Detailed information for compound 1571015

Basic information

Technical information
  • TDR Targets ID: 1571015
  • Name: N-[2,2,2-trichloro-1-[(1,5-dimethyl-3-oxo-2-p henylpyrazol-4-yl)amino]ethyl]butanamide
  • MW: 419.733 | Formula: C17H21Cl3N4O2
  • H donors: 2 H acceptors: 2 LogP: 4.89 Rotable bonds: 8
    Rule of 5 violations (Lipinski): 1
  • SMILES: CCCC(=O)NC(C(Cl)(Cl)Cl)Nc1c(C)n(n(c1=O)c1ccccc1)C
  • InChi: 1S/C17H21Cl3N4O2/c1-4-8-13(25)21-16(17(18,19)20)22-14-11(2)23(3)24(15(14)26)12-9-6-5-7-10-12/h5-7,9-10,16,22H,4,8H2,1-3H3,(H,21,25)
  • InChiKey: INWJCRWBMKWZER-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • N-[2,2,2-trichloro-1-[(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)amino]ethyl]butanamide
  • N-[2,2,2-trichloro-1-[(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)amino]ethyl]butanamide
  • N-[2,2,2-trichloro-1-[(3-keto-1,5-dimethyl-2-phenyl-pyrazol-4-yl)amino]ethyl]butyramide
  • ST5033663
  • BAS 00278711
  • CBDivE_004742
  • MLS000709283
  • AG-690/34653038
  • SMR000289950

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
Schistosoma mansoni acetylcholine receptor-related 0.0127 0.0385 0.1687
Echinococcus granulosus Pyruvate dehydrogenase lipoamide kinase 0.0062 0.0049 0.0085
Plasmodium falciparum DNA gyrase subunit B 0.1985 1 1
Chlamydia trachomatis DNA gyrase subunit B 0.1301 0.6463 0.6446
Toxoplasma gondii LsmAD domain-containing protein 0.0082 0.015 0.0179
Treponema pallidum DNA gyrase, subunit B (gyrB) 0.1985 1 1
Loa Loa (eye worm) hypothetical protein 0.0276 0.1153 0.1241
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.0065 0.0065 0.0123
Loa Loa (eye worm) hypothetical protein 0.0958 0.4687 0.515
Leishmania major DNA topoisomerase III, putative 0.0142 0.0461 0.0734
Brugia malayi Cation transporter family protein 0.0276 0.1153 0.2158
Brugia malayi Hypothetical glycine receptor like protein T20B12.9 in chromosome III 0.0276 0.1153 0.2158
Trypanosoma cruzi mitochondrial DNA topoisomerase II, putative 0.1147 0.5665 1
Leishmania major hypothetical protein, conserved 0.0082 0.015 0.0179
Loa Loa (eye worm) hypothetical protein 0.0127 0.0385 0.0391
Loa Loa (eye worm) hypothetical protein 0.0127 0.0385 0.0391
Mycobacterium ulcerans glutaminase 0.0279 0.1169 0.1125
Trypanosoma brucei DNA topoisomerase II alpha, putative 0.0322 0.1393 0.2393
Wolbachia endosymbiont of Brugia malayi DNA gyrase, topoisomerase II, B subunit, GyrB 0.1985 1 1
Loa Loa (eye worm) excitatory GABA receptor EXP-1A 0.0276 0.1153 0.1241
Loa Loa (eye worm) hypothetical protein 0.0322 0.1393 0.1507
Plasmodium vivax DNA topoisomerase II, putative 0.0464 0.2128 0.2089
Mycobacterium tuberculosis DNA gyrase (subunit B) GyrB (DNA topoisomerase (ATP-hydrolysing)) (DNA topoisomerase II) (type II DNA topoisomerase) 0.1985 1 1
Schistosoma mansoni glutaminase 0.0279 0.1169 0.5425
Brugia malayi Neurotransmitter-gated ion-channel transmembrane region family protein 0.0148 0.0495 0.0927
Schistosoma mansoni DNA topoisomerase II 0.0464 0.2128 1
Loa Loa (eye worm) latrophilin receptor protein 2 0.0065 0.0065 0.0038
Echinococcus granulosus nicotinic acetylcholine receptor a11 subunit 0.0276 0.1153 0.5353
Schistosoma mansoni nicotinic acetylcholine receptor alpha 0.0148 0.0495 0.2214
Loa Loa (eye worm) ACC-1 protein 0.0276 0.1153 0.1241
Loa Loa (eye worm) hypothetical protein 0.0127 0.0385 0.0391
Trypanosoma brucei DNA topoisomerase III, putative 0.0142 0.0461 0.0734
Schistosoma mansoni hypothetical protein 0.0065 0.0065 0.0163
Onchocerca volvulus Putative DNA topoisomerase 2, mitochondrial 0.0464 0.2128 1
Trypanosoma brucei PAB1-binding protein , putative 0.0082 0.015 0.0179
Loa Loa (eye worm) hypothetical protein 0.0127 0.0385 0.0391
Giardia lamblia DNA topoisomerase III 0.0142 0.0461 0.2347
Echinococcus granulosus GPCR family 2 0.0065 0.0065 0.0163
Loa Loa (eye worm) DNA topoisomerase III 0.0142 0.0461 0.0476
Loa Loa (eye worm) hypothetical protein 0.0276 0.1153 0.1241
Echinococcus multilocularis nicotinic acetylcholine receptor beta 1 subunit 0.0276 0.1153 0.5353
Plasmodium vivax DNA topoisomerase 3, putative 0.0142 0.0461 0.0414
Brugia malayi hypothetical protein 0.0127 0.0385 0.072
Echinococcus granulosus cadherin EGF LAG seven pass G type receptor 0.0065 0.0065 0.0163
Echinococcus multilocularis heat shock protein 90 0.0062 0.0049 0.0085
Loa Loa (eye worm) hypothetical protein 0.0062 0.0049 0.002
Loa Loa (eye worm) hypothetical protein 0.0127 0.0385 0.0391
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0207 0.0797 0.0847
Schistosoma mansoni heat shock protein 0.0062 0.0049 0.0085
Plasmodium vivax DNA gyrase subunit B, putative 0.1985 1 1
Loa Loa (eye worm) hypothetical protein 0.0127 0.0385 0.0391
Echinococcus granulosus nicotinic acetylcholine receptor beta 1 subunit 0.0276 0.1153 0.5353
Echinococcus granulosus glycine receptor subunit beta 0.0276 0.1153 0.5353
Schistosoma mansoni nAChR subunit 0.0276 0.1153 0.5353
Loa Loa (eye worm) hypothetical protein 0.0276 0.1153 0.1241
Loa Loa (eye worm) hypothetical protein 0.0148 0.0495 0.0513
Brugia malayi hypothetical protein 0.0127 0.0385 0.072
Echinococcus granulosus DNA topoisomerase 2 alpha 0.0464 0.2128 1
Trichomonas vaginalis glutaminase, putative 0.0279 0.1169 0.5385
Trypanosoma brucei DNA topoisomerase IA, putative 0.0142 0.0461 0.0734
Schistosoma mansoni pyruvate dehydrogenase 0.0062 0.0049 0.0085
Schistosoma mansoni Cys-loop ligand gated ion channel subunit 0.0276 0.1153 0.5353
Loa Loa (eye worm) hypothetical protein 0.0276 0.1153 0.1241
Leishmania major DNA topoisomerase ii 0.0322 0.1393 0.2393
Loa Loa (eye worm) glutaminase 0.0279 0.1169 0.1258
Echinococcus granulosus gamma aminobutyric acid receptor subunit 0.0127 0.0385 0.1687
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0207 0.0797 0.1491
Brugia malayi Probable DNA topoisomerase II 0.0464 0.2128 0.3981
Echinococcus multilocularis Pyruvate dehydrogenase (lipoamide) kinase 0.0062 0.0049 0.0085
Echinococcus granulosus acetylcholine receptor subunit beta 1 0.0276 0.1153 0.5353
Onchocerca volvulus DNA topoisomerase 2 homolog 0.0464 0.2128 1
Schistosoma mansoni prokaryotic DNA topoisomerase 0.0142 0.0461 0.2051
Echinococcus granulosus Cys loop ligand gated ion channel subunit 0.0127 0.0385 0.1687
Echinococcus multilocularis neuronal acetylcholine receptor subunit alpha 4 0.0276 0.1153 0.5353
Leishmania major DNA topoisomerase III, putative 0.0142 0.0461 0.0734
Trypanosoma cruzi PAB1-binding protein , putative 0.0082 0.015 0.0179
Echinococcus multilocularis gamma aminobutyric acid receptor subunit 0.0127 0.0385 0.1687
Trypanosoma brucei DNA topoisomerase II beta, putative 0.0322 0.1393 0.2393
Schistosoma mansoni hypothetical protein 0.0065 0.0065 0.0163
Brugia malayi acetylcholine receptor alpha subunit precursor, putative 0.0276 0.1153 0.2158
Schistosoma mansoni endoplasmin 0.0062 0.0049 0.0085
Loa Loa (eye worm) hypothetical protein 0.0148 0.0495 0.0513
Echinococcus granulosus DNA topoisomerase 3 beta 1 0.0142 0.0461 0.2051
Brugia malayi heat shock protein 90 0.0062 0.0049 0.0092
Loa Loa (eye worm) hypothetical protein 0.1085 0.5345 0.5878
Echinococcus multilocularis glycine receptor subunit alpha 1 0.0276 0.1153 0.5353
Loa Loa (eye worm) hypothetical protein 0.0322 0.1393 0.1507
Loa Loa (eye worm) glutamate-gated chloride channel alpha3A subunit 0.0276 0.1153 0.1241
Loa Loa (eye worm) hypothetical protein 0.0082 0.015 0.0131
Brugia malayi Calcitonin receptor-like protein seb-1 0.0207 0.0797 0.1491
Brugia malayi DNA topoisomerase III beta-1 0.0142 0.0461 0.0863
Loa Loa (eye worm) hypothetical protein 0.0276 0.1153 0.1241
Brugia malayi nicotinic acetylcholine receptor beta-1 chain precursor 0.0276 0.1153 0.2158
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.0065 0.0065 0.0163
Trypanosoma cruzi DNA topoisomerase II, putative 0.0322 0.1393 0.2393
Brugia malayi excitatory GABA receptor EXP-1A 0.0276 0.1153 0.2158
Echinococcus granulosus glycine receptor subunit beta 0.0276 0.1153 0.5353
Onchocerca volvulus 0.0148 0.0495 0.0634
Echinococcus multilocularis glycine receptor subunit beta 0.0276 0.1153 0.5353
Schistosoma mansoni nAChR subunit 0.0127 0.0385 0.1687
Loa Loa (eye worm) hypothetical protein 0.0127 0.0385 0.0391
Schistosoma mansoni nAChR subunit (ShAR1-beta2-like) 0.0276 0.1153 0.5353
Trypanosoma cruzi DNA topoisomerase III, putative 0.0142 0.0461 0.0734
Treponema pallidum DNA topoisomerase I (topA) 0.0142 0.0461 0.0414
Mycobacterium leprae Probable DNA gyrase (subunit B) GyrB (DNA topoisomerase (ATP-hydrolysing)) (DNA topoisomerase II) (Type II DNA topoisomerase) 0.0683 0.3264 1
Loa Loa (eye worm) hypothetical protein 0.1805 0.907 1
Brugia malayi Neurotransmitter-gated ion-channel ligand binding domain containing protein 0.0127 0.0385 0.072
Loa Loa (eye worm) hypothetical protein 0.0276 0.1153 0.1241
Schistosoma mansoni nAChR subunit (ShAR1-alpha-like) 0.0276 0.1153 0.5353
Echinococcus multilocularis Cys loop ligand gated ion channel subunit 0.0127 0.0385 0.1687
Giardia lamblia DNA topoisomerase II 0.0402 0.1805 1
Brugia malayi glutamate-gated chloride channel alpha3A subunit, putative 0.0127 0.0385 0.072
Onchocerca volvulus 0.0276 0.1153 0.441
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.0065 0.0065 0.0163
Loa Loa (eye worm) hypothetical protein 0.0276 0.1153 0.1241
Echinococcus granulosus glycine receptor subunit alpha 1 0.0276 0.1153 0.5353
Echinococcus multilocularis Cys loop ligand gated ion channel subunit 0.0276 0.1153 0.5353
Loa Loa (eye worm) acetylcholine receptor protein 0.0127 0.0385 0.0391
Echinococcus multilocularis nAChR subunit 0.0276 0.1153 0.5353
Brugia malayi Neurotransmitter-gated ion-channel ligand binding domain containing protein 0.0276 0.1153 0.2158
Giardia lamblia DNA topoisomerase III 0.0142 0.0461 0.2347
Brugia malayi hypothetical protein 0.0127 0.0385 0.072
Schistosoma mansoni nAChR subunit 0.0276 0.1153 0.5353
Echinococcus granulosus glycine receptor subunit alpha 1 0.0276 0.1153 0.5353
Trichomonas vaginalis DNA topoisomerase II, putative 0.0464 0.2128 1
Schistosoma mansoni nAChR subunit 0.0276 0.1153 0.5353
Loa Loa (eye worm) hypothetical protein 0.0148 0.0495 0.0513
Loa Loa (eye worm) hypothetical protein 0.0148 0.0495 0.0513
Trypanosoma cruzi DNA topoisomerase III, putative 0.0142 0.0461 0.0734
Schistosoma mansoni hypothetical protein 0.0065 0.0065 0.0163
Loa Loa (eye worm) hypothetical protein 0.0127 0.0385 0.0391
Loa Loa (eye worm) hypothetical protein 0.0148 0.0495 0.0513
Loa Loa (eye worm) hypothetical protein 0.0127 0.0385 0.0391
Loa Loa (eye worm) GABA receptor subunit 0.0148 0.0495 0.0513
Loa Loa (eye worm) hypothetical protein 0.0276 0.1153 0.1241
Brugia malayi nicotinic acetylcholine receptor alpha subunit, putative 0.0276 0.1153 0.2158
Loa Loa (eye worm) glutamate-gated chloride channel alpha3A subunit 0.0127 0.0385 0.0391
Echinococcus granulosus neuronal acetylcholine receptor subunit alpha 4 0.0276 0.1153 0.5353
Echinococcus multilocularis nicotinic acetylcholine receptor a11 subunit 0.0276 0.1153 0.5353
Loa Loa (eye worm) ligand-Gated ion Channel family member 0.0276 0.1153 0.1241
Plasmodium falciparum ataxin-2 like protein, putative 0.0082 0.015 0.0101
Echinococcus multilocularis nicotinic acetylcholine receptor alpha subunit 0.0276 0.1153 0.5353
Loa Loa (eye worm) hypothetical protein 0.0148 0.0495 0.0513
Brugia malayi DNA topoisomerase III 0.0142 0.0461 0.0863
Brugia malayi hypothetical protein 0.0127 0.0385 0.072
Schistosoma mansoni endoplasmin 0.0062 0.0049 0.0085
Loa Loa (eye worm) hypothetical protein 0.0127 0.0385 0.0391
Brugia malayi kinase, mitochondrial precursor 0.0062 0.0049 0.0092
Brugia malayi Neurotransmitter-gated ion-channel ligand binding domain containing protein 0.0276 0.1153 0.2158
Plasmodium falciparum DNA topoisomerase 3, putative 0.0142 0.0461 0.0414
Echinococcus granulosus nicotinic acetylcholine receptor subunit alpha 8 0.0276 0.1153 0.5353
Brugia malayi Neurotransmitter-gated ion-channel ligand binding domain containing protein 0.0276 0.1153 0.2158
Loa Loa (eye worm) LGC-31 protein 0.0276 0.1153 0.1241
Trypanosoma cruzi PAB1-binding protein , putative 0.0082 0.015 0.0179
Loa Loa (eye worm) hypothetical protein 0.0276 0.1153 0.1241
Schistosoma mansoni nAChR subunit 0.0276 0.1153 0.5353
Toxoplasma gondii DNA topoisomerase family protein 0.0142 0.0461 0.0734
Loa Loa (eye worm) hypothetical protein 0.0276 0.1153 0.1241
Schistosoma mansoni Cys-loop ligand gated ion channel subunit 0.0276 0.1153 0.5353
Brugia malayi DNA gyrase/topoisomerase IV, A subunit family protein 0.0464 0.2128 0.3981
Schistosoma mansoni heat shock protein 0.0062 0.0049 0.0085
Brugia malayi DNA topoisomerase II, alpha isozyme 0.0464 0.2128 0.3981
Brugia malayi latrophilin 2 splice variant baaae 0.0141 0.0458 0.0858
Brugia malayi acetylcholine receptor protein, alpha-like chain, putative 0.0276 0.1153 0.2158
Toxoplasma gondii ATPase/histidine kinase/DNA gyrase B/HSP90 domain-containing protein 0.1147 0.5665 1
Schistosoma mansoni neurotransmitter gated ion channel 0.0127 0.0385 0.1687
Echinococcus multilocularis glycine receptor subunit alpha 1 0.0276 0.1153 0.5353
Echinococcus granulosus heat shock protein 0.0062 0.0049 0.0085
Brugia malayi Hypothetical glycine receptor like protein T20B12.9 in chromosome III 0.0148 0.0495 0.0927
Schistosoma mansoni Cys-loop ligand gated ion channel subunit 0.0148 0.0495 0.2214
Brugia malayi Neurotransmitter-gated ion-channel ligand binding domain containing protein 0.0127 0.0385 0.072
Schistosoma mansoni nAChR subunit 0.0276 0.1153 0.5353
Entamoeba histolytica DNA topoisomerase II, putative 0.0464 0.2128 1
Trichomonas vaginalis prokaryotic DNA topoisomerase, putative 0.0142 0.0461 0.1983
Trypanosoma cruzi DNA topoisomerase IA, putative 0.0142 0.0461 0.0734
Brugia malayi Neuronal acetylcholine receptor protein, alpha-2 chain precursor 0.0127 0.0385 0.072
Echinococcus granulosus DNA topoisomerase 3 alpha 0.0142 0.0461 0.2051
Onchocerca volvulus 0.0148 0.0495 0.0634
Trypanosoma cruzi DNA topoisomerase III, putative 0.0142 0.0461 0.0734
Brugia malayi Endoplasmin precursor 0.0062 0.0049 0.0092
Loa Loa (eye worm) heat shock protein 90 0.0062 0.0049 0.002
Loa Loa (eye worm) hypothetical protein 0.0276 0.1153 0.1241
Brugia malayi Neurotransmitter-gated ion-channel ligand binding domain containing protein 0.0276 0.1153 0.2158
Brugia malayi Acetylcholine receptor protein, alpha-like chain 1 precursor 0.0127 0.0385 0.072
Loa Loa (eye worm) hypothetical protein 0.0276 0.1153 0.1241
Plasmodium falciparum DNA topoisomerase 2 0.0464 0.2128 0.2089
Schistosoma mansoni nAChR subunit 0.0276 0.1153 0.5353
Echinococcus granulosus nAChR subunit 0.0276 0.1153 0.5353
Schistosoma mansoni nAChR subunit 0.0127 0.0385 0.1687
Echinococcus multilocularis heat shock protein 0.0062 0.0049 0.0085
Brugia malayi Latrophilin receptor protein 2 0.0065 0.0065 0.0123
Loa Loa (eye worm) hypothetical protein 0.0127 0.0385 0.0391
Loa Loa (eye worm) TOPoisomerase family member 0.0464 0.2128 0.2319
Echinococcus multilocularis cadherin EGF LAG seven pass G type receptor 0.0065 0.0065 0.0163
Mycobacterium ulcerans DNA gyrase subunit B 0.1985 1 1
Echinococcus granulosus nAChR subunit 0.0148 0.0495 0.2214
Echinococcus multilocularis nicotinic acetylcholine receptor subunit alpha 8 0.0276 0.1153 0.5353
Loa Loa (eye worm) nicotinic acetylcholine receptor non-alpha subunit 0.0276 0.1153 0.1241
Echinococcus multilocularis glycine receptor subunit beta 0.0276 0.1153 0.5353
Loa Loa (eye worm) hypothetical protein 0.0127 0.0385 0.0391
Loa Loa (eye worm) DNA topoisomerase III beta-1 0.0142 0.0461 0.0476
Schistosoma mansoni Cys-loop ligand gated ion channel subunit 0.0276 0.1153 0.5353
Brugia malayi glutaminase DH11.1 0.0279 0.1169 0.2186
Loa Loa (eye worm) hypothetical protein 0.0276 0.1153 0.1241
Schistosoma mansoni acetylcholine receptor subunit beta 0.0127 0.0385 0.1687
Entamoeba histolytica DNA topoisomerase III, putative 0.0142 0.0461 0.1983
Loa Loa (eye worm) neuronal acetylcholine receptor protein 0.0127 0.0385 0.0391
Loa Loa (eye worm) hypothetical protein 0.0127 0.0385 0.0391
Loa Loa (eye worm) acetylcholine receptor alpha subunit 0.0276 0.1153 0.1241
Loa Loa (eye worm) ACC-1 protein 0.0276 0.1153 0.1241
Schistosoma mansoni neurotransmitter gated ion channel 0.0148 0.0495 0.2214
Loa Loa (eye worm) nicotinic acetylcholine receptor alpha subunit 0.0276 0.1153 0.1241
Echinococcus multilocularis Pyruvate dehydrogenase (lipoamide) kinase 0.0062 0.0049 0.0085
Brugia malayi acetylcholine receptor, alpha-type subunit unc-38 precursor 0.0276 0.1153 0.2158
Plasmodium vivax ataxin-2 like protein, putative 0.0082 0.015 0.0101
Trypanosoma brucei DNA topoisomerase III, putative 0.0142 0.0461 0.0734
Echinococcus granulosus nicotinic acetylcholine receptor alpha subunit 0.0276 0.1153 0.5353
Loa Loa (eye worm) hypothetical protein 0.0276 0.1153 0.1241
Onchocerca volvulus 0.0276 0.1153 0.441
Toxoplasma gondii DNA topoisomerase 2, putative 0.0464 0.2128 0.3701
Loa Loa (eye worm) hypothetical protein 0.0141 0.0458 0.0472
Toxoplasma gondii DNA topoisomerase domain-containing protein 0.0142 0.0461 0.0734
Brugia malayi Neurotransmitter-gated ion-channel transmembrane region family protein 0.0276 0.1153 0.2158
Echinococcus granulosus glycine receptor subunit alpha 1 0.0276 0.1153 0.5353
Loa Loa (eye worm) hypothetical protein 0.0065 0.0065 0.0038
Brugia malayi Neurotransmitter-gated ion-channel transmembrane region family protein 0.0148 0.0495 0.0927
Schistosoma mansoni prokaryotic DNA topoisomerase 0.0142 0.0461 0.2051
Echinococcus multilocularis nicotinic acetylcholine receptor subunit type 0.0127 0.0385 0.1687
Onchocerca volvulus 0.0276 0.1153 0.441
Brugia malayi hypothetical protein 0.0082 0.015 0.0281
Loa Loa (eye worm) hypothetical protein 0.0276 0.1153 0.1241
Brugia malayi Cation transporter family protein 0.0276 0.1153 0.2158
Loa Loa (eye worm) hypothetical protein 0.0207 0.0797 0.0847
Trichomonas vaginalis prokaryotic DNA topoisomerase, putative 0.0142 0.0461 0.1983
Schistosoma mansoni nAChR subunit (ShAR1-beta-like) 0.0276 0.1153 0.5353
Brugia malayi glutamate-gated chloride channel alpha3A subunit, putative 0.0148 0.0495 0.0927
Entamoeba histolytica hypothetical protein 0.0148 0.0495 0.2147
Loa Loa (eye worm) hypothetical protein 0.0127 0.0385 0.0391
Echinococcus multilocularis acetylcholine receptor subunit beta 1 0.0276 0.1153 0.5353
Loa Loa (eye worm) endoplasmin 0.0062 0.0049 0.002
Brugia malayi Neurotransmitter-gated ion-channel ligand binding domain containing protein 0.0276 0.1153 0.2158
Schistosoma mansoni nAChR subunit 0.0276 0.1153 0.5353
Entamoeba histolytica DNA topoisomerase III, putative 0.0142 0.0461 0.1983
Loa Loa (eye worm) hypothetical protein 0.0127 0.0385 0.0391
Brugia malayi Neurotransmitter-gated ion-channel ligand binding domain containing protein 0.0127 0.0385 0.072
Brugia malayi hypothetical protein 0.0127 0.0385 0.072
Echinococcus granulosus nicotinic acetylcholine receptor subunit type 0.0276 0.1153 0.5353
Loa Loa (eye worm) hypothetical protein 0.0148 0.0495 0.0513
Onchocerca volvulus Putative nachr subunit 0.0276 0.1153 0.441
Echinococcus granulosus heat shock protein 90 0.0062 0.0049 0.0085
Mycobacterium leprae Probable DNA topoisomerase I TopA (omega-protein) (relaxing enzyme) (untwisting enzyme) (swivelase) (type I DNA topoisomerase) ( 0.0142 0.0461 0.1282
Loa Loa (eye worm) glutaminase 2 0.0279 0.1169 0.1258
Mycobacterium ulcerans DNA topoisomerase I 0.0142 0.0461 0.0414
Brugia malayi GRF zinc finger family protein 0.0142 0.0461 0.0863
Leishmania major mitochondrial DNA topoisomerase II 0.1147 0.5665 1
Brugia malayi Neurotransmitter-gated ion-channel transmembrane region family protein 0.0276 0.1153 0.2158
Echinococcus multilocularis GPCR, family 2 0.0065 0.0065 0.0163
Loa Loa (eye worm) hypothetical protein 0.0276 0.1153 0.1241
Trypanosoma cruzi mitochondrial DNA topoisomerase II, putative 0.1147 0.5665 1
Loa Loa (eye worm) hypothetical protein 0.0148 0.0495 0.0513
Schistosoma mansoni neurotransmitter gated ion channel 0.0127 0.0385 0.1687
Onchocerca volvulus 0.0276 0.1153 0.441
Echinococcus multilocularis DNA topoisomerase 3 beta 1 0.0142 0.0461 0.2051
Echinococcus multilocularis nAChR subunit 0.0148 0.0495 0.2214
Onchocerca volvulus 0.0142 0.0461 0.0438
Trypanosoma cruzi DNA topoisomerase II, putative 0.0322 0.1393 0.2393
Onchocerca volvulus 0.0276 0.1153 0.441
Brugia malayi Neurotransmitter-gated ion-channel transmembrane region family protein 0.0276 0.1153 0.2158
Onchocerca volvulus 0.0276 0.1153 0.441
Echinococcus multilocularis rho GTPase activating protein 20 0.0142 0.0461 0.2051
Schistosoma mansoni hypothetical protein 0.0141 0.0458 0.2037
Wolbachia endosymbiont of Brugia malayi topoisomerase IA, TopA 0.0142 0.0461 0.0414
Trypanosoma cruzi DNA topoisomerase IA, putative 0.0142 0.0461 0.0734
Loa Loa (eye worm) hypothetical protein 0.0276 0.1153 0.1241
Brugia malayi Apoptosis regulator proteins, Bcl-2 family protein 0.0059 0.0031 0.0059
Plasmodium falciparum ataxin-2 like protein, putative 0.0082 0.015 0.0101
Echinococcus multilocularis DNA topoisomerase 2 alpha 0.0464 0.2128 1
Brugia malayi gamma-aminobutyric-acid receptor beta subunit precursor 0.1085 0.5345 1
Brugia malayi Cation transporter family protein 0.0276 0.1153 0.2158
Echinococcus multilocularis glycine receptor subunit alpha 1 0.0276 0.1153 0.5353
Brugia malayi Neurotransmitter-gated ion-channel ligand binding domain containing protein 0.0276 0.1153 0.2158
Onchocerca volvulus DNA topoisomerase 2 homolog 0.0464 0.2128 1
Echinococcus granulosus Cys loop ligand gated ion channel subunit 0.0276 0.1153 0.5353
Schistosoma mansoni hypothetical protein 0.0065 0.0065 0.0163
Chlamydia trachomatis DNA topoisomerase I 0.0142 0.0461 0.0414
Leishmania major DNA topoisomerase 1A 0.0142 0.0461 0.0734
Trypanosoma brucei DNA topoisomerase ii 0.1147 0.5665 1

Activities

Activity type Activity value Assay description Source Reference
Potency (functional) 14.7157 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 (functional) 89.1251 uM PUBCHEM_BIOASSAY: HTS for Inhibitors of HP1-beta Chromodomain Interactions with Methylated Histone Tails. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488962] 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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