Detailed information for compound 1426167

Basic information

Technical information
  • TDR Targets ID: 1426167
  • Name: C530-1338
  • MW: 516.651 | Formula: C30H32N2O4S
  • H donors: 0 H acceptors: 4 LogP: 5.31 Rotable bonds: 5
    Rule of 5 violations (Lipinski): 2
  • SMILES: Cc1ccc(c(c1)CN1C(=O)c2ccccc2S(=O)(=O)c2c1cc(cc2)C(=O)N(C1CCCCC1)C)C
  • InChi: 1S/C30H32N2O4S/c1-20-13-14-21(2)23(17-20)19-32-26-18-22(29(33)31(3)24-9-5-4-6-10-24)15-16-28(26)37(35,36)27-12-8-7-11-25(27)30(32)34/h7-8,11-18,24H,4-6,9-10,19H2,1-3H3
  • InChiKey: IAWGAESVJGSRJZ-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • NCGC00109741-01

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens glucagon-like peptide 1 receptor Starlite/ChEMBL No references
Homo sapiens TAR DNA binding protein 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 mansoni tar DNA-binding protein Get druggable targets OG5_132461 All targets in OG5_132461
Brugia malayi RNA binding protein Get druggable targets OG5_132461 All targets in OG5_132461
Brugia malayi TAR-binding protein Get druggable targets OG5_132461 All targets in OG5_132461
Loa Loa (eye worm) TAR-binding protein Get druggable targets OG5_132461 All targets in OG5_132461
Schistosoma japonicum TAR DNA-binding protein 43, putative Get druggable targets OG5_132461 All targets in OG5_132461
Echinococcus granulosus tar DNA binding protein Get druggable targets OG5_132461 All targets in OG5_132461
Brugia malayi RNA recognition motif domain containing protein Get druggable targets OG5_132461 All targets in OG5_132461
Schistosoma japonicum TAR DNA-binding protein 43, putative Get druggable targets OG5_132461 All targets in OG5_132461
Echinococcus multilocularis tar DNA binding protein Get druggable targets OG5_132461 All targets in OG5_132461
Loa Loa (eye worm) RNA binding protein Get druggable targets OG5_132461 All targets in OG5_132461
Schistosoma mansoni tar DNA-binding protein Get druggable targets OG5_132461 All targets in OG5_132461
Schistosoma mansoni tar DNA-binding protein Get druggable targets OG5_132461 All targets in OG5_132461
Schistosoma mansoni tar DNA-binding protein Get druggable targets OG5_132461 All targets in OG5_132461
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein Get druggable targets OG5_132461 All targets in OG5_132461
Schistosoma mansoni tar DNA-binding protein Get druggable targets OG5_132461 All targets in OG5_132461
By sequence similarity to non orthologous known druggable targets
Species Potential target Known druggable target Length Alignment span Identity
Schistosoma mansoni apoferritin-2 Ferritin light chain   175 aa 146 aa 28.8 %
Schistosoma japonicum Ferritin, putative Ferritin light chain   175 aa 144 aa 24.3 %
Echinococcus granulosus expressed protein Ferritin light chain   175 aa 146 aa 28.8 %
Echinococcus multilocularis expressed protein Ferritin light chain   175 aa 146 aa 30.1 %
Schistosoma mansoni apoferritin-2 Ferritin light chain   175 aa 142 aa 29.6 %
Schistosoma mansoni ferritin Ferritin light chain   175 aa 171 aa 43.9 %
Schistosoma mansoni ferritin Ferritin light chain   175 aa 171 aa 44.4 %
Loa Loa (eye worm) pigment dispersing factor receptor c glucagon-like peptide 1 receptor 463 aa 388 aa 25.8 %
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Giardia lamblia MRP-like ABC transporter 0.0014 0.0648 1
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.0076 1 1
Trypanosoma brucei multidrug resistance-associated protein, putative 0.0014 0.0648 1
Trichomonas vaginalis ABC transporter, putative 0.0044 0.5202 1
Brugia malayi ABC transporter family protein 0.0014 0.0648 0.0095
Echinococcus granulosus ATP binding cassette sub family G 0.001 0.0089 0.0001
Trypanosoma cruzi ABC transporter, mitochondrial, putative 0.0014 0.0648 1
Echinococcus granulosus multidrug resistance protein 1 0.0044 0.5202 0.5159
Plasmodium falciparum multidrug resistance-associated protein 2 0.0014 0.0648 0.1093
Trichomonas vaginalis multidrug resistance protein 1, 2, putative 0.0044 0.5202 1
Trichomonas vaginalis abcb9, putative 0.0044 0.5202 1
Trichomonas vaginalis ATP-binding cassette transporter, putative 0.0031 0.3201 0.6086
Plasmodium falciparum ABC transporter B family member 7, putative 0.0014 0.0648 0.1093
Brugia malayi ABC transporter family protein 0.0014 0.0648 0.0095
Loa Loa (eye worm) pigment dispersing factor receptor c 0.006 0.7562 0.7418
Mycobacterium leprae PROBABLE DRUGS-TRANSPORT TRANSMEMBRANE ATP-BINDING PROTEIN ABC TRANSPORTER 0.0014 0.0648 1
Plasmodium falciparum ABC transporter B family member 4, putative 0.0014 0.0648 0.1093
Trichomonas vaginalis ATP-binding cassette transporter, putative 0.0044 0.5202 1
Leishmania major ATP-binding cassette protein subfamily C, member 2, putative 0.0014 0.0648 0.1093
Loa Loa (eye worm) hypothetical protein 0.0014 0.0648 0.0095
Giardia lamblia Multidrug resistance-associated protein 1 0.0014 0.0648 1
Echinococcus multilocularis ATP binding cassette sub family B 0.0014 0.0648 0.0564
Trichomonas vaginalis lipid A export ATP-binding/permease protein msba, putative 0.0014 0.0648 0.1094
Trichomonas vaginalis ABC transporter, putative 0.0044 0.5202 1
Loa Loa (eye worm) hypothetical protein 0.0044 0.5202 0.4919
Echinococcus multilocularis ATP binding cassette subfamily B (MDR:TAP) 0.0044 0.5202 0.5159
Trichomonas vaginalis lipid A export ATP-binding/permease protein msba, putative 0.0044 0.5202 1
Echinococcus granulosus 5'partial|ATP binding cassette sub family B 0.0044 0.5113 0.5069
Giardia lamblia Multidrug resistance-associated protein 1 0.0014 0.0648 1
Toxoplasma gondii ABC transporter family protein 0.0014 0.0648 0.1093
Loa Loa (eye worm) ATP-binding cassette sub-family B member 2 0.0044 0.5202 0.4919
Echinococcus granulosus multidrug resistance associated protein 1 0.0014 0.0648 0.0564
Trichomonas vaginalis conserved hypothetical protein 0.0013 0.0559 0.0919
Echinococcus multilocularis GPCR, family 2 0.0019 0.1407 0.133
Toxoplasma gondii ABC transporter transmembrane region domain-containing protein 0.0014 0.0648 0.1093
Brugia malayi ABC transporter transmembrane region family protein 0.0014 0.0648 0.0095
Entamoeba histolytica P-glyco protein 6, putative 0.0044 0.5202 1
Schistosoma mansoni tar DNA-binding protein 0.0076 1 1
Schistosoma mansoni multidrug resistance protein 0.0014 0.0648 0.0564
Plasmodium vivax ABC transporter B family member 7, putative 0.0014 0.0648 0.1093
Schistosoma mansoni multidrug resistance protein 0.0044 0.5202 0.5159
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.005 0.5998 0.5962
Trichomonas vaginalis multidrug resistance protein 1, 2, putative 0.0044 0.5202 1
Brugia malayi RNA recognition motif domain containing protein 0.0076 1 1
Schistosoma mansoni multidrug resistance protein 0.0044 0.5202 0.5159
Leishmania major ABC-thiol transporter 0.0014 0.0648 0.1093
Leishmania major ATP-binding cassette protein subfamily C, member 1, putative 0.0014 0.0648 0.1093
Brugia malayi ABC transporter 0.0014 0.0648 0.0095
Toxoplasma gondii ATP-binding cassette sub-family B member 5 0.0014 0.0648 0.1093
Brugia malayi multidrug resistance related protein 1 0.0014 0.0648 0.0095
Loa Loa (eye worm) multidrug resistance protein 3 0.0044 0.5202 0.4919
Loa Loa (eye worm) hypothetical protein 0.0019 0.1407 0.0898
Echinococcus multilocularis ATP binding cassette sub family B 0.0044 0.5113 0.5069
Schistosoma mansoni multidrug resistance protein 0.0014 0.0648 0.0564
Trichomonas vaginalis taga, putative 0.0044 0.5202 1
Trichomonas vaginalis lipid A export ATP-binding/permease protein msba, putative 0.0044 0.5202 1
Toxoplasma gondii ABC transporter, putative 0.0014 0.0648 0.1093
Mycobacterium ulcerans transmembrane ABC transporter ATP-binding protein 0.0014 0.0648 1
Trypanosoma brucei ABC transporter, mitochondrial, putative 0.0014 0.0648 1
Echinococcus multilocularis ATP binding cassette sub family G 0.001 0.0089 0.0001
Schistosoma mansoni tar DNA-binding protein 0.0076 1 1
Entamoeba histolytica ABC transporter, putative 0.0014 0.0648 0.1093
Trichomonas vaginalis lipid A export ATP-binding/permease protein msba, putative 0.0044 0.5202 1
Onchocerca volvulus 0.0044 0.5202 0.5
Leishmania major ATP-binding cassette protein subfamily B, member 1, putative 0.0014 0.0648 0.1093
Brugia malayi multidrug Resistance Protein family member (mrp-5), putative 0.0014 0.0648 0.0095
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.006 0.7562 0.7418
Loa Loa (eye worm) RNA binding protein 0.0076 1 1
Trichomonas vaginalis multidrug resistance protein 1, 2, putative 0.0044 0.5202 1
Plasmodium falciparum ABC transporter B family member 5, putative 0.0014 0.0648 0.1093
Brugia malayi multidrug resistance protein 3 0.0044 0.5202 0.4919
Echinococcus multilocularis multidrug resistance protein 1 0.0031 0.3201 0.314
Schistosoma mansoni multidrug resistance protein 0.0013 0.0559 0.0474
Toxoplasma gondii ABC transporter transmembrane region domain-containing protein 0.0014 0.0648 0.1093
Schistosoma mansoni smdr1 0.0014 0.0648 0.0564
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.005 0.5998 0.5761
Brugia malayi ABC transporter family protein 0.0014 0.0648 0.0095
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.005 0.5998 0.5962
Plasmodium vivax multidrug resistance protein 2, putative 0.0014 0.0648 0.1093
Mycobacterium ulcerans transmembrane ABC transporter ATP-binding protein 0.001 0.0089 0.001
Trichomonas vaginalis lipid A export ATP-binding/permease protein msba, putative 0.0044 0.5202 1
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.005 0.5998 0.5962
Giardia lamblia Hypothetical protein 0.0013 0.0559 0.8621
Echinococcus multilocularis ATP binding cassette sub family B 0.0014 0.0648 0.0564
Entamoeba histolytica P-glycoprotein 6, putative 0.0014 0.0648 0.1093
Echinococcus granulosus tar DNA binding protein 0.0076 1 1
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.0019 0.1407 0.0898
Echinococcus multilocularis ATP binding cassette sub family G 0.001 0.0089 0.0001
Echinococcus granulosus ATP binding cassette sub family G 0.001 0.0089 0.0001
Schistosoma mansoni hypothetical protein 0.0019 0.1407 0.133
Loa Loa (eye worm) ABC transporter 0.0014 0.0648 0.0095
Loa Loa (eye worm) ABC transporter 0.0014 0.0648 0.0095
Schistosoma mansoni hypothetical protein 0.0019 0.1407 0.133
Leishmania major ATP-binding cassette protein subfamily C, member 5, putative 0.0014 0.0648 0.1093
Giardia lamblia Multidrug resistance-associated protein 1 0.0013 0.0559 0.8621
Echinococcus granulosus GPCR family 2 0.0019 0.1407 0.133
Entamoeba histolytica P-glycoprotein-2, putative 0.0044 0.5202 1
Plasmodium vivax ABC transporter B family member 6, putative 0.0014 0.0648 0.1093
Treponema pallidum bacterioferrin (TpF1) 0.001 0.0089 0.5
Trypanosoma brucei p-glycoprotein 0.0014 0.0648 1
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.005 0.5998 0.5962
Plasmodium falciparum multidrug resistance protein 2 0.0014 0.0648 0.1093
Trichomonas vaginalis ABC transporter, putative 0.0044 0.5202 1
Giardia lamblia ABC transporter, putative 0.0014 0.0648 1
Plasmodium vivax multidrug resistance protein 1, putative 0.0044 0.5202 1
Trypanosoma cruzi ABC transporter of the mitochondrion, putative 0.0014 0.0648 1
Echinococcus granulosus cadherin EGF LAG seven pass G type receptor 0.0019 0.1407 0.133
Brugia malayi Latrophilin receptor protein 2 0.0019 0.1407 0.0898
Trichomonas vaginalis multidrug resistance protein 1, 2, putative 0.0013 0.0559 0.0919
Trichomonas vaginalis multidrug resistance protein 1, 2, putative 0.0044 0.5202 1
Trichomonas vaginalis ABC transporter, putative 0.0044 0.5202 1
Trichomonas vaginalis ATP-binding cassette transporter, putative 0.0044 0.5202 1
Entamoeba histolytica ATP-binding cassette protein, putative 0.0014 0.0648 0.1093
Echinococcus multilocularis multidrug resistance associated protein 7 0.0014 0.0648 0.0564
Loa Loa (eye worm) hypothetical protein 0.0014 0.0648 0.0095
Echinococcus multilocularis ATP binding cassette sub family G 0.001 0.0089 0.0001
Echinococcus multilocularis ATP binding cassette sub family B 0.0014 0.0648 0.0564
Toxoplasma gondii ABC transporter transmembrane region domain-containing protein 0.0014 0.0648 0.1093
Schistosoma mansoni hypothetical protein 0.0019 0.1407 0.133
Leishmania major pentamidine resistance protein 1 0.0014 0.0648 0.1093
Toxoplasma gondii ABC transporter transmembrane region domain-containing protein 0.0014 0.0648 0.1093
Trichomonas vaginalis ATP-binding cassette transporter, putative 0.0013 0.0559 0.0919
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.0019 0.1407 0.133
Mycobacterium tuberculosis Iron-regulated transporter IrtA 0.0014 0.0648 0.1094
Trichomonas vaginalis lipid A export ATP-binding/permease protein msba, putative 0.0044 0.5202 1
Schistosoma mansoni hypothetical protein 0.0019 0.1407 0.133
Trichomonas vaginalis ATP-binding cassette transporter, putative 0.0044 0.5202 1
Leishmania major ATP-binding cassette protein subfamily B, member 3, putative 0.0014 0.0648 0.1093
Trichomonas vaginalis ATP-binding cassette transporter, putative 0.0013 0.0559 0.0919
Plasmodium falciparum multidrug resistance-associated protein 1 0.0014 0.0648 0.1093
Loa Loa (eye worm) hypothetical protein 0.0041 0.4713 0.44
Echinococcus multilocularis ATP binding cassette subfamily B (MDR:TAP) 0.0044 0.5202 0.5159
Echinococcus granulosus ATP binding cassette sub family B 0.0014 0.0648 0.0564
Entamoeba histolytica P-glycoprotein-1 0.0044 0.5202 1
Schistosoma mansoni tar DNA-binding protein 0.0076 1 1
Brugia malayi ABC transporter family protein 0.0044 0.5202 0.4919
Trypanosoma brucei ABC transporter of the mitochondrion, putative 0.0014 0.0648 1
Schistosoma mansoni ATP-binding cassette sub-family B member 7 mitochondrial precursor (abc7) 0.0014 0.0648 0.0564
Echinococcus granulosus multidrug resistance protein 1 0.0044 0.5202 0.5159
Trichomonas vaginalis ABC transporter, half transporter, putative 0.0044 0.5202 1
Entamoeba histolytica P-glycoprotein-5 0.0044 0.5202 1
Trypanosoma cruzi multidrug resistance-associated protein, putative 0.0014 0.0648 1
Mycobacterium ulcerans transmembrane ABC transporter ATP-binding protein 0.0014 0.0648 1
Entamoeba histolytica ATP-binding cassette protein, putative 0.0014 0.0648 0.1093
Loa Loa (eye worm) hypothetical protein 0.006 0.7562 0.7418
Echinococcus granulosus ATP binding cassette sub family G 0.001 0.0089 0.0001
Echinococcus multilocularis cadherin EGF LAG seven pass G type receptor 0.0019 0.1407 0.133
Echinococcus multilocularis ATP binding cassette subfamily B (MDR:TAP) 0.0044 0.5202 0.5159
Loa Loa (eye worm) ABC transporter transmembrane region family protein 0.0014 0.0648 0.0095
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.005 0.5998 0.5761
Entamoeba histolytica hypothetical protein 0.0014 0.0648 0.1093
Trichomonas vaginalis lipid A export ATP-binding/permease protein msba, putative 0.0044 0.5202 1
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.0019 0.1407 0.133
Entamoeba histolytica P-glycoprotein 6, putative 0.0014 0.0648 0.1093
Entamoeba histolytica P-glycoprotein-2, putative 0.0013 0.0559 0.0918
Plasmodium vivax ABC transporter B family member 5, putative 0.0014 0.0648 0.1093
Entamoeba histolytica P-glycoprotein-2 0.0044 0.5202 1
Wolbachia endosymbiont of Brugia malayi ABC-type multidrug transport system, ATPase and permease component 0.0014 0.0648 1
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.005 0.5998 0.5962
Echinococcus granulosus ATP binding cassette sub family B 0.0013 0.0559 0.0474
Schistosoma mansoni multidrug resistance protein 0.0044 0.5202 0.5159
Mycobacterium leprae PROBABLE DRUGS-TRANSPORT TRANSMEMBRANE ATP-BINDING PROTEIN ABC TRANSPORTER 0.0014 0.0648 1
Leishmania major p-glycoprotein 0.0044 0.5202 1
Toxoplasma gondii ATP-binding cassette transporter ABC.B1 0.0044 0.5202 1
Brugia malayi hypothetical protein 0.0014 0.0648 0.0095
Entamoeba histolytica ATP-binding cassette protein, putative 0.0014 0.0648 0.1093
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.005 0.5998 0.5962
Schistosoma mansoni ATP-binding cassette sub-family B member 6 mitochondrial precursor (abc6) 0.0013 0.0559 0.0474
Loa Loa (eye worm) ABC transporter 0.0014 0.0648 0.0095
Brugia malayi Calcitonin receptor-like protein seb-1 0.006 0.7562 0.7418
Brugia malayi latrophilin 2 splice variant baaae 0.0041 0.4713 0.44
Plasmodium falciparum ABC transporter B family member 6, putative 0.0014 0.0648 0.1093
Mycobacterium ulcerans component linked with the assembly of cytochrome transport transmembrane ATP-binding protein ABC transporter CydD 0.0014 0.0648 1
Echinococcus granulosus ATP binding cassette sub family B 0.0014 0.0648 0.0564
Schistosoma mansoni ATP-binding cassette sub-family g2 (white protein) (abcg2) 0.001 0.0089 0.0001
Leishmania major ATP-binding cassette protein subfamily C, member 8, putative 0.0014 0.0648 0.1093
Trichomonas vaginalis lipid A export ATP-binding/permease protein msba, putative 0.0044 0.5202 1
Echinococcus multilocularis ATP binding cassette sub family B 0.0014 0.0648 0.0564
Trichomonas vaginalis ATP-binding cassette transporter, putative 0.0044 0.5202 1
Toxoplasma gondii ABC transporter transmembrane region domain-containing protein 0.0014 0.0648 0.1093
Brugia malayi P-glycoprotein-like protein 0.0014 0.0648 0.0095
Echinococcus granulosus multidrug resistance associated protein 7 0.0014 0.0648 0.0564
Plasmodium falciparum multidrug resistance protein 1 0.0044 0.5202 1
Trichomonas vaginalis multidrug resistance protein 1, 2, putative 0.0044 0.5202 1
Entamoeba histolytica ATP-binding cassette protein, putative 0.0014 0.0648 0.1093
Plasmodium vivax multidrug resistance-associated protein 2, putative 0.0014 0.0648 0.1093
Trichomonas vaginalis abcb9, putative 0.0044 0.5202 1
Loa Loa (eye worm) TAR-binding protein 0.0076 1 1
Brugia malayi TAR-binding protein 0.0076 1 1
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.005 0.5998 0.5962
Entamoeba histolytica P-glycoprotein-2 0.0044 0.5202 1
Plasmodium falciparum ABC transporter B family member 3, putative 0.0014 0.0648 0.1093
Echinococcus granulosus multidrug resistance protein 1 0.0044 0.5202 0.5159
Trichomonas vaginalis abcb9, putative 0.0044 0.5202 1
Schistosoma mansoni multidrug resistance protein 0.0014 0.0648 0.0564
Leishmania major ATP-binding cassette protein subfamily B, member 2, putative 0.0044 0.5202 1
Echinococcus granulosus multidrug resistance protein 1 0.0031 0.3201 0.314
Brugia malayi ABC transporter transmembrane region family protein 0.0014 0.0648 0.0095
Plasmodium vivax multidrug resistance-associated protein 1, putative 0.0014 0.0648 0.1093
Schistosoma mansoni smdr2 0.0044 0.5202 0.5159
Mycobacterium tuberculosis Probable transmembrane multidrug efflux pump 0.0044 0.5202 1
Echinococcus multilocularis ATP binding cassette subfamily B (MDR:TAP) 0.0044 0.5202 0.5159
Loa Loa (eye worm) hypothetical protein 0.0014 0.0648 0.0095
Echinococcus multilocularis 0.0014 0.0648 0.0564
Mycobacterium ulcerans transmembrane ABC transporter ATP-binding protein 0.001 0.0089 0.001
Trichomonas vaginalis ATP-binding cassette transporter, putative 0.0044 0.5202 1
Leishmania major p-glycoprotein e 0.0014 0.0648 0.1093
Loa Loa (eye worm) hypothetical protein 0.0044 0.5202 0.4919
Echinococcus granulosus ATP binding cassette subfamily B MDR:TAP 0.0044 0.5202 0.5159
Toxoplasma gondii ABC transporter transmembrane region domain-containing protein 0.0014 0.0648 0.1093
Loa Loa (eye worm) latrophilin receptor protein 2 0.0019 0.1407 0.0898
Plasmodium vivax ABC transporter B family member 3, putative 0.0014 0.0648 0.1093
Schistosoma mansoni hypothetical protein 0.0041 0.4713 0.4666
Echinococcus multilocularis multidrug resistance protein 1 0.0044 0.5202 0.5159
Trypanosoma cruzi multidrug resistance-associated protein, putative 0.0014 0.0648 1
Mycobacterium ulcerans transmembrane ABC transporter ATP-binding protein 0.0014 0.0648 1
Echinococcus granulosus multidrug resistance protein 1 0.0031 0.3201 0.314
Schistosoma mansoni multidrug resistance protein 0.0014 0.0648 0.0564
Mycobacterium tuberculosis Probable drugs-transport transmembrane ATP-binding protein ABC transporter 0.0014 0.0648 0.1094
Trypanosoma brucei multidrug resistance-associated protein, putative 0.0014 0.0648 1
Leishmania major ATP-binding cassette protein subfamily C, member 6, putative 0.0014 0.0648 0.1093
Mycobacterium ulcerans drugs-transport transmembrane ATP-binding protein ABC transporter 0.0014 0.0648 1
Trypanosoma brucei multidrug resistance protein E 0.0014 0.0648 1
Entamoeba histolytica P-glycoprotein 5, putative 0.0044 0.5202 1
Entamoeba histolytica multidrug resistance protein, putative 0.0014 0.0648 0.1093
Trichomonas vaginalis multidrug resistance protein 1, 2, putative 0.0044 0.5202 1
Wolbachia endosymbiont of Brugia malayi ABC-type protease secretion system, ATPase and permease component, AprD 0.0014 0.0648 1
Trypanosoma cruzi multidrug resistance protein E, putative 0.0014 0.0648 1
Echinococcus multilocularis multidrug resistance associated protein 1 0.0014 0.0648 0.0564
Echinococcus multilocularis tar DNA binding protein 0.0076 1 1
Echinococcus multilocularis multidrug resistance protein 1 0.0044 0.5202 0.5159
Toxoplasma gondii ABC transporter transmembrane region domain-containing protein 0.0044 0.5202 1
Entamoeba histolytica P-glycoprotein 5, putative 0.0013 0.0559 0.0918
Schistosoma mansoni tar DNA-binding protein 0.0076 1 1
Echinococcus granulosus ATP binding cassette subfamily B MDR:TAP 0.0044 0.5202 0.5159
Plasmodium vivax ABC transporter B family member 4, putative 0.0014 0.0648 0.1093
Schistosoma mansoni tar DNA-binding protein 0.0076 1 1
Echinococcus granulosus ATP binding cassette subfamily B MDR:TAP 0.0044 0.5202 0.5159
Giardia lamblia Multidrug resistance-associated protein Mrp2 0.0013 0.0559 0.8621
Echinococcus granulosus ATP binding cassette subfamily B MDR:TAP 0.0044 0.5202 0.5159
Mycobacterium ulcerans transmembrane ABC transporter ATP-binding protein 0.001 0.0089 0.001
Trichomonas vaginalis ABC transporter, half transporter, putative 0.0044 0.5202 1
Schistosoma mansoni multidrug resistance protein 0.0014 0.0648 0.0564
Trichomonas vaginalis multidrug resistance protein 1, 2, putative 0.0044 0.5202 1
Trichomonas vaginalis lipid A export ATP-binding/permease protein msba, putative 0.0044 0.5202 1
Loa Loa (eye worm) hypothetical protein 0.0044 0.5113 0.4824
Echinococcus multilocularis ATP binding cassette subfamily B (MDR:TAP) 0.0044 0.5202 0.5159
Chlamydia trachomatis ABC transporter ATP binding protein/permease 0.0044 0.5202 0.5

Activities

Activity type Activity value Assay description Source Reference
Potency (binding) = 3.5481 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) 7.0795 uM PubChem BioAssay. qHTS of TDP-43 Inhibitors. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 14.1254 uM PubChem BioAssay. qHTS of GLP-1 Receptor Inverse Agonists (Inhibition Mode). (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 28.1838 uM PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Histone Lysine Methyltransferase G9a. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID504404] ChEMBL. No reference
Potency (functional) 29.0929 uM PUBCHEM_BIOASSAY: Nrf2 qHTS screen for inhibitors. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID493153, AID493163, AID504648] 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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