622
Brugia malayi hypothetical protein 0.00120498 0.0541513 0.198622
Trichomonas vaginalis abcb9, putative 0.00572203 0.259962 0.953516
Schistosoma mansoni smdr2 0.00572203 0.259962 0.953516
Echinococcus granulosus 5'partial|ATP binding cassette sub family B 0.00570554 0.259211 0.259211
Echinococcus granulosus ATP binding cassette sub family B 0.00120498 0.0541513 0.0541513
Trichomonas vaginalis multidrug resistance protein 1, 2, putative 0.00572203 0.259962 0.953516
Toxoplasma gondii ABC transporter transmembrane region domain-containing protein 0.00120498 0.0541513 0.198622
Brugia malayi ABC transporter family protein 0.00120498 0.0541513 0.198622
Loa Loa (eye worm) hypothetical protein 0.00120498 0.0541513 0.198622
Trichomonas vaginalis ABC transporter, putative 0.00572203 0.259962 0.953516
Trichomonas vaginalis conserved hypothetical protein 0.00118849 0.0534001 0.195867
Giardia lamblia Multidrug resistance-associated protein 1 0.00120498 0.0541513 0.198622
Leishmania major ATP-binding cassette protein subfamily C, member 6, putative 0.00120498 0.0541513 0.198622
Loa Loa (eye worm) ABC transporter 0.00120498 0.0541513 0.198622
Toxoplasma gondii ABC transporter family protein 0.00120498 0.0541513 0.198622
Brugia malayi ABC transporter 0.00118849 0.0534001 0.195867
Trypanosoma brucei Eukaryotic initiation factor 4A-1 0.00600017 0.272635 1
Echinococcus multilocularis multidrug resistance protein 1 0.00572203 0.259962 0.259962
Schistosoma mansoni multidrug resistance protein 0.00572203 0.259962 0.953516
Plasmodium falciparum multidrug resistance-associated protein 2 0.00120498 0.0541513 0.198622
Plasmodium falciparum ABC transporter B family member 7, putative 0.00120498 0.0541513 0.198622
Echinococcus granulosus death domain containing protein 0.00106957 0.0479817 0.0479817
Trichomonas vaginalis ATP-binding cassette transporter, putative 0.00572203 0.259962 0.953516
Giardia lamblia Translation initiation factor eIF-4A, putative 0.00600017 0.272635 1
Wolbachia endosymbiont of Brugia malayi ABC-type multidrug transport system, ATPase and permease component 0.00120498 0.0541513 1
Trichomonas vaginalis ATP-binding cassette transporter, putative 0.00572203 0.259962 0.953516
Schistosoma mansoni DEAD box ATP-dependent RNA helicase 0.00600017 0.272635 1
Entamoeba histolytica ATP-binding cassette protein, putative 0.00120498 0.0541513 0.198622
Toxoplasma gondii ATP-binding cassette transporter ABC.B1 0.00572203 0.259962 0.953516
Toxoplasma gondii ABC transporter transmembrane region domain-containing protein 0.00120498 0.0541513 0.198622
Loa Loa (eye worm) hypothetical protein 0.00107315 0.048145 0.176591
Trichomonas vaginalis ATP-binding cassette transporter, putative 0.00572203 0.259962 0.953516
Schistosoma mansoni hypothetical protein 0.00106957 0.0479817 0.175992
Echinococcus granulosus multidrug resistance protein 1 0.00572203 0.259962 0.259962
Entamoeba histolytica P-glycoprotein-1 0.00572203 0.259962 0.953516
Echinococcus granulosus multidrug resistance protein 1 0.00453353 0.205811 0.205811
Echinococcus granulosus ankyrin repeat and death domain containing protein 0.00106957 0.0479817 0.0479817
Onchocerca volvulus Netrin receptor homolog 0.00106957 0.0479817 0.175992
Brugia malayi multidrug Resistance Protein family member (mrp-5), putative 0.00120498 0.0541513 0.198622
Echinococcus granulosus eukaryotic initiation factor 4A III 0.00600017 0.272635 0.272635
Entamoeba histolytica P-glycoprotein 5, putative 0.00572203 0.259962 0.953516
Echinococcus granulosus ATP binding cassette subfamily B MDR:TAP 0.00572203 0.259962 0.259962
Schistosoma mansoni multidrug resistance protein 0.00120498 0.0541513 0.198622
Toxoplasma gondii ABC transporter transmembrane region domain-containing protein 0.00120498 0.0541513 0.198622
Plasmodium falciparum eukaryotic initiation factor 4A 0.00600017 0.272635 1
Echinococcus multilocularis multidrug resistance associated protein 1 0.00120498 0.0541513 0.0541513
Giardia lamblia Multidrug resistance-associated protein 1 0.00120498 0.0541513 0.198622
Trypanosoma cruzi ABC transporter of the mitochondrion, putative 0.00120498 0.0541513 0.198622
Plasmodium vivax multidrug resistance-associated protein 2, putative 0.00120498 0.0541513 0.198622
Entamoeba histolytica P-glycoprotein 6, putative 0.00120498 0.0541513 0.198622
Mycobacterium tuberculosis Probable drugs-transport transmembrane ATP-binding protein ABC transporter 0.00120498 0.0541513 0.198622
Schistosoma mansoni netrin receptor unc5 0.00106957 0.0479817 0.175992
Plasmodium vivax ABC transporter B family member 3, putative 0.00120498 0.0541513 0.198622
Echinococcus multilocularis ATP binding cassette sub family B 0.00120498 0.0541513 0.0541513
Trichomonas vaginalis multidrug resistance protein 1, 2, putative 0.00572203 0.259962 0.953516
Echinococcus multilocularis ATP binding cassette subfamily B (MDR:TAP) 0.00572203 0.259962 0.259962
Trypanosoma brucei ABC transporter of the mitochondrion, putative 0.00120498 0.0541513 0.198622
Plasmodium falciparum ABC transporter B family member 4, putative 0.00120498 0.0541513 0.198622
Echinococcus multilocularis multidrug resistance protein 1 0.00453353 0.205811 0.205811
Mycobacterium ulcerans transmembrane ABC transporter ATP-binding protein 0.00120498 0.0541513 1
Echinococcus multilocularis multidrug resistance associated protein 7 0.00120498 0.0541513 0.0541513
Loa Loa (eye worm) ABC transporter transmembrane region family protein 0.00120498 0.0541513 0.198622
Entamoeba histolytica ABC transporter, putative 0.00120498 0.0541513 0.198622
Echinococcus multilocularis eukaryotic initiation factor 4A 0.00600017 0.272635 0.272635
Plasmodium vivax ABC transporter B family member 7, putative 0.00120498 0.0541513 0.198622
Echinococcus granulosus nuclear factor of activated T cells 5 0.0219641 1 1
Mycobacterium tuberculosis Probable transmembrane multidrug efflux pump 0.00572203 0.259962 0.953516
Echinococcus granulosus ATP binding cassette subfamily B MDR:TAP 0.00572203 0.259962 0.259962
Loa Loa (eye worm) hypothetical protein 0.00120498 0.0541513 0.198622
Echinococcus granulosus ATP binding cassette sub family B 0.00118849 0.0534001 0.0534001
Schistosoma mansoni ATP-binding cassette sub-family B member 7 mitochondrial precursor (abc7) 0.00120498 0.0541513 0.198622
Toxoplasma gondii ABC transporter transmembrane region domain-containing protein 0.00120498 0.0541513 0.198622
Onchocerca volvulus 0.00572203 0.259962 0.953516
Trichomonas vaginalis ATP-binding cassette transporter, putative 0.00453353 0.205811 0.754894
Trichomonas vaginalis multidrug resistance protein 1, 2, putative 0.00572203 0.259962 0.953516
Leishmania major ATP-binding cassette protein subfamily B, member 2, putative 0.00572203 0.259962 0.953516
Echinococcus multilocularis multidrug resistance protein 1 0.00572203 0.259962 0.259962
Echinococcus multilocularis ATP binding cassette subfamily B (MDR:TAP) 0.00572203 0.259962 0.259962
Loa Loa (eye worm) ATP-binding cassette sub-family B member 2 0.00572203 0.259962 0.953516
Mycobacterium ulcerans transmembrane ABC transporter ATP-binding protein 0.00120498 0.0541513 1
Entamoeba histolytica P-glycoprotein-2, putative 0.00572203 0.259962 0.953516
Toxoplasma gondii ABC transporter transmembrane region domain-containing protein 0.00572203 0.259962 0.953516
Trypanosoma cruzi Eukaryotic initiation factor 4A-1 0.00600017 0.272635 1
Echinococcus multilocularis Ankyrin 0.00107315 0.048145 0.048145
Leishmania major ATP-binding cassette protein subfamily C, member 8, putative 0.00120498 0.0541513 0.198622
Toxoplasma gondii eukaryotic initiation factor-4A, putative 0.00600017 0.272635 1
Trichomonas vaginalis ABC transporter, half transporter, putative 0.00572203 0.259962 0.953516
Schistosoma mansoni multidrug resistance protein 0.00118849 0.0534001 0.195867
Leishmania major ATP-binding cassette protein subfamily C, member 1, putative 0.00120498 0.0541513 0.198622
Brugia malayi ABC transporter transmembrane region family protein 0.00120498 0.0541513 0.198622
Leishmania major ATP-binding cassette protein subfamily B, member 3, putative 0.00120498 0.0541513 0.198622
Echinococcus granulosus ATP binding cassette subfamily B MDR:TAP 0.00572203 0.259962 0.259962
Trypanosoma brucei multidrug resistance-associated protein, putative 0.00120498 0.0541513 0.198622
Echinococcus granulosus multidrug resistance associated protein 7 0.00120498 0.0541513 0.0541513
Echinococcus granulosus Ankyrin 0.00107315 0.048145 0.048145
Loa Loa (eye worm) ABC transporter 0.00120498 0.0541513 0.198622
Trichomonas vaginalis lipid A export ATP-binding/permease protein msba, putative 0.00572203 0.259962 0.953516
Echinococcus granulosus netrin receptor unc 5 0.00106957 0.0479817 0.0479817
Loa Loa (eye worm) hypothetical protein 0.00572203 0.259962 0.953516
Trichomonas vaginalis lipid A export ATP-binding/permease protein msba, putative 0.00572203 0.259962 0.953516
Loa Loa (eye worm) multidrug resistance protein 3 0.00572203 0.259962 0.953516
Trypanosoma cruzi Eukaryotic initiation factor 4A-1 0.00600017 0.272635 1
Leishmania major p-glycoprotein 0.00572203 0.259962 0.953516
Trypanosoma brucei multidrug resistance protein E 0.00120498 0.0541513 0.198622
Trypanosoma cruzi multidrug resistance-associated protein, putative 0.00120498 0.0541513 0.198622
Trichomonas vaginalis ABC transporter, putative 0.00572203 0.259962 0.953516
Leishmania major ATP-binding cassette protein subfamily B, member 1, putative 0.00120498 0.0541513 0.198622
Loa Loa (eye worm) hypothetical protein 0.00570554 0.259211 0.95076
Echinococcus granulosus ATP binding cassette sub family B 0.00120498 0.0541513 0.0541513
Trichomonas vaginalis multidrug resistance protein 1, 2, putative 0.00572203 0.259962 0.953516
Trichomonas vaginalis multidrug resistance protein 1, 2, putative 0.00572203 0.259962 0.953516
Entamoeba histolytica P-glycoprotein-5 0.00572203 0.259962 0.953516
Onchocerca volvulus Eukaryotic initiation factor 4A homolog 0.00600017 0.272635 1
Leishmania major eukaryotic initiation factor 4a, putative 0.00600017 0.272635 1
Entamoeba histolytica P-glycoprotein-2 0.00572203 0.259962 0.953516
Mycobacterium leprae PROBABLE DRUGS-TRANSPORT TRANSMEMBRANE ATP-BINDING PROTEIN ABC TRANSPORTER 0.00120498 0.0541513 1
Trichomonas vaginalis lipid A export ATP-binding/permease protein msba, putative 0.00572203 0.259962 0.953516
Brugia malayi ABC transporter family protein 0.00572203 0.259962 0.953516
Entamoeba histolytica hypothetical protein 0.00120498 0.0541513 0.198622
Trichomonas vaginalis ATP-binding cassette transporter, putative 0.00572203 0.259962 0.953516
Entamoeba histolytica ATP-binding cassette protein, putative 0.00120498 0.0541513 0.198622
Brugia malayi ABC transporter family protein 0.00120498 0.0541513 0.198622
Entamoeba histolytica DEAD/DEAH box helicase, putative 0.00600017 0.272635 1
Mycobacterium tuberculosis Iron-regulated transporter IrtA 0.00120498 0.0541513 0.198622
Plasmodium vivax ABC transporter B family member 5, putative 0.00120498 0.0541513 0.198622
Schistosoma mansoni multidrug resistance protein 0.00120498 0.0541513 0.198622
Entamoeba histolytica P-glycoprotein-2 0.00572203 0.259962 0.953516
Leishmania major p-glycoprotein e 0.00120498 0.0541513 0.198622
Echinococcus granulosus multidrug resistance associated protein 1 0.00120498 0.0541513 0.0541513
Plasmodium falciparum ABC transporter B family member 3, putative 0.00120498 0.0541513 0.198622
Giardia lamblia Hypothetical protein 0.00118849 0.0534001 0.195867
Entamoeba histolytica ATP-binding cassette protein, putative 0.00120498 0.0541513 0.198622
Entamoeba histolytica P-glycoprotein-2, putative 0.00118849 0.0534001 0.195867
Trypanosoma cruzi ABC transporter, mitochondrial, putative 0.00120498 0.0541513 0.198622
Trichomonas vaginalis ABC transporter, half transporter, putative 0.00572203 0.259962 0.953516
Brugia malayi Protein kinase domain containing protein 0.00106957 0.0479817 0.175992
Loa Loa (eye worm) hypothetical protein 0.00118849 0.0534001 0.195867
Leishmania major ABC-thiol transporter 0.00120498 0.0541513 0.198622
Echinococcus multilocularis ATP binding cassette sub family B 0.00120498 0.0541513 0.0541513
Plasmodium vivax ABC transporter B family member 6, putative 0.00120498 0.0541513 0.198622
Echinococcus multilocularis ankyrin repeat and death domain containing protein 0.00106957 0.0479817 0.0479817
Trichomonas vaginalis DEAD box ATP-dependent RNA helicase, putative 0.00600017 0.272635 1
Brugia malayi ABC transporter family protein 0.00120498 0.0541513 0.198622
Loa Loa (eye worm) hypothetical protein 0.00106957 0.0479817 0.175992
Plasmodium falciparum multidrug resistance-associated protein 1 0.00120498 0.0541513 0.198622
Leishmania major ATP-binding cassette protein subfamily C, member 2, putative 0.00120498 0.0541513 0.198622
Echinococcus multilocularis ATP binding cassette subfamily B (MDR:TAP) 0.00572203 0.259962 0.259962
Mycobacterium leprae PROBABLE DRUGS-TRANSPORT TRANSMEMBRANE ATP-BINDING PROTEIN ABC TRANSPORTER 0.00120498 0.0541513 1
Chlamydia trachomatis ABC transporter ATP binding protein/permease 0.00572203 0.259962 1
Trichomonas vaginalis taga, putative 0.00572203 0.259962 0.953516
Brugia malayi Death domain containing protein 0.00106957 0.0479817 0.175992
Brugia malayi Immunoglobulin I-set domain containing protein 0.00106957 0.0479817 0.175992
Giardia lamblia Multidrug resistance-associated protein Mrp2 0.00118849 0.0534001 0.195867
Giardia lamblia Multidrug resistance-associated protein 1 0.00118849 0.0534001 0.195867
Schistosoma mansoni multidrug resistance protein 0.00120498 0.0541513 0.198622
Brugia malayi ABC transporter transmembrane region family protein 0.00120498 0.0541513 0.198622
Toxoplasma gondii ABC transporter transmembrane region domain-containing protein 0.00120498 0.0541513 0.198622
Trichomonas vaginalis DEAD box ATP-dependent RNA helicase, putative 0.00600017 0.272635 1
Trypanosoma brucei p-glycoprotein 0.00120498 0.0541513 0.198622
Trichomonas vaginalis lipid A export ATP-binding/permease protein msba, putative 0.00572203 0.259962 0.953516
Trypanosoma cruzi multidrug resistance protein E, putative 0.00120498 0.0541513 0.198622
Plasmodium falciparum multidrug resistance protein 1 0.00572203 0.259962 0.953516
Trichomonas vaginalis multidrug resistance protein 1, 2, putative 0.00572203 0.259962 0.953516
Trichomonas vaginalis ABC transporter, putative 0.00572203 0.259962 0.953516
Echinococcus multilocularis netrin receptor unc 5 0.00106957 0.0479817 0.0479817
Loa Loa (eye worm) hypothetical protein 0.00572203 0.259962 0.953516
Echinococcus multilocularis ATP binding cassette subfamily B (MDR:TAP) 0.00572203 0.259962 0.259962
Schistosoma mansoni ankyrin 23/unc44 0.00106957 0.0479817 0.175992
Trichomonas vaginalis DEAD box ATP-dependent RNA helicase, putative 0.00600017 0.272635 1
Toxoplasma gondii ABC transporter, putative 0.00120498 0.0541513 0.198622
Loa Loa (eye worm) immunoglobulin I-set domain-containing protein 0.00106957 0.0479817 0.175992
Schistosoma mansoni multidrug resistance protein 0.00120498 0.0541513 0.198622
Echinococcus multilocularis 0.00120498 0.0541513 0.0541513
Echinococcus multilocularis ATP binding cassette sub family B 0.00120498 0.0541513 0.0541513
Leishmania major eukaryotic initiation factor 4a, putative 0.00600017 0.272635 1
Entamoeba histolytica P-glyco protein 6, putative 0.00572203 0.259962 0.953516
Entamoeba histolytica multidrug resistance protein, putative 0.00120498 0.0541513 0.198622
Echinococcus multilocularis eukaryotic initiation factor 4A III 0.00600017 0.272635 0.272635
Schistosoma mansoni multidrug resistance protein 0.00120498 0.0541513 0.198622
Leishmania major ATP-binding cassette protein subfamily C, member 5, putative 0.00120498 0.0541513 0.198622
Wolbachia endosymbiont of Brugia malayi ABC-type protease secretion system, ATPase and permease component, AprD 0.00120498 0.0541513 1
Plasmodium vivax multidrug resistance protein 2, putative 0.00120498 0.0541513 0.198622
Giardia lamblia ABC transporter, putative 0.00120498 0.0541513 0.198622
Trichomonas vaginalis lipid A export ATP-binding/permease protein msba, putative 0.00572203 0.259962 0.953516
Mycobacterium tuberculosis Probable cold-shock DeaD-box protein A homolog DeaD (ATP-dependent RNA helicase dead homolog) 0.00600017 0.272635 1
Schistosoma mansoni ATP-binding cassette sub-family B member 6 mitochondrial precursor (abc6) 0.00118849 0.0534001 0.195867
Echinococcus granulosus multidrug resistance protein 1 0.00453353 0.205811 0.205811
Trichomonas vaginalis abcb9, putative 0.00572203 0.259962 0.953516
Toxoplasma gondii ATP-binding cassette sub-family B member 5 0.00120498 0.0541513 0.198622
Trichomonas vaginalis lipid A export ATP-binding/permease protein msba, putative 0.00572203 0.259962 0.953516
Trichomonas vaginalis lipid A export ATP-binding/permease protein msba, putative 0.00572203 0.259962 0.953516
Entamoeba histolytica P-glycoprotein 5, putative 0.00118849 0.0534001 0.195867
Trypanosoma brucei ABC transporter, mitochondrial, putative 0.00120498 0.0541513 0.198622
Brugia malayi multidrug resistance related protein 1 0.00120498 0.0541513 0.198622
Trichomonas vaginalis ABC transporter, putative 0.00572203 0.259962 0.953516
Schistosoma mansoni DEAD box ATP-dependent RNA helicase 0.00600017 0.272635 1
Brugia malayi eukaryotic initiation factor 4A 0.00600017 0.272635 1
Trichomonas vaginalis ATP-binding cassette transporter, putative 0.00118849 0.0534001 0.195867
Echinococcus granulosus multidrug resistance protein 1 0.00572203 0.259962 0.259962
Trichomonas vaginalis multidrug resistance protein 1, 2, putative 0.00118849 0.0534001 0.195867
Trichomonas vaginalis ATP-binding cassette transporter, putative 0.00118849 0.0534001 0.195867
Plasmodium vivax RNA helicase-1, putative 0.00600017 0.272635 1
Echinococcus multilocularis nuclear factor of activated T cells 5 0.0219641 1 1
Loa Loa (eye worm) hypothetical protein 0.00118849 0.0534001 0.195867
Leishmania major pentamidine resistance protein 1 0.00120498 0.0541513 0.198622
Echinococcus granulosus multidrug resistance protein 1 0.00572203 0.259962 0.259962
Loa Loa (eye worm) hypothetical protein 0.00120498 0.0541513 0.198622
Loa Loa (eye worm) ABC transporter 0.00120498 0.0541513 0.198622
Mycobacterium ulcerans transmembrane ABC transporter ATP-binding protein 0.00120498 0.0541513 1
Plasmodium vivax multidrug resistance-associated protein 1, putative 0.00120498 0.0541513 0.198622
Schistosoma mansoni smdr1 0.00120498 0.0541513 0.198622
Loa Loa (eye worm) hypothetical protein 0.00600017 0.272635 1
Echinococcus multilocularis ATP binding cassette subfamily B (MDR:TAP) 0.00572203 0.259962 0.259962
Giardia lamblia MRP-like ABC transporter 0.00120498 0.0541513 0.198622
Schistosoma mansoni retinoblastoma-binding protein 4 (rbbp4) 0.00107315 0.048145 0.176591
Entamoeba histolytica ATP-binding cassette protein, putative 0.00120498 0.0541513 0.198622
Brugia malayi ABC transporter 0.00120498 0.0541513 0.198622
Trichomonas vaginalis lipid A export ATP-binding/permease protein msba, putative 0.00572203 0.259962 0.953516
Brugia malayi P-glycoprotein-like protein 0.00120498 0.0541513 0.198622
Brugia malayi Uncoordinated protein 44 0.00106957 0.0479817 0.175992
Plasmodium vivax ABC transporter B family member 4, putative 0.00120498 0.0541513 0.198622
Trypanosoma brucei multidrug resistance-associated protein, putative 0.00120498 0.0541513 0.198622
Mycobacterium ulcerans component linked with the assembly of cytochrome transport transmembrane ATP-binding protein ABC transporter CydD 0.00120498 0.0541513 1
Trichomonas vaginalis multidrug resistance protein 1, 2, putative 0.00572203 0.259962 0.953516
Echinococcus multilocularis ATP binding cassette sub family B 0.00120498 0.0541513 0.0541513
Treponema pallidum ATP-dependent RNA helicase 0.00600017 0.272635 1
Trichomonas vaginalis lipid A export ATP-binding/permease protein msba, putative 0.00120498 0.0541513 0.198622

Activities

Activity type Activity value Assay description Source Reference
Activity (functional) NOVARTIS: Antimalarial liver stage activity measured as a greater than 50% reduction in Plasmodium yoelii schizont area in HepG2-A16-CD81 cells at 10uM compound concentration, determined by immuno-fluorescence. ChEMBL. 22096101
CC50 > 10 uM NOVARTIS: Cytotoxicity against human hepatocellular carcinoma cell line (Huh7) ChEMBL. 18579783
EC50 (functional) = 1.023 uM NOVARTIS: Inhibition of Plasmodium falciparum 3D7 (drug-susceptible) proliferation in erythrocyte-based infection assay ChEMBL. 18579783
EC50 (functional) > 1.678 uM NOVARTIS: Inhibition of Plasmodium falciparum W2 (drug-resistant) proliferation in erythrocyte-based infection assay ChEMBL. 18579783
IC50 (functional) = 1.6 uM Anticancer activity against paclitaxel resistant variant human H460 cells ChEMBL. 18257542
IC50 (functional) = 1.6 uM Anticancer activity against paclitaxel resistant variant human H460 cells ChEMBL. 18257542
IC50 (functional) = 2.52 uM Anticancer activity against human H460 cells ChEMBL. 18257542
IC50 (functional) = 2.52 uM Anticancer activity against human H460 cells ChEMBL. 18257542
IC50 (ADMET) > 100 uM Anticancer activity against human NHFB cells ChEMBL. 18257542

Phenotypes

Whole-cell/tissue/organism interactions

Species name Source Reference Is orphan
Plasmodium falciparum ChEMBL23 18579783
Homo sapiens ChEMBL23 18257542

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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