Detailed information for compound 1315462

Basic information

Technical information
  • TDR Targets ID: 1315462
  • Name: ethyl 4-(4-nitrophenyl)sulfonylpiperazine-1-c arboxylate
  • MW: 343.356 | Formula: C13H17N3O6S
  • H donors: 0 H acceptors: 5 LogP: 0.94 Rotable bonds: 6
    Rule of 5 violations (Lipinski): 1
  • SMILES: CCOC(=O)N1CCN(CC1)S(=O)(=O)c1ccc(cc1)[N+](=O)[O-]
  • InChi: 1S/C13H17N3O6S/c1-2-22-13(17)14-7-9-15(10-8-14)23(20,21)12-5-3-11(4-6-12)16(18)19/h3-6H,2,7-10H2,1H3
  • InChiKey: ZLECPLUZUDDNQM-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • 4-(4-nitrophenyl)sulfonyl-1-piperazinecarboxylic acid ethyl ester
  • 4-(4-nitrophenyl)sulfonylpiperazine-1-carboxylic acid ethyl ester
  • T5259713
  • ZINC00180460
  • MLS000774201
  • SMR000364990
  • Oprea1_015545

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Escherichia coli penicillin-binding protein Starlite/ChEMBL No references
Homo sapiens muscleblind-like splicing regulator 1 Starlite/ChEMBL No references

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Echinococcus multilocularis muscleblind protein 1 Get druggable targets OG5_132352 All targets in OG5_132352
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_132352 All targets in OG5_132352
Brugia malayi Muscleblind-like protein Get druggable targets OG5_132352 All targets in OG5_132352
Mycobacterium tuberculosis Possible penicillin-binding protein Get druggable targets OG5_149948 All targets in OG5_149948
Echinococcus granulosus muscleblind protein Get druggable targets OG5_132352 All targets in OG5_132352
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_132352 All targets in OG5_132352
Echinococcus multilocularis muscleblind protein Get druggable targets OG5_132352 All targets in OG5_132352
By sequence similarity to non orthologous known druggable targets
No druggable targets predicted by sequence similarity
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Echinococcus granulosus sodium channel protein 0.0084 0.2261 0.3327
Mycobacterium ulcerans component linked with the assembly of cytochrome transport transmembrane ATP-binding protein ABC transporter CydD 0.0064 0.1463 1
Entamoeba histolytica P-glycoprotein 6, putative 0.0064 0.1463 0.0165
Loa Loa (eye worm) ATP-binding cassette sub-family B member 2 0.0198 0.6798 1
Plasmodium falciparum multidrug resistance protein 1 0.0198 0.6798 1
Brugia malayi ABC transporter transmembrane region family protein 0.0076 0.1925 0.2832
Loa Loa (eye worm) hypothetical protein 0.0076 0.1925 0.2832
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0053 0.1003 0.1476
Echinococcus multilocularis muscleblind protein 0.018 0.6106 0.8983
Trichomonas vaginalis voltage and ligand gated potassium channel, putative 0.0073 0.1799 0.1892
Toxoplasma gondii ABC transporter transmembrane region domain-containing protein 0.0064 0.1463 0.1347
Entamoeba histolytica hypothetical protein 0.0076 0.1925 0.1017
Trypanosoma brucei ABC transporter, mitochondrial, putative 0.0064 0.1463 0.6425
Trichomonas vaginalis multidrug resistance protein 1, 2, putative 0.0198 0.6798 1
Mycobacterium leprae PROBABLE DRUGS-TRANSPORT TRANSMEMBRANE ATP-BINDING PROTEIN ABC TRANSPORTER 0.0064 0.1463 1
Loa Loa (eye worm) hypothetical protein 0.0195 0.6708 0.9868
Trichomonas vaginalis ABC transporter, half transporter, putative 0.0198 0.6798 1
Echinococcus granulosus multidrug resistance associated protein 7 0.0076 0.1925 0.2832
Entamoeba histolytica P-glycoprotein-2 0.0198 0.6798 1
Schistosoma mansoni multidrug resistance protein 0.0076 0.1925 0.2832
Brugia malayi ABC transporter 0.0064 0.1463 0.2153
Trypanosoma cruzi multidrug resistance-associated protein, putative 0.0076 0.1925 1
Entamoeba histolytica P-glycoprotein-2, putative 0.0198 0.6798 1
Plasmodium vivax multidrug resistance-associated protein 1, putative 0.0064 0.1463 0.1347
Schistosoma mansoni ATP-binding cassette sub-family B member 6 mitochondrial precursor (abc6) 0.0062 0.1374 0.2021
Entamoeba histolytica P-glycoprotein-5 0.0198 0.6798 1
Brugia malayi ABC transporter family protein 0.0064 0.1463 0.2153
Loa Loa (eye worm) hypothetical protein 0.0043 0.0633 0.0931
Trypanosoma cruzi multidrug resistance-associated protein, putative 0.0076 0.1925 1
Leishmania major ATP-binding cassette protein subfamily C, member 5, putative 0.0076 0.1925 0.2096
Trichomonas vaginalis ATP-binding cassette transporter, putative 0.0062 0.1374 0.1202
Trichomonas vaginalis multidrug resistance protein 1, 2, putative 0.0198 0.6798 1
Loa Loa (eye worm) hypothetical protein 0.0043 0.0633 0.0931
Plasmodium vivax ABC transporter B family member 5, putative 0.0064 0.1463 0.1347
Trichomonas vaginalis multidrug resistance protein 1, 2, putative 0.0198 0.6798 1
Brugia malayi beta-lactamase 0.0043 0.0633 0.0931
Trichomonas vaginalis lipid A export ATP-binding/permease protein msba, putative 0.0064 0.1463 0.1347
Trichomonas vaginalis abcb9, putative 0.0198 0.6798 1
Echinococcus multilocularis 0.0064 0.1463 0.2153
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0053 0.1003 0.1476
Loa Loa (eye worm) inward rectifying k channel family protein 1 0.0178 0.6017 0.8851
Echinococcus multilocularis beta LACTamase domain containing family member 0.0043 0.0633 0.0931
Giardia lamblia Multidrug resistance-associated protein 1 0.0074 0.1836 0.8376
Leishmania major ATP-binding cassette protein subfamily C, member 6, putative 0.0076 0.1925 0.2096
Echinococcus multilocularis ATP binding cassette sub family B 0.0195 0.6708 0.9868
Trichomonas vaginalis ATP-binding cassette transporter, putative 0.0198 0.6798 1
Trichomonas vaginalis multidrug resistance protein 1, 2, putative 0.0198 0.6798 1
Wolbachia endosymbiont of Brugia malayi ABC-type multidrug transport system, ATPase and permease component 0.0064 0.1463 0.5
Schistosoma mansoni multidrug resistance protein 0.0062 0.1374 0.2021
Echinococcus granulosus 5'partial|ATP binding cassette sub family B 0.0195 0.6708 0.9868
Brugia malayi P-glycoprotein-like protein 0.0064 0.1463 0.2153
Echinococcus multilocularis ATP binding cassette subfamily B (MDR:TAP) 0.0198 0.6798 1
Trichomonas vaginalis voltage and ligand gated potassium channel, putative 0.0073 0.1799 0.1892
Entamoeba histolytica multidrug resistance protein, putative 0.0076 0.1925 0.1017
Loa Loa (eye worm) hypothetical protein 0.0178 0.6017 0.8851
Loa Loa (eye worm) ABC transporter 0.0064 0.1463 0.2153
Echinococcus granulosus voltage gated sodium channel Nav1 alpha subunit 0.0084 0.2261 0.3327
Echinococcus multilocularis ATP binding cassette sub family B 0.0064 0.1463 0.2153
Giardia lamblia MRP-like ABC transporter 0.0076 0.1925 1
Toxoplasma gondii ABC transporter transmembrane region domain-containing protein 0.0064 0.1463 0.1347
Wolbachia endosymbiont of Brugia malayi ABC-type protease secretion system, ATPase and permease component, AprD 0.0064 0.1463 0.5
Trichomonas vaginalis multidrug resistance protein 1, 2, putative 0.0198 0.6798 1
Entamoeba histolytica ATP-binding cassette protein, putative 0.0076 0.1925 0.1017
Entamoeba histolytica ATP-binding cassette protein, putative 0.0076 0.1925 0.1017
Entamoeba histolytica ATP-binding cassette protein, putative 0.0076 0.1925 0.1017
Echinococcus multilocularis ATP binding cassette sub family B 0.0064 0.1463 0.2153
Loa Loa (eye worm) ABC transporter 0.0064 0.1463 0.2153
Trypanosoma brucei multidrug resistance-associated protein, putative 0.0076 0.1925 1
Echinococcus multilocularis ATP binding cassette sub family B 0.0064 0.1463 0.2153
Leishmania major pentamidine resistance protein 1 0.0076 0.1925 0.2096
Loa Loa (eye worm) hypothetical protein 0.0198 0.6798 1
Trichomonas vaginalis ABC transporter, putative 0.0198 0.6798 1
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0053 0.1003 0.1476
Echinococcus granulosus multidrug resistance protein 1 0.0136 0.4319 0.6353
Echinococcus multilocularis ATP binding cassette sub family B 0.0064 0.1463 0.2153
Echinococcus granulosus ATP binding cassette subfamily B MDR:TAP 0.0198 0.6798 1
Mycobacterium tuberculosis Probable drugs-transport transmembrane ATP-binding protein ABC transporter 0.0064 0.1463 0.0886
Brugia malayi Muscleblind-like protein 0.018 0.6106 0.8983
Giardia lamblia Multidrug resistance-associated protein 1 0.0076 0.1925 1
Toxoplasma gondii hypothetical protein 0.0178 0.6017 0.8734
Entamoeba histolytica P-glycoprotein 6, putative 0.0064 0.1463 0.0165
Loa Loa (eye worm) beta-lactamase 0.0043 0.0633 0.0931
Echinococcus multilocularis multidrug resistance associated protein 7 0.0076 0.1925 0.2832
Trichomonas vaginalis multidrug resistance protein 1, 2, putative 0.0198 0.6798 1
Echinococcus granulosus ATP binding cassette sub family B 0.0064 0.1463 0.2153
Toxoplasma gondii ATP-binding cassette sub-family B member 5 0.0064 0.1463 0.1347
Loa Loa (eye worm) voltage and ligand gated potassium channel 0.0083 0.2208 0.3249
Echinococcus multilocularis ATP binding cassette subfamily B (MDR:TAP) 0.0198 0.6798 1
Giardia lamblia Multidrug resistance-associated protein 1 0.0076 0.1925 1
Trichomonas vaginalis lipid A export ATP-binding/permease protein msba, putative 0.0198 0.6798 1
Brugia malayi ABC transporter 0.0062 0.1374 0.2021
Echinococcus multilocularis potassium voltage gated channel subfamily H 0.0083 0.2208 0.3249
Trichomonas vaginalis lipid A export ATP-binding/permease protein msba, putative 0.0198 0.6798 1
Echinococcus granulosus multidrug resistance protein 1 0.0198 0.6798 1
Brugia malayi Voltage-gated potassium channel, HERG (KCNH2)-related. C. elegans unc-103 ortholog 0.0083 0.2208 0.3249
Trypanosoma brucei p-glycoprotein 0.0076 0.1925 1
Echinococcus granulosus ATP binding cassette sub family B 0.0064 0.1463 0.2153
Brugia malayi multidrug Resistance Protein family member (mrp-5), putative 0.0064 0.1463 0.2153
Loa Loa (eye worm) hypothetical protein 0.0178 0.6017 0.8851
Trichomonas vaginalis ATP-binding cassette transporter, putative 0.0136 0.4319 0.5979
Leishmania major calcium channel protein, putative,ion transporter, putative 0.0084 0.2261 0.2642
Trichomonas vaginalis ABC transporter, putative 0.0198 0.6798 1
Trichomonas vaginalis lipid A export ATP-binding/permease protein msba, putative 0.0198 0.6798 1
Entamoeba histolytica ABC transporter, putative 0.0076 0.1925 0.1017
Leishmania major ATP-binding cassette protein subfamily B, member 3, putative 0.0064 0.1463 0.1347
Brugia malayi ABC transporter transmembrane region family protein 0.0062 0.1374 0.2021
Trypanosoma cruzi ABC transporter, mitochondrial, putative 0.0064 0.1463 0.6425
Toxoplasma gondii ABC transporter family protein 0.0064 0.1463 0.1347
Loa Loa (eye worm) hypothetical protein 0.018 0.6106 0.8983
Plasmodium vivax ABC transporter B family member 3, putative 0.0064 0.1463 0.1347
Plasmodium vivax multidrug resistance protein 2, putative 0.0064 0.1463 0.1347
Loa Loa (eye worm) hypothetical protein 0.0062 0.1374 0.2021
Mycobacterium ulcerans transmembrane ABC transporter ATP-binding protein 0.0064 0.1463 1
Trichomonas vaginalis ATP-binding cassette transporter, putative 0.0198 0.6798 1
Loa Loa (eye worm) hypothetical protein 0.0198 0.6798 1
Echinococcus multilocularis ATP binding cassette subfamily B (MDR:TAP) 0.0198 0.6798 1
Trichomonas vaginalis abcb9, putative 0.0198 0.6798 1
Echinococcus granulosus multidrug resistance protein 1 0.0136 0.4319 0.6353
Schistosoma mansoni ATP-binding cassette sub-family B member 7 mitochondrial precursor (abc7) 0.0064 0.1463 0.2153
Trypanosoma brucei multidrug resistance-associated protein, putative 0.0076 0.1925 1
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0043 0.0633 0.0931
Mycobacterium tuberculosis Probable transmembrane multidrug efflux pump 0.0198 0.6798 0.6581
Leishmania major ATP-binding cassette protein subfamily B, member 1, putative 0.0064 0.1463 0.1347
Trichomonas vaginalis multidrug resistance protein 1, 2, putative 0.0198 0.6798 1
Toxoplasma gondii ABC transporter transmembrane region domain-containing protein 0.0064 0.1463 0.1347
Trichomonas vaginalis ATP-binding cassette transporter, putative 0.0198 0.6798 1
Echinococcus multilocularis multidrug resistance protein 1 0.0136 0.4319 0.6353
Entamoeba histolytica P-glyco protein 6, putative 0.0198 0.6798 1
Echinococcus granulosus multidrug resistance protein 1 0.0198 0.6798 1
Loa Loa (eye worm) multidrug resistance protein 3 0.0198 0.6798 1
Schistosoma mansoni voltage-gated potassium channel 0.009 0.2494 0.3669
Echinococcus multilocularis multidrug resistance protein 1 0.0198 0.6798 1
Trichomonas vaginalis ATP-binding cassette transporter, putative 0.0198 0.6798 1
Entamoeba histolytica P-glycoprotein-1 0.0198 0.6798 1
Echinococcus multilocularis multidrug resistance protein 1 0.0198 0.6798 1
Trichomonas vaginalis taga, putative 0.0198 0.6798 1
Toxoplasma gondii ABC transporter, putative 0.0064 0.1463 0.1347
Echinococcus granulosus ATP binding cassette sub family B 0.0062 0.1374 0.2021
Trichomonas vaginalis conserved hypothetical protein 0.0062 0.1374 0.1202
Mycobacterium tuberculosis Iron-regulated transporter IrtA 0.0064 0.1463 0.0886
Brugia malayi multidrug resistance related protein 1 0.0076 0.1925 0.2832
Leishmania major ATP-binding cassette protein subfamily C, member 2, putative 0.0076 0.1925 0.2096
Echinococcus multilocularis multidrug resistance associated protein 1 0.0076 0.1925 0.2832
Entamoeba histolytica ATP-binding cassette protein, putative 0.0076 0.1925 0.1017
Trichomonas vaginalis lipid A export ATP-binding/permease protein msba, putative 0.0198 0.6798 1
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0053 0.1003 0.1476
Plasmodium vivax ABC transporter B family member 4, putative 0.0064 0.1463 0.1347
Entamoeba histolytica P-glycoprotein-2 0.0198 0.6798 1
Trichomonas vaginalis abcb9, putative 0.0198 0.6798 1
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0053 0.1003 0.1476
Mycobacterium ulcerans transmembrane ABC transporter ATP-binding protein 0.0064 0.1463 1
Leishmania major ATP-binding cassette protein subfamily C, member 8, putative 0.0064 0.1463 0.1347
Echinococcus granulosus multidrug resistance protein 1 0.0198 0.6798 1
Brugia malayi ABC transporter family protein 0.0064 0.1463 0.2153
Echinococcus multilocularis sodium channel protein 0.0084 0.2261 0.3327
Schistosoma mansoni smdr1 0.0064 0.1463 0.2153
Brugia malayi ABC transporter family protein 0.0064 0.1463 0.2153
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0043 0.0633 0.0931
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0053 0.1003 0.1476
Brugia malayi ABC transporter transmembrane region family protein 0.0064 0.1463 0.2153
Leishmania major p-glycoprotein e 0.0076 0.1925 0.2096
Mycobacterium leprae PROBABLE DRUGS-TRANSPORT TRANSMEMBRANE ATP-BINDING PROTEIN ABC TRANSPORTER 0.0064 0.1463 1
Toxoplasma gondii ABC transporter transmembrane region domain-containing protein 0.0076 0.1925 0.2096
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0053 0.1003 0.1476
Plasmodium vivax multidrug resistance-associated protein 2, putative 0.0064 0.1463 0.1347
Mycobacterium ulcerans transmembrane ABC transporter ATP-binding protein 0.0064 0.1463 1
Schistosoma mansoni voltage-gated potassium channel 0.009 0.2494 0.3669
Schistosoma mansoni multidrug resistance protein 0.0198 0.6798 1
Trichomonas vaginalis ABC transporter, putative 0.0198 0.6798 1
Echinococcus granulosus muscleblind protein 0.018 0.6106 0.8983
Leishmania major ATP-binding cassette protein subfamily C, member 1, putative 0.0076 0.1925 0.2096
Leishmania major ABC-thiol transporter 0.0076 0.1925 0.2096
Trichomonas vaginalis ATP-binding cassette transporter, putative 0.0062 0.1374 0.1202
Echinococcus granulosus beta LACTamase domain containing family member 0.0043 0.0633 0.0931
Echinococcus granulosus ATP binding cassette subfamily B MDR:TAP 0.0198 0.6798 1
Trichomonas vaginalis lipid A export ATP-binding/permease protein msba, putative 0.0198 0.6798 1
Schistosoma mansoni smdr2 0.0198 0.6798 1
Toxoplasma gondii ABC transporter transmembrane region domain-containing protein 0.0064 0.1463 0.1347
Brugia malayi Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative 0.0043 0.0633 0.0931
Toxoplasma gondii ATP-binding cassette transporter ABC.B1 0.0198 0.6798 1
Trichomonas vaginalis lipid A export ATP-binding/permease protein msba, putative 0.0198 0.6798 1
Leishmania major ATP-binding cassette protein subfamily B, member 2, putative 0.0198 0.6798 1
Echinococcus granulosus ATP binding cassette subfamily B MDR:TAP 0.0198 0.6798 1
Toxoplasma gondii ABC transporter transmembrane region domain-containing protein 0.0064 0.1463 0.1347
Trichomonas vaginalis ABC transporter, half transporter, putative 0.0198 0.6798 1
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0053 0.1003 0.1476
Schistosoma mansoni multidrug resistance protein 0.0198 0.6798 1
Loa Loa (eye worm) hypothetical protein 0.0064 0.1463 0.2153
Trichomonas vaginalis lipid A export ATP-binding/permease protein msba, putative 0.0198 0.6798 1
Trypanosoma brucei ABC transporter of the mitochondrion, putative 0.0064 0.1463 0.6425
Plasmodium vivax multidrug resistance protein 1, putative 0.0198 0.6798 1
Onchocerca volvulus 0.0198 0.6798 1
Loa Loa (eye worm) hypothetical protein 0.0043 0.0633 0.0931
Brugia malayi multidrug resistance protein 3 0.0198 0.6798 1
Loa Loa (eye worm) hypothetical protein 0.0073 0.1798 0.2645
Echinococcus multilocularis ATP binding cassette subfamily B (MDR:TAP) 0.0198 0.6798 1
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0053 0.1003 0.1476
Schistosoma mansoni multidrug resistance protein 0.0198 0.6798 1
Echinococcus granulosus ATP binding cassette subfamily B MDR:TAP 0.0198 0.6798 1
Schistosoma mansoni multidrug resistance protein 0.0076 0.1925 0.2832
Schistosoma mansoni multidrug resistance protein 0.0076 0.1925 0.2832
Brugia malayi beta-lactamase family protein 0.0043 0.0633 0.0931
Trichomonas vaginalis lipid A export ATP-binding/permease protein msba, putative 0.0198 0.6798 1
Loa Loa (eye worm) ABC transporter 0.0064 0.1463 0.2153
Loa Loa (eye worm) hypothetical protein 0.0074 0.1836 0.27
Plasmodium vivax ABC transporter B family member 6, putative 0.0064 0.1463 0.1347
Trypanosoma brucei multidrug resistance protein E 0.0076 0.1925 1
Toxoplasma gondii ABC transporter transmembrane region domain-containing protein 0.0198 0.6798 1
Leishmania major p-glycoprotein 0.0198 0.6798 1
Trichomonas vaginalis ATP-binding cassette transporter, putative 0.0198 0.6798 1
Trichomonas vaginalis multidrug resistance protein 1, 2, putative 0.0062 0.1374 0.1202
Trichomonas vaginalis ABC transporter, putative 0.0198 0.6798 1
Echinococcus multilocularis muscleblind protein 1 0.018 0.6106 0.8983
Loa Loa (eye worm) hypothetical protein 0.0043 0.0633 0.0931
Brugia malayi ABC transporter family protein 0.0198 0.6798 1
Brugia malayi beta-lactamase family protein 0.0043 0.0633 0.0931
Schistosoma mansoni multidrug resistance protein 0.0076 0.1925 0.2832
Mycobacterium ulcerans drugs-transport transmembrane ATP-binding protein ABC transporter 0.0064 0.1463 1
Loa Loa (eye worm) hypothetical protein 0.0043 0.0633 0.0931
Plasmodium vivax ABC transporter B family member 7, putative 0.0064 0.1463 0.1347
Loa Loa (eye worm) ABC transporter transmembrane region family protein 0.0076 0.1925 0.2832
Trypanosoma cruzi multidrug resistance protein E, putative 0.0076 0.1925 1
Echinococcus granulosus multidrug resistance associated protein 1 0.0076 0.1925 0.2832
Chlamydia trachomatis ABC transporter ATP binding protein/permease 0.0198 0.6798 0.5
Loa Loa (eye worm) hypothetical protein 0.0043 0.0633 0.0931
Loa Loa (eye worm) hypothetical protein 0.0076 0.1925 0.2832
Loa Loa (eye worm) beta-LACTamase domain containing family member 0.0043 0.0633 0.0931
Brugia malayi hypothetical protein 0.0064 0.1463 0.2153
Entamoeba histolytica P-glycoprotein 5, putative 0.0198 0.6798 1
Giardia lamblia ABC transporter, putative 0.0076 0.1925 1
Loa Loa (eye worm) hypothetical protein 0.0178 0.6017 0.8851
Echinococcus multilocularis ATP binding cassette subfamily B (MDR:TAP) 0.0198 0.6798 1
Echinococcus granulosus potassium voltage gated channel subfamily H 0.0083 0.2208 0.3249
Loa Loa (eye worm) hypothetical protein 0.018 0.6106 0.8983
Schistosoma mansoni multidrug resistance protein 0.0064 0.1463 0.2153
Trypanosoma cruzi ABC transporter of the mitochondrion, putative 0.0064 0.1463 0.6425

Activities

Activity type Activity value Assay description Source Reference
Potency (functional) 0.4147 uM PUBCHEM_BIOASSAY: Primary qHTS for delayed death inhibitors of the malarial parasite plastid, 48 hour incubation. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488752, AID488774, AID504848, AID504850] ChEMBL. No reference
Potency (functional) = 2.8184 um PUBCHEM_BIOASSAY: qHTS Inhibitors of AmpC Beta-Lactamase (assay with detergent). (Class of assay: confirmatory) [Related pubchem assays: 1002 (Confirmation Concentration-Response Assay for Inhibitors of AmpC Beta-Lactamase (assay with detergent)), 585 (Promiscuous and Specific Inhibitors of AmpC Beta-Lactamase (assay without detergent) - a screen old NIH MLSMR collection), 584 (Promiscuous and Specific Inhibitors of AmpC Beta-Lactamase (assay with detergent) - a screen of the old NIH MLSMR collection), 1003 (Confirmation Cuvette-Based Assay for Inhibitors of AmpC Beta-Lactamase (assay with detergent))] ChEMBL. No reference
Potency (functional) 4.6535 uM PUBCHEM_BIOASSAY: Primary qHTS for delayed death inhibitors of the malarial parasite plastid, 96 hour incubation. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488745, AID488752, AID488774, AID504848, AID504850] ChEMBL. No reference
Potency (binding) 17.7828 uM PubChem BioAssay. qHTS Assay for Inhibitors of MBNL1-poly(CUG) RNA binding. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 89.1251 uM PUBCHEM_BIOASSAY: qHTS for Inhibitors of Polymerase Iota. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID588623] ChEMBL. No reference

Phenotypes

Whole-cell/tissue/organism interactions

Species name Source Reference Is orphan
Plasmodium falciparum ChEMBL23

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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