Detailed information for compound 646961

Basic information

Technical information
  • TDR Targets ID: 646961
  • Name: 4-chloro-N-[3-[[2-nitro-4-(trifluoromethyl)ph enyl]amino]propyl]benzenesulfonamide
  • MW: 437.821 | Formula: C16H15ClF3N3O4S
  • H donors: 2 H acceptors: 4 LogP: 4.82 Rotable bonds: 9
    Rule of 5 violations (Lipinski): 1
  • SMILES: Clc1ccc(cc1)S(=O)(=O)NCCCNc1ccc(cc1[N+](=O)[O-])C(F)(F)F
  • InChi: 1S/C16H15ClF3N3O4S/c17-12-3-5-13(6-4-12)28(26,27)22-9-1-8-21-14-7-2-11(16(18,19)20)10-15(14)23(24)25/h2-7,10,21-22H,1,8-9H2
  • InChiKey: OEUGIIQAUGMPQW-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • A2481/0105409

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
Echinococcus multilocularis cAMP specific 3',5' cyclic phosphodiesterase 0.00916261 0.838209 0.838209
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0037298 0.272329 0.272329
Echinococcus multilocularis neuropeptide FF receptor 2 0.0037298 0.272329 0.272329
Onchocerca volvulus 0.0037298 0.272329 0.146796
Trichomonas vaginalis ATP-binding cassette transporter, putative 0.00200277 0.0924434 0.0924434
Schistosoma mansoni multidrug resistance protein 0.00252781 0.147131 0.147131
Loa Loa (eye worm) hypothetical protein 0.0037298 0.272329 0.324894
Echinococcus multilocularis glycine receptor subunit alpha 1 0.00506784 0.411699 0.411699
Loa Loa (eye worm) gonadotropin-releasing hormone receptor 2 0.0037298 0.272329 0.324894
Loa Loa (eye worm) hypothetical protein 0.0037298 0.272329 0.324894
Echinococcus granulosus ATP binding cassette subfamily B MDR:TAP 0.00252781 0.147131 0.147131
Brugia malayi sulfakinin receptor protein 0.0037298 0.272329 0.272329
Trichomonas vaginalis lipid A export ATP-binding/permease protein msba, putative 0.00252781 0.147131 0.147131
Echinococcus granulosus tachykinin peptides receptor 99D 0.0037298 0.272329 0.272329
Echinococcus granulosus Transglutaminase 0.0107159 1 1
Brugia malayi Voltage-gated potassium channel, HERG (KCNH2)-related. C. elegans unc-103 ortholog 0.00503358 0.408131 0.408131
Mycobacterium tuberculosis Conserved protein 0.0107159 1 1
Loa Loa (eye worm) hypothetical protein 0.0037298 0.272329 0.324894
Echinococcus multilocularis 7TM GPCR, rhodopsin 0.0037298 0.272329 0.272329
Echinococcus granulosus tm gpcr rhodopsin 0.0037298 0.272329 0.272329
Loa Loa (eye worm) hypothetical protein 0.0037298 0.272329 0.324894
Giardia lamblia Transglutaminase/protease, putative 0.0107159 1 1
Schistosoma mansoni thyrotropin-releasing hormone receptor 0.0037298 0.272329 0.272329
Trichomonas vaginalis ATP-binding cassette transporter, putative 0.00252781 0.147131 0.147131
Loa Loa (eye worm) hypothetical protein 0.0037298 0.272329 0.324894
Echinococcus granulosus rhodopsin orphan GPCR 0.0037298 0.272329 0.272329
Brugia malayi hypothetical protein 0.0037298 0.272329 0.272329
Trichomonas vaginalis lipid A export ATP-binding/permease protein msba, putative 0.00252781 0.147131 0.147131
Loa Loa (eye worm) hypothetical protein 0.0037298 0.272329 0.324894
Schistosoma mansoni peptide (FMRFamide/neurokinin-3)-like receptor 0.0037298 0.272329 0.272329
Loa Loa (eye worm) TYRA-2 protein 0.0037298 0.272329 0.324894
Loa Loa (eye worm) GABA receptor subunit 0.00458259 0.361156 0.430866
Loa Loa (eye worm) hypothetical protein 0.0037298 0.272329 0.324894
Loa Loa (eye worm) hypothetical protein 0.0037298 0.272329 0.324894
Echinococcus multilocularis tm gpcr rhodopsin gpcr rhodopsin superfamily 0.0037298 0.272329 0.272329
Schistosoma mansoni amine GPCR 0.0037298 0.272329 0.272329
Echinococcus multilocularis ATP binding cassette subfamily B (MDR:TAP) 0.00252781 0.147131 0.147131
Echinococcus multilocularis Cys loop ligand gated ion channel subunit 0.00506784 0.411699 0.411699
Schistosoma mansoni amine GPCR 0.0037298 0.272329 0.272329
Echinococcus granulosus g protein linked acetylcholine receptor gar 2a 0.0037298 0.272329 0.272329
Trichomonas vaginalis multidrug resistance protein 1, 2, putative 0.00252781 0.147131 0.147131
Schistosoma mansoni hypothetical protein 0.0037298 0.272329 0.272329
Loa Loa (eye worm) multidrug resistance protein 3 0.00252781 0.147131 0.17553
Brugia malayi larval opioid receptor 0.0037298 0.272329 0.272329
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.00153131 0.0433358 0.0491589
Schistosoma mansoni myosin xvIII 0.0037298 0.272329 0.272329
Trichomonas vaginalis multidrug resistance protein 1, 2, putative 0.00252781 0.147131 0.147131
Echinococcus granulosus neuropeptides capa receptor 0.0037298 0.272329 0.272329
Loa Loa (eye worm) hypothetical protein 0.0037298 0.272329 0.324894
Echinococcus multilocularis cAMP specific 3',5' cyclic phosphodiesterase 0.00916261 0.838209 0.838209
Schistosoma mansoni biogenic amine (octopamine/dopamine) receptor 0.0037298 0.272329 0.272329
Toxoplasma gondii ABC transporter transmembrane region domain-containing protein 0.00252781 0.147131 0.166902
Echinococcus multilocularis serotonin receptor 0.0037298 0.272329 0.272329
Schistosoma mansoni histamine-responsive GPCR (AAF21638) 0.0037298 0.272329 0.272329
Echinococcus multilocularis neuropeptides capa receptor 0.0037298 0.272329 0.272329
Schistosoma mansoni biogenic amine (dopamine) receptor 0.0037298 0.272329 0.272329
Brugia malayi hypothetical protein 0.0037298 0.272329 0.272329
Schistosoma mansoni hypothetical protein 0.0107159 1 1
Echinococcus multilocularis ATP binding cassette subfamily B (MDR:TAP) 0.00252781 0.147131 0.147131
Schistosoma mansoni hypothetical protein 0.0037298 0.272329 0.272329
Echinococcus granulosus ATP binding cassette subfamily B MDR:TAP 0.00252781 0.147131 0.147131
Echinococcus granulosus Cys loop ligand gated ion channel subunit 0.00450112 0.35267 0.35267
Brugia malayi Cyclic-nucleotide gated cation channel 0.00112956 0.00148989 0.00148989
Echinococcus granulosus cyclic nucleotide gated cation channel 0.00112956 0.00148989 0.00148989
Echinococcus granulosus multidrug resistance protein 1 0.00252781 0.147131 0.147131
Onchocerca volvulus 0.0037298 0.272329 0.146796
Schistosoma mansoni ancient conserved domain protein 2 (cyclin m2) 0.0037298 0.272329 0.272329
Mycobacterium leprae Conserved hypothetical protein 0.0107159 1 0.5
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0037298 0.272329 0.272329
Brugia malayi Melatonin receptor type 1A 0.0037298 0.272329 0.272329
Echinococcus granulosus potassium:sodium hyperpolarization activated 0.00112956 0.00148989 0.00148989
Echinococcus granulosus dro:myosuppressin receptor 0.0037298 0.272329 0.272329
Brugia malayi hypothetical protein 0.0037298 0.272329 0.272329
Loa Loa (eye worm) cyclic AMP specific phosphodiesterase PDE4D5A 0.00804735 0.722045 0.861413
Echinococcus multilocularis ATP binding cassette subfamily B (MDR:TAP) 0.00252781 0.147131 0.147131
Schistosoma mansoni voltage-gated potassium channel 0.00164559 0.0552396 0.0552396
Loa Loa (eye worm) hypothetical protein 0.0037298 0.272329 0.324894
Loa Loa (eye worm) hypothetical protein 0.0037298 0.272329 0.324894
Brugia malayi Cytochrome P450 family protein 0.00185133 0.0766686 0.0766686
Schistosoma mansoni camp-specific 35-cyclic phosphodiesterase 0.00916261 0.838209 0.838209
Echinococcus multilocularis Transglutaminase 0.0107159 1 1
Loa Loa (eye worm) hypothetical protein 0.00252053 0.146373 0.174625
Loa Loa (eye worm) hypothetical protein 0.0037298 0.272329 0.324894
Echinococcus granulosus g protein linked acetylcholine receptor gar 2a 0.0037298 0.272329 0.272329
Echinococcus granulosus neuropeptide s receptor 0.0037298 0.272329 0.272329
Entamoeba histolytica P-glycoprotein-2 0.00252781 0.147131 0.5
Loa Loa (eye worm) hypothetical protein 0.0037298 0.272329 0.324894
Loa Loa (eye worm) hypothetical protein 0.0037298 0.272329 0.324894
Entamoeba histolytica P-glyco protein 6, putative 0.00252781 0.147131 0.5
Echinococcus granulosus allatostatin A receptor 0.0037298 0.272329 0.272329
Echinococcus granulosus thyrotropin releasing hormone receptor 0.0037298 0.272329 0.272329
Echinococcus multilocularis neuropeptide Y receptor 0.0037298 0.272329 0.272329
Echinococcus granulosus potassium voltage gated channel subfamily H 0.00164559 0.0552396 0.0552396
Onchocerca volvulus Neuropeptide F receptor homolog 0.0037298 0.272329 0.146796
Loa Loa (eye worm) hypothetical protein 0.0037298 0.272329 0.324894
Loa Loa (eye worm) hypothetical protein 0.0037298 0.272329 0.324894
Echinococcus granulosus rhodopsin orphan GPCR 0.0037298 0.272329 0.272329
Echinococcus granulosus fmrfamide receptor 0.0037298 0.272329 0.272329
Schistosoma mansoni voltage-gated potassium channel 0.00112956 0.00148989 0.00148989
Echinococcus multilocularis ATP binding cassette subfamily B (MDR:TAP) 0.00252781 0.147131 0.147131
Trichomonas vaginalis ABC transporter, putative 0.00252781 0.147131 0.147131
Onchocerca volvulus 0.0037298 0.272329 0.146796
Brugia malayi Dopamine receptor protein 1 0.0037298 0.272329 0.272329
Echinococcus granulosus biogenic amine 5HT receptor 0.0037298 0.272329 0.272329
Echinococcus multilocularis tachykinin peptides receptor 99D 0.0037298 0.272329 0.272329
Schistosoma mansoni histamine h1 receptor 0.0037298 0.272329 0.272329
Echinococcus granulosus ATP binding cassette subfamily B MDR:TAP 0.00252781 0.147131 0.147131
Brugia malayi Serotonin receptor 0.0037298 0.272329 0.272329
Schistosoma mansoni peptide (allatostatin/somatostatin)-like receptor 0.0037298 0.272329 0.272329
Leishmania major p-glycoprotein 0.00252781 0.147131 1
Trichomonas vaginalis multidrug resistance protein 1, 2, putative 0.00252781 0.147131 0.147131
Brugia malayi Cytochrome P450 family protein 0.00116645 0.00533223 0.00533223
Trichomonas vaginalis ABC transporter, half transporter, putative 0.00252781 0.147131 0.147131
Schistosoma mansoni smdr2 0.00252781 0.147131 0.147131
Schistosoma mansoni cyclic-nucleotide-gated cation channel 0.00112956 0.00148989 0.00148989
Brugia malayi gonadotropin-releasing hormone receptor 2 0.0037298 0.272329 0.272329
Echinococcus multilocularis ATP binding cassette subfamily B (MDR:TAP) 0.00252781 0.147131 0.147131
Echinococcus multilocularis glycine receptor subunit alpha 1 0.00506784 0.411699 0.411699
Entamoeba histolytica P-glycoprotein-1 0.00252781 0.147131 0.5
Schistosoma mansoni neuropeptide F-like receptor 0.0037298 0.272329 0.272329
Schistosoma mansoni muscarinic acetylcholine (GAR) receptor 0.0037298 0.272329 0.272329
Brugia malayi hypothetical protein 0.0037298 0.272329 0.272329
Echinococcus multilocularis growth hormone secretagogue receptor type 1 0.0037298 0.272329 0.272329
Echinococcus granulosus neuropeptides capa receptor 0.0037298 0.272329 0.272329
Schistosoma mansoni voltage-gated potassium channel 0.00554961 0.461881 0.461881
Trichomonas vaginalis multidrug resistance protein 1, 2, putative 0.00252781 0.147131 0.147131
Brugia malayi Thioredoxin family protein 0.0107159 1 1
Loa Loa (eye worm) hypothetical protein 0.0037298 0.272329 0.324894
Trichomonas vaginalis voltage and ligand gated potassium channel, putative 0.00112956 0.00148989 0.00148989
Echinococcus multilocularis rhodopsin orphan GPCR 0.0037298 0.272329 0.272329
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0037298 0.272329 0.272329
Loa Loa (eye worm) hypothetical protein 0.00916261 0.838209 1
Loa Loa (eye worm) melatonin receptor type 1A 0.0037298 0.272329 0.324894
Trichomonas vaginalis voltage and ligand gated potassium channel, putative 0.00461753 0.364795 0.364795
Echinococcus multilocularis cAMP specific 3',5' cyclic phosphodiesterase 0.00804735 0.722045 0.722045
Brugia malayi Dopamine receptor protein 2 0.0037298 0.272329 0.272329
Mycobacterium tuberculosis Hypothetical protein 0.0107159 1 1
Echinococcus multilocularis ATP binding cassette sub family B 0.00252053 0.146373 0.146373
Trichomonas vaginalis ABC transporter, half transporter, putative 0.00252781 0.147131 0.147131
Loa Loa (eye worm) hypothetical protein 0.0037298 0.272329 0.324894
Onchocerca volvulus 0.0037298 0.272329 0.146796
Trichomonas vaginalis lipid A export ATP-binding/permease protein msba, putative 0.00252781 0.147131 0.147131
Schistosoma mansoni cyclic-nucleotide-gated cation channel 0.00112956 0.00148989 0.00148989
Giardia lamblia Hypothetical protein 0.0107159 1 1
Onchocerca volvulus 0.0037298 0.272329 0.146796
Loa Loa (eye worm) hypothetical protein 0.0037298 0.272329 0.324894
Echinococcus granulosus neuropeptide Y receptor 0.0037298 0.272329 0.272329
Trichomonas vaginalis ABC transporter, putative 0.00252781 0.147131 0.147131
Brugia malayi Dopamine receptor 0.0037298 0.272329 0.272329
Echinococcus multilocularis orexin receptor type 2 0.0037298 0.272329 0.272329
Echinococcus multilocularis neuropeptide s receptor 0.0037298 0.272329 0.272329
Brugia malayi hypothetical protein 0.0037298 0.272329 0.272329
Echinococcus granulosus hypothetical protein 0.0037298 0.272329 0.272329
Loa Loa (eye worm) hypothetical protein 0.00164559 0.0552396 0.0659019
Loa Loa (eye worm) hypothetical protein 0.0037298 0.272329 0.324894
Brugia malayi hypothetical protein 0.0037298 0.272329 0.272329
Onchocerca volvulus 0.0037298 0.272329 0.146796
Mycobacterium tuberculosis Conserved hypothetical protein 0.0107159 1 1
Echinococcus granulosus rhodopsin orphan GPCR 0.0037298 0.272329 0.272329
Loa Loa (eye worm) G-protein coupled receptor 0.0037298 0.272329 0.324894
Schistosoma mansoni neuropeptide f receptor 76f 0.0037298 0.272329 0.272329
Echinococcus multilocularis rhodopsin orphan GPCR 0.0037298 0.272329 0.272329
Onchocerca volvulus 0.0037298 0.272329 0.146796
Trypanosoma brucei cytochrome P450, putative 0.00116645 0.00533223 1
Loa Loa (eye worm) hypothetical protein 0.00432007 0.333812 0.398244
Echinococcus granulosus cyclic nucleotide gated cation channel 0.00112956 0.00148989 0.00148989
Schistosoma mansoni adenoreceptor 0.0037298 0.272329 0.272329
Mycobacterium tuberculosis Conserved hypothetical protein 0.0107159 1 1
Echinococcus granulosus orexin receptor type 2 0.0037298 0.272329 0.272329
Echinococcus multilocularis allatostatin A receptor 0.0037298 0.272329 0.272329
Echinococcus granulosus hyperpolarization activated cyclic 0.00112956 0.00148989 0.00148989
Echinococcus granulosus ATP binding cassette subfamily B MDR:TAP 0.00252781 0.147131 0.147131
Entamoeba histolytica P-glycoprotein-2, putative 0.00252781 0.147131 0.5
Loa Loa (eye worm) hypothetical protein 0.0037298 0.272329 0.324894
Loa Loa (eye worm) neuropeptide F receptor 0.0037298 0.272329 0.324894
Loa Loa (eye worm) hypothetical protein 0.00506784 0.411699 0.491165
Loa Loa (eye worm) hypothetical protein 0.0037298 0.272329 0.324894
Schistosoma mansoni neuropeptide receptor 0.0037298 0.272329 0.272329
Brugia malayi ABC transporter family protein 0.00252781 0.147131 0.147131
Echinococcus multilocularis glycine receptor subunit beta 0.00506784 0.411699 0.411699
Echinococcus multilocularis rhodopsin orphan GPCR 0.0037298 0.272329 0.272329
Loa Loa (eye worm) glutamate-gated chloride channel alpha3A subunit 0.00450112 0.35267 0.420742
Loa Loa (eye worm) cyclic-nucleotide gated cation channel 0.00112956 0.00148989 0.00177747
Mycobacterium ulcerans transglutaminase family protein 0.0107159 1 1
Loa Loa (eye worm) hypothetical protein 0.0037298 0.272329 0.324894
Echinococcus multilocularis g protein linked acetylcholine receptor gar 2a 0.0037298 0.272329 0.272329
Echinococcus granulosus sex peptide receptor 0.0037298 0.272329 0.272329
Schistosoma mansoni neuropeptide receptor 0.0037298 0.272329 0.272329
Schistosoma mansoni biogenic amine receptor 0.0037298 0.272329 0.272329
Echinococcus granulosus rhodopsin orphan GPCR 0.0037298 0.272329 0.272329
Loa Loa (eye worm) G-protein coupled receptor 0.0037298 0.272329 0.324894
Schistosoma mansoni Cys-loop ligand gated ion channel subunit 0.00506784 0.411699 0.411699
Brugia malayi Probable 3',5'-cyclic phosphodiesterase R153.1, putative 0.00804735 0.722045 0.722045
Schistosoma mansoni neuropeptide receptor 0.0037298 0.272329 0.272329
Trichomonas vaginalis ATP-binding cassette transporter, putative 0.00252781 0.147131 0.147131
Echinococcus multilocularis neuropeptide receptor 0.0037298 0.272329 0.272329
Trichomonas vaginalis taga, putative 0.00252781 0.147131 0.147131
Echinococcus granulosus cAMP specific 3'5' cyclic phosphodiesterase 0.00916261 0.838209 0.838209
Loa Loa (eye worm) hypothetical protein 0.00112956 0.00148989 0.00177747
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0037298 0.272329 0.272329
Brugia malayi neuropeptide F receptor 0.0037298 0.272329 0.272329
Echinococcus multilocularis multidrug resistance protein 1 0.00252781 0.147131 0.147131
Loa Loa (eye worm) hypothetical protein 0.0037298 0.272329 0.324894
Trichomonas vaginalis ATP-binding cassette transporter, putative 0.00252781 0.147131 0.147131
Schistosoma mansoni hyperpolarization activated cyclic nucleotide-gated potassium channel 0.00112956 0.00148989 0.00148989
Loa Loa (eye worm) voltage and ligand gated potassium channel 0.00503358 0.408131 0.486908
Schistosoma mansoni multidrug resistance protein 0.00252781 0.147131 0.147131
Brugia malayi glutamate-gated chloride channel alpha3A subunit, putative 0.00458259 0.361156 0.361156
Entamoeba histolytica P-glycoprotein 5, putative 0.00252781 0.147131 0.5
Echinococcus granulosus multidrug resistance protein 1 0.00200277 0.0924434 0.0924434
Trichomonas vaginalis ABC transporter, putative 0.00252781 0.147131 0.147131
Brugia malayi G-protein coupled receptor 0.0037298 0.272329 0.272329
Schistosoma mansoni biogenic amine (dopamine) receptor 0.0037298 0.272329 0.272329
Loa Loa (eye worm) hypothetical protein 0.0037298 0.272329 0.324894
Echinococcus multilocularis rhodopsin orphan GPCR 0.0037298 0.272329 0.272329
Echinococcus multilocularis peptide (allatostatin:somatostatin) 0.0037298 0.272329 0.272329
Brugia malayi putative neuropeptide receptor 0.0037298 0.272329 0.272329
Giardia lamblia CAMP-specific 3,5-cyclic phosphodiesterase 4B 0.00916261 0.838209 0.838209
Onchocerca volvulus 0.0037298 0.272329 0.146796
Echinococcus granulosus cAMP specific 3'5' cyclic phosphodiesterase 0.00804735 0.722045 0.722045
Trichomonas vaginalis peptide N-glycanase, putative 0.0107159 1 1
Schistosoma mansoni amine GPCR 0.0037298 0.272329 0.272329
Schistosoma mansoni neuropeptide F-like receptor 0.0037298 0.272329 0.272329
Loa Loa (eye worm) hypothetical protein 0.00252781 0.147131 0.17553
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.00957866 0.881545 1
Loa Loa (eye worm) hypothetical protein 0.0037298 0.272329 0.324894
Echinococcus granulosus neuropeptide Y receptor 0.0037298 0.272329 0.272329
Echinococcus granulosus g-protein coupled receptor 0.0037298 0.272329 0.272329
Loa Loa (eye worm) G-protein-linked acetylcholine receptor protein 2 0.0037298 0.272329 0.324894
Schistosoma mansoni amine GPCR 0.0037298 0.272329 0.272329
Brugia malayi hypothetical protein 0.0037298 0.272329 0.272329
Echinococcus granulosus Cys loop ligand gated ion channel subunit 0.00506784 0.411699 0.411699
Loa Loa (eye worm) hypothetical protein 0.0037298 0.272329 0.324894
Echinococcus multilocularis neuropeptide receptor 0.0037298 0.272329 0.272329
Schistosoma mansoni voltage-gated potassium channel 0.00164559 0.0552396 0.0552396
Echinococcus multilocularis rhodopsin orphan GPCR 0.0037298 0.272329 0.272329
Brugia malayi follicle stimulating hormone receptor 0.0037298 0.272329 0.272329
Echinococcus multilocularis rhodopsin orphan GPCR 0.0037298 0.272329 0.272329
Loa Loa (eye worm) hypothetical protein 0.00252781 0.147131 0.17553
Brugia malayi Tachykinin-like peptides receptor 99D 0.0037298 0.272329 0.272329
Schistosoma mansoni biogenic amine (5HT) receptor 0.0037298 0.272329 0.272329
Brugia malayi hypothetical protein 0.0037298 0.272329 0.272329
Echinococcus multilocularis dro:myosuppressin receptor 0.0037298 0.272329 0.272329
Echinococcus multilocularis sex peptide receptor 0.0037298 0.272329 0.272329
Echinococcus granulosus tm gpcr rhodopsin 0.0037298 0.272329 0.272329
Trichomonas vaginalis abcb9, putative 0.00252781 0.147131 0.147131
Loa Loa (eye worm) neuropeptide F receptor 0.0037298 0.272329 0.324894
Onchocerca volvulus 0.0037298 0.272329 0.146796
Trichomonas vaginalis abcb9, putative 0.00252781 0.147131 0.147131
Trichomonas vaginalis voltage and ligand gated potassium channel, putative 0.00461753 0.364795 0.364795
Onchocerca volvulus 0.0037298 0.272329 0.146796
Brugia malayi glutamate-gated chloride channel alpha3A subunit, putative 0.00450112 0.35267 0.35267
Schistosoma mansoni growth hormone secretagogue receptor 0.0037298 0.272329 0.272329
Schistosoma mansoni hypothetical protein 0.0037298 0.272329 0.272329
Echinococcus multilocularis pyroglutamylated rfamide peptide receptor 0.0037298 0.272329 0.272329
Loa Loa (eye worm) cytochrome P450 family protein 0.00185133 0.0766686 0.0914671
Trichomonas vaginalis lipid A export ATP-binding/permease protein msba, putative 0.00252781 0.147131 0.147131
Brugia malayi Cytochrome P450 family protein 0.00116645 0.00533223 0.00533223
Echinococcus granulosus cAMP specific 3'5' cyclic phosphodiesterase 0.00916261 0.838209 0.838209
Echinococcus granulosus somatostatin receptor 0.0037298 0.272329 0.272329
Mycobacterium tuberculosis Long conserved protein 0.0107159 1 1
Echinococcus multilocularis Cys loop ligand gated ion channel subunit 0.00450112 0.35267 0.35267
Loa Loa (eye worm) hypothetical protein 0.0037298 0.272329 0.324894
Echinococcus granulosus g protein coupled receptor 0.0037298 0.272329 0.272329
Entamoeba histolytica P-glycoprotein-5 0.00252781 0.147131 0.5
Trypanosoma cruzi cytochrome P450, putative 0.00116645 0.00533223 1
Loa Loa (eye worm) hypothetical protein 0.0037298 0.272329 0.324894
Trichomonas vaginalis lipid A export ATP-binding/permease protein msba, putative 0.00252781 0.147131 0.147131
Loa Loa (eye worm) hypothetical protein 0.0037298 0.272329 0.324894
Loa Loa (eye worm) cytochrome P450 family protein 0.00116645 0.00533223 0.00636146
Brugia malayi Cation transporter family protein 0.00506784 0.411699 0.411699
Echinococcus multilocularis g protein coupled receptor 0.0037298 0.272329 0.272329
Brugia malayi GnHR receptor homolog 0.0037298 0.272329 0.272329
Onchocerca volvulus 0.0037298 0.272329 0.146796
Trichomonas vaginalis abcb9, putative 0.00252781 0.147131 0.147131
Chlamydia trachomatis ABC transporter ATP binding protein/permease 0.00252781 0.147131 0.5
Echinococcus multilocularis somatostatin receptor 0.0037298 0.272329 0.272329
Brugia malayi ORL1-like opioid receptor 0.0037298 0.272329 0.272329
Schistosoma mansoni biogenic amine (dopamine) receptor 0.0037298 0.272329 0.272329
Loa Loa (eye worm) cytochrome P450 family protein 0.00116645 0.00533223 0.00636146
Echinococcus granulosus multidrug resistance protein 1 0.00252781 0.147131 0.147131
Echinococcus granulosus multidrug resistance protein 1 0.00252781 0.147131 0.147131
Brugia malayi hypothetical protein 0.0037298 0.272329 0.272329
Echinococcus multilocularis rhodopsin orphan GPCR 0.0037298 0.272329 0.272329
Brugia malayi Dopamine receptor protein 1, putative (partial) 0.0037298 0.272329 0.272329
Echinococcus granulosus glycine receptor subunit alpha 1 0.00506784 0.411699 0.411699
Echinococcus granulosus multidrug resistance protein 1 0.00200277 0.0924434 0.0924434
Echinococcus granulosus potassium voltage gated channel subfamily H 0.00503358 0.408131 0.408131
Brugia malayi AKH receptor 0.0037298 0.272329 0.272329
Brugia malayi multidrug resistance protein 3 0.00252781 0.147131 0.147131
Trichomonas vaginalis ATP-binding cassette transporter, putative 0.00252781 0.147131 0.147131
Echinococcus granulosus glycine receptor subunit beta 0.00506784 0.411699 0.411699
Loa Loa (eye worm) hypothetical protein 0.0037298 0.272329 0.324894
Leishmania major cytochrome p450-like protein 0.00116645 0.00533223 0.0362413
Schistosoma mansoni biogenic amine receptor 0.0037298 0.272329 0.272329
Echinococcus granulosus pyroglutamylated rfamide peptide receptor 0.0037298 0.272329 0.272329
Echinococcus multilocularis multidrug resistance protein 1 0.00252781 0.147131 0.147131
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0037298 0.272329 0.272329
Echinococcus granulosus glycine receptor subunit alpha 1 0.00506784 0.411699 0.411699
Echinococcus granulosus G protein coupled 5 hydroxytryptamine receptor 0.0037298 0.272329 0.272329
Brugia malayi neuropeptide F receptor 0.0037298 0.272329 0.272329
Onchocerca volvulus 0.0107159 1 1
Loa Loa (eye worm) hypothetical protein 0.0037298 0.272329 0.324894
Brugia malayi G protein-coupled receptor 0.0037298 0.272329 0.272329
Echinococcus granulosus 7tm_1 domain containing protein 0.0037298 0.272329 0.272329
Loa Loa (eye worm) hypothetical protein 0.0037298 0.272329 0.324894
Onchocerca volvulus 0.0037298 0.272329 0.146796
Loa Loa (eye worm) unidentified vitellogenin-linked transcript protein 6 0.0037298 0.272329 0.324894
Echinococcus multilocularis voltage gated potassium channel 0.00164559 0.0552396 0.0552396
Echinococcus granulosus G protein coupled receptor 139 0.0037298 0.272329 0.272329
Echinococcus multilocularis tm gpcr rhodopsin gpcr rhodopsin superfamily 0.0037298 0.272329 0.272329
Echinococcus multilocularis hyperpolarization activated cyclic 0.00112956 0.00148989 0.00148989
Onchocerca volvulus 0.0037298 0.272329 0.146796
Plasmodium vivax multidrug resistance protein 1, putative 0.00252781 0.147131 1
Loa Loa (eye worm) hypothetical protein 0.0037298 0.272329 0.324894
Schistosoma mansoni biogenic amine (5HT) receptor 0.0037298 0.272329 0.272329
Brugia malayi hypothetical protein 0.0037298 0.272329 0.272329
Schistosoma mansoni peptide (allatostatin)-like receptor 0.0037298 0.272329 0.272329
Echinococcus multilocularis hyperpolarization activated cyclic 0.00112956 0.00148989 0.00148989
Echinococcus multilocularis g-protein coupled receptor 0.0037298 0.272329 0.272329
Echinococcus multilocularis fmrfamide receptor 0.0037298 0.272329 0.272329
Echinococcus granulosus 5'partial|ATP binding cassette sub family B 0.00252053 0.146373 0.146373
Trichomonas vaginalis voltage and ligand gated potassium channel, putative 0.00112956 0.00148989 0.00148989
Schistosoma mansoni opsin-like receptor 0.0037298 0.272329 0.272329
Brugia malayi RE15519p 0.0037298 0.272329 0.272329
Schistosoma mansoni cyclic-nucleotide-gated cation channel 0.00112956 0.00148989 0.00148989
Schistosoma mansoni opsin-like receptor 0.0037298 0.272329 0.272329
Echinococcus granulosus glycine receptor subunit alpha 1 0.00506784 0.411699 0.411699
Loa Loa (eye worm) hypothetical protein 0.0037298 0.272329 0.324894
Onchocerca volvulus 0.0037298 0.272329 0.146796
Echinococcus multilocularis g protein linked acetylcholine receptor gar 2a 0.0037298 0.272329 0.272329
Echinococcus granulosus rhodopsin orphan GPCR 0.0037298 0.272329 0.272329
Echinococcus multilocularis potassium:sodium hyperpolarization activated 0.00112956 0.00148989 0.00148989
Loa Loa (eye worm) CYP4Cod1 0.00116645 0.00533223 0.00636146
Loa Loa (eye worm) 5-hydroxytryptamine 2C receptor 0.0037298 0.272329 0.324894
Echinococcus multilocularis neuropeptide receptor A26 0.0037298 0.272329 0.272329
Echinococcus multilocularis g protein coupled receptor 0.0037298 0.272329 0.272329
Leishmania major ATP-binding cassette protein subfamily B, member 2, putative 0.00252781 0.147131 1
Schistosoma mansoni voltage-gated potassium channel 0.00554961 0.461881 0.461881
Brugia malayi Unidentified vitellogenin-linked transcript protein 6, putative 0.0037298 0.272329 0.272329
Loa Loa (eye worm) hypothetical protein 0.00458259 0.361156 0.430866
Schistosoma mansoni hypothetical protein 0.0037298 0.272329 0.272329
Loa Loa (eye worm) hypothetical protein 0.0037298 0.272329 0.324894
Trichomonas vaginalis ABC transporter, putative 0.00252781 0.147131 0.147131
Echinococcus granulosus cyclic nucleotide gated cation channel alpha 3 0.00112956 0.00148989 0.00148989
Echinococcus granulosus alpha 1A adrenergic receptor 0.0037298 0.272329 0.272329
Echinococcus multilocularis glycine receptor subunit beta 0.00506784 0.411699 0.411699
Schistosoma mansoni biogenic amine receptor 0.0037298 0.272329 0.272329
Schistosoma mansoni amine GPCR 0.0037298 0.272329 0.272329
Schistosoma mansoni Cys-loop ligand gated ion channel subunit 0.00506784 0.411699 0.411699
Schistosoma mansoni peptide (FMRFamide/somatostatin)-like receptor 0.0037298 0.272329 0.272329
Brugia malayi Serotonin receptor 0.0037298 0.272329 0.272329
Brugia malayi G-protein-linked acetylcholine receptor protein 2, putative 0.0037298 0.272329 0.272329
Echinococcus multilocularis neuropeptide Y receptor 0.0037298 0.272329 0.272329
Echinococcus multilocularis thyrotropin releasing hormone receptor 0.0037298 0.272329 0.272329
Echinococcus multilocularis rhodopsin orphan GPCR 0.0037298 0.272329 0.272329
Echinococcus granulosus 7TM GPCR rhodopsin 0.0037298 0.272329 0.272329
Trichomonas vaginalis lipid A export ATP-binding/permease protein msba, putative 0.00252781 0.147131 0.147131
Echinococcus granulosus g protein coupled receptor 0.0037298 0.272329 0.272329
Loa Loa (eye worm) hypothetical protein 0.0037298 0.272329 0.324894
Echinococcus granulosus g protein coupled receptor 0.0037298 0.272329 0.272329
Loa Loa (eye worm) ATP-binding cassette sub-family B member 2 0.00252781 0.147131 0.17553
Loa Loa (eye worm) glutamate-gated chloride channel alpha3A subunit 0.00506784 0.411699 0.491165
Schistosoma mansoni hyperpolarization activated cyclic nucleotide-gated potassium channel 0.00112956 0.00148989 0.00148989
Echinococcus granulosus glycine receptor subunit beta 0.00506784 0.411699 0.411699
Echinococcus multilocularis tm gpcr rhodopsin gpcr rhodopsin superfamily 0.0037298 0.272329 0.272329
Loa Loa (eye worm) hypothetical protein 0.0037298 0.272329 0.324894
Loa Loa (eye worm) follicle stimulating hormone receptor 0.0037298 0.272329 0.324894
Brugia malayi Voltage-gated potassium channel, EAG (KCNH1)-related. C. elegans egl-2 ortholog 0.00164559 0.0552396 0.0552396
Echinococcus multilocularis G-protein coupled receptor, putative 0.0037298 0.272329 0.272329
Echinococcus granulosus tm gpcr rhodopsin 0.0037298 0.272329 0.272329
Loa Loa (eye worm) hypothetical protein 0.0037298 0.272329 0.324894
Echinococcus granulosus rhodopsin orphan GPCR 0.0037298 0.272329 0.272329
Trichomonas vaginalis multidrug resistance protein 1, 2, putative 0.00252781 0.147131 0.147131
Trichomonas vaginalis multidrug resistance protein 1, 2, putative 0.00252781 0.147131 0.147131
Loa Loa (eye worm) hypothetical protein 0.0037298 0.272329 0.324894
Echinococcus multilocularis cyclic nucleotide gated cation channel 0.00112956 0.00148989 0.00148989
Echinococcus multilocularis serotonin receptor 0.0037298 0.272329 0.272329
Onchocerca volvulus 0.0037298 0.272329 0.146796
Echinococcus granulosus rhodopsin orphan GPCR 0.0037298 0.272329 0.272329
Mycobacterium ulcerans hypothetical protein 0.0107159 1 1
Entamoeba histolytica P-glycoprotein-2 0.00252781 0.147131 0.5
Trichomonas vaginalis multidrug resistance protein 1, 2, putative 0.00252781 0.147131 0.147131
Schistosoma mansoni peptide (FMRFamide/somatostatin)-like receptor 0.0037298 0.272329 0.272329
Trichomonas vaginalis lipid A export ATP-binding/permease protein msba, putative 0.00252781 0.147131 0.147131
Echinococcus granulosus neuropeptide receptor A26 0.0037298 0.272329 0.272329
Echinococcus granulosus neuropeptide receptor 0.0037298 0.272329 0.272329
Echinococcus multilocularis potassium voltage gated channel subfamily H 0.00503358 0.408131 0.408131
Trichomonas vaginalis lipid A export ATP-binding/permease protein msba, putative 0.00252781 0.147131 0.147131
Echinococcus multilocularis fmrfamide receptor 0.0037298 0.272329 0.272329
Mycobacterium ulcerans putative transglutaminase-like protein 0.0107159 1 1
Loa Loa (eye worm) hypothetical protein 0.0037298 0.272329 0.324894
Mycobacterium leprae Conserved hypothetical protein 0.0107159 1 0.5
Echinococcus granulosus peptide allatostatin:somatostatin 0.0037298 0.272329 0.272329
Loa Loa (eye worm) hypothetical protein 0.0037298 0.272329 0.324894
Echinococcus granulosus biogenic amine 5HT receptor 0.0037298 0.272329 0.272329
Trypanosoma cruzi cytochrome P450, putative 0.00116645 0.00533223 1
Loa Loa (eye worm) cyclic-nucleotide gated cation channel 0.00112956 0.00148989 0.00177747
Loa Loa (eye worm) hypothetical protein 0.0037298 0.272329 0.324894
Brugia malayi G-protein coupled receptor 0.0037298 0.272329 0.272329
Echinococcus multilocularis glycine receptor subunit alpha 1 0.00506784 0.411699 0.411699
Schistosoma mansoni alpha-1 adrenergic receptor 0.0037298 0.272329 0.272329
Echinococcus granulosus serotonin receptor 0.0037298 0.272329 0.272329
Schistosoma mansoni Cys-loop ligand gated ion channel subunit 0.00506784 0.411699 0.411699
Echinococcus granulosus neuropeptide receptor 0.0037298 0.272329 0.272329
Echinococcus multilocularis potassium voltage gated channel subfamily H 0.00164559 0.0552396 0.0552396
Toxoplasma gondii ATP-binding cassette transporter ABC.B1 0.00252781 0.147131 0.166902
Onchocerca volvulus 0.0037298 0.272329 0.146796
Echinococcus multilocularis g protein coupled receptor 0.0037298 0.272329 0.272329
Schistosoma mansoni neuropeptide receptor 0.0037298 0.272329 0.272329
Loa Loa (eye worm) hypothetical protein 0.0037298 0.272329 0.324894
Echinococcus granulosus hyperpolarization activated cyclic 0.00112956 0.00148989 0.00148989
Plasmodium falciparum multidrug resistance protein 1 0.00252781 0.147131 1
Echinococcus granulosus voltage gated potassium channel 0.00164559 0.0552396 0.0552396
Brugia malayi putative neuropeptide receptor NPR1 0.0037298 0.272329 0.272329
Echinococcus granulosus growth hormone secretagogue receptor type 1 0.0037298 0.272329 0.272329
Schistosoma mansoni multidrug resistance protein 0.00252781 0.147131 0.147131
Echinococcus multilocularis G protein coupled 5 hydroxytryptamine receptor 0.0037298 0.272329 0.272329
Onchocerca volvulus 0.0037298 0.272329 0.146796
Brugia malayi Serotonin/octopamine receptor family protein 7 0.0037298 0.272329 0.272329
Brugia malayi G protein-coupled receptor F59B2.13 0.0037298 0.272329 0.272329
Mycobacterium ulcerans hypothetical protein 0.0107159 1 1
Loa Loa (eye worm) hypothetical protein 0.0037298 0.272329 0.324894
Echinococcus multilocularis biogenic amine (5HT) receptor 0.0037298 0.272329 0.272329
Trichomonas vaginalis ATP-binding cassette transporter, putative 0.00252781 0.147131 0.147131
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0037298 0.272329 0.272329
Echinococcus multilocularis G protein coupled receptor 139 0.0037298 0.272329 0.272329
Onchocerca volvulus Dopamine\/Ecdysteroid receptor homolog 0.0037298 0.272329 0.146796
Echinococcus multilocularis alpha 1A adrenergic receptor 0.0037298 0.272329 0.272329
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0037298 0.272329 0.272329
Echinococcus multilocularis neuropeptides capa receptor 0.0037298 0.272329 0.272329
Schistosoma mansoni opsin-like receptor 0.0037298 0.272329 0.272329
Echinococcus granulosus neuropeptide FF receptor 2 0.0037298 0.272329 0.272329
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0037298 0.272329 0.272329
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0037298 0.272329 0.272329
Echinococcus multilocularis multidrug resistance protein 1 0.00200277 0.0924434 0.0924434
Echinococcus multilocularis cyclic nucleotide gated cation channel alpha 3 0.00112956 0.00148989 0.00148989

Activities

Activity type Activity value Assay description Source Reference
EC50 (functional) = 15 uM Plasmodium falciparum 3D7 EC50 (uM) as measured by SYBR green dye Saint Jude. 20485428
EC50 (functional) = 15 uM Plasmodium falciparum K1 EC50 (uM) as measured by SYBR green dye Saint Jude. 20485428
EC50 (functional) > 15 uM ST_JUDE: Plasmodium falciparum K1 EC50 (uM) as measured by SYBR green dye ChEMBL. 20485428
EC50 (functional) > 15 uM ST_JUDE: Plasmodium falciparum 3D7 EC50 (uM) as measured by SYBR green dye ChEMBL. 20485428
Percent growth inhibition (functional) = -3.5 % Plasmodium falciparum 3D7 % growth inhibition at 7uM as measured by SYBR green dye Saint Jude. 20485428
Percent growth inhibition (functional) = -1.8 % Plasmodium falciparum 3D7 % growth inhibition at 7uM as measured by YOYO-3 red dye Saint Jude. 20485428

Phenotypes

Whole-cell/tissue/organism interactions

Species name Source Reference Is orphan
Plasmodium falciparum ChEMBL23 20485428

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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