TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 309.747 | Formula: C14H15ClFN4O-
H donors: 3 H acceptors: 2 LogP: 2.39 Rotable bonds: 5
Rule of 5 violations (Lipinski): 1
SMILES: CC(=O)Nc1ccc(nc1N)NCc1ccc(cc1)F.[Cl-]
InChi: 1S/C14H15FN4O.ClH/c1-9(20)18-12-6-7-13(19-14(12)16)17-8-10-2-4-11(15)5-3-10;/h2-7H,8H2,1H3,(H,18,20)(H3,16,17,19);1H/p-1
InChiKey: SNFKATSAUGOEKK-UHFFFAOYSA-M

Network

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Target Layer

Model Organisms

Species	Viewmode
Arabidopsis thaliana
Caenorhabditis elegans
Dictyostelium discoideum
Drosophila melanogaster
Escherichia coli
Homo sapiens
Mus musculus
Oryza sativa
Saccharomyces cerevisiae
Schmidtea mediterranea
Other organisms

TDR Pathogens:

Species	Viewmode
Brugia malayi
Chlamydia trachomatis
Echinococcus granulosus
Entamoeba histolytica
Echinococcus multilocularis
Giardia lamblia
Leishmania major
Loa Loa (eye worm)
Mycobacterium leprae
Mycobacterium tuberculosis
Mycobacterium ulcerans
Onchocerca volvulus
Plasmodium falciparum
Plasmodium vivax
Schistosoma mansoni
Trypanosoma brucei
Trypanosoma cruzi
Toxoplasma gondii
Treponema pallidum
Trichomonas vaginalis
Wolbachia endosymbiont of Brugia malayi

Other Pathogens:

Species	Viewmode
Babesia bovis
Candida albicans
Cryptosporidium hominis
Cryptosporidium parvum
Leishmania braziliensis
Leishmania donovani
Leishmania infantum
Leishmania mexicana
Neospora caninum
Plasmodium berghei
Plasmodium knowlesi
Plasmodium yoelii
Schistosoma japonicum
Trypanosoma brucei gambiense
Trypanosoma congolense
Theileria parva

Compound Layer

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Clustering layers

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Synonyms

No synonyms found for this compound

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

Ranking Plot

Putative Targets List

Species	Potential target	Raw	Global	Species
Loa Loa (eye worm)	GTP-binding regulatory protein Gs alpha-S chain	0.0045	0.0432	0.082
Echinococcus granulosus	diuretic hormone 44 receptor GPRdih2	0.0047	0.0458	0.0458
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0026	0.018	0.0299
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0044	0.0418	0.0694
Onchocerca volvulus		0.0048	0.0465	0.0772
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0024	0.015	0.025
Schistosoma mansoni	hypothetical protein	0.0047	0.0458	0.0436
Loa Loa (eye worm)	phosphatidylinositol 3	0.0015	0.0031	0.006
Trypanosoma cruzi	PAB1-binding protein , putative	0.005	0.0496	1
Loa Loa (eye worm)	phosphatidylinositol 3	0.0044	0.0418	0.0792
Schistosoma mansoni	intermediate filament proteins	0.0053	0.0537	0.0515
Echinococcus granulosus	aldehyde dehydrogenase mitochondrial	0.0059	0.0622	0.0622
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0033	0.0269	0.0446
Leishmania major	aldehyde dehydrogenase, mitochondrial precursor	0.0059	0.0622	1
Brugia malayi	intermediate filament protein	0.0053	0.0537	0.0979
Brugia malayi	Iron-sulfur cluster assembly accessory protein	0.0048	0.0465	0.0843
Echinococcus multilocularis	Ataxin 2, N terminal,domain containing protein	0.0022	0.0132	0.0132
Echinococcus multilocularis	lamin	0.0053	0.0537	0.0537
Echinococcus granulosus	histone lysine methyltransferase setb	0.006	0.0623	0.0623
Schistosoma mansoni	phosphatidylinositol 3-and 4-kinase	0.0015	0.0031	0.0009
Echinococcus granulosus	expressed protein	0.0018	0.0072	0.0072
Loa Loa (eye worm)	hypothetical protein	0.0014	0.0022	0.0043
Brugia malayi	Uncoordinated protein 44	0.0014	0.0022	0.000000082647
Schistosoma mansoni	histone-lysine n-methyltransferase setb1	0.006	0.0623	0.0602
Echinococcus granulosus	geminin	0.0333	0.4236	0.4236
Echinococcus granulosus	tumor protein p63	0.0336	0.4274	0.4274
Loa Loa (eye worm)	hypothetical protein	0.0049	0.0486	0.0922
Echinococcus multilocularis	transfer RNA-Lys	0.0035	0.0302	0.0302
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0035	0.0299	0.0496
Brugia malayi	CXXC zinc finger family protein	0.0028	0.0211	0.0358
Trichomonas vaginalis	rotamase, putative	0.0033	0.0268	0.0446
Leishmania major	peptidyl-prolyl cis-trans isomerase/rotamase, putative,PPIase, putative	0.0032	0.0258	0.4154
Leishmania major	target of rapamycin (TOR) kinase 1, putative	0.0044	0.0418	0.6718
Schistosoma mansoni	ferritin light chain	0.0018	0.0072	0.005
Loa Loa (eye worm)	hypothetical protein	0.0233	0.2917	0.5533
Trichomonas vaginalis	ferritin, putative	0.0018	0.0072	0.012
Echinococcus granulosus	single minded 2	0.0035	0.0302	0.0302
Trypanosoma cruzi	phosphatidylinositol 3-related kinase, putative	0.0015	0.0031	0.0634
Echinococcus granulosus	Ankyrin	0.0014	0.0024	0.0024
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0026	0.0184	0.0305
Brugia malayi	GTP-binding regulatory protein Gs alpha-S chain, putative	0.0045	0.0432	0.0781
Brugia malayi	hypothetical protein	0.0233	0.2917	0.5513
Echinococcus multilocularis	diuretic hormone 44 receptor GPRdih2	0.0047	0.0458	0.0458
Brugia malayi	Phosphatidylinositol 3- and 4-kinase family protein	0.0044	0.0418	0.0753
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0029	0.0214	0.0355
Entamoeba histolytica	hypothetical protein	0.0261	0.328	1
Echinococcus multilocularis	nuclear factor of activated T cells 5	0.0072	0.0789	0.0789
Onchocerca volvulus		0.0053	0.0537	0.0891
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0024	0.015	0.0249
Mycobacterium ulcerans	aldehyde dehydrogenase	0.0059	0.0622	1
Echinococcus multilocularis	microtubule associated protein 2	0.0769	1	1
Schistosoma mansoni	cpg binding protein	0.0028	0.0211	0.0189
Plasmodium falciparum	ataxin-2 like protein, putative	0.005	0.0496	1
Echinococcus granulosus	lamin	0.0053	0.0537	0.0537
Toxoplasma gondii	histone lysine methyltransferase SET/SUV39	0.006	0.0623	1
Loa Loa (eye worm)	cytoplasmic intermediate filament protein	0.0028	0.0212	0.0401
Trypanosoma brucei	Phosphatidylinositol 3-kinase tor1	0.0044	0.0418	0.8322
Schistosoma mansoni	rotamase	0.0033	0.0268	0.0247
Schistosoma mansoni	ferritin	0.0018	0.0072	0.005
Entamoeba histolytica	hypothetical protein	0.0261	0.328	1
Echinococcus granulosus	intermediate filament protein	0.0053	0.0537	0.0537
Trypanosoma brucei	phosphatidylinositol 3-kinase tor, putative	0.0021	0.0111	0.1722
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0033	0.0269	0.0446
Echinococcus granulosus	nuclear factor of activated T cells 5	0.0072	0.0789	0.0789
Trypanosoma cruzi	target of rapamycin kinase 3	0.0035	0.0299	0.6038
Loa Loa (eye worm)	immunoglobulin I-set domain-containing protein	0.0014	0.0022	0.0043
Mycobacterium leprae	PROBABLE BACTERIOFERRITIN BFRA	0.0018	0.0072	1
Schistosoma mansoni	histone-lysine n-methyltransferase setb1	0.006	0.0623	0.0602
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0045	0.0432	0.0432
Echinococcus multilocularis	GPCR, family 2	0.0047	0.0458	0.0458
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0045	0.0432	0.0432
Treponema pallidum	bacterioferrin (TpF1)	0.0018	0.0072	0.5
Loa Loa (eye worm)	hypothetical protein	0.0102	0.1178	0.2235
Trypanosoma cruzi	PAB1-binding protein , putative	0.005	0.0496	1
Onchocerca volvulus		0.0053	0.0537	0.0891
Schistosoma mansoni	ferritin	0.0018	0.0072	0.005
Brugia malayi	PAS domain containing protein	0.0048	0.0466	0.0844
Echinococcus multilocularis	expressed protein	0.0018	0.0072	0.0072
Echinococcus granulosus	cpg binding protein	0.003	0.0232	0.0232
Mycobacterium ulcerans	putative regulatory protein	0.0035	0.0302	0.4186
Schistosoma mansoni	hypothetical protein	0.0047	0.0458	0.0436
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0044	0.0418	0.0694
Schistosoma mansoni	apoferritin-2	0.0018	0.0072	0.005
Trypanosoma cruzi	Phosphatidylinositol 3-kinase tor2	0.0044	0.0418	0.8428
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0026	0.018	0.0299
Schistosoma mansoni	aldehyde dehydrogenase	0.0059	0.0622	0.0601
Schistosoma mansoni	hypothetical protein	0.0333	0.4236	0.4223
Trichomonas vaginalis	PIKK family atypical protein kinase	0.003	0.0226	0.0376
Brugia malayi	Pre-SET motif family protein	0.006	0.0623	0.1144
Trichomonas vaginalis	conserved hypothetical protein	0.0034	0.0292	0.0485
Brugia malayi	Pre-SET motif family protein	0.0411	0.5273	1
Echinococcus granulosus	Basic leucine zipper bZIP transcription	0.0261	0.328	0.328
Brugia malayi	cytoplasmic intermediate filament protein	0.0028	0.0212	0.036
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0024	0.015	0.025
Echinococcus multilocularis	ankyrin repeat and death domain containing protein	0.0014	0.0022	0.0022
Mycobacterium ulcerans	aldehyde dehydrogenase	0.0059	0.0622	1
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0044	0.0418	0.0694
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0035	0.0299	0.0496
Schistosoma mansoni	histone-lysine n-methyltransferase suv9	0.006	0.0623	0.0602
Trichomonas vaginalis	conserved hypothetical protein	0.0034	0.0292	0.0485
Brugia malayi	hypothetical protein	0.0261	0.328	0.6204
Mycobacterium tuberculosis	Probable aldehyde dehydrogenase	0.0059	0.0622	1
Echinococcus granulosus	cadherin EGF LAG seven pass G type receptor	0.0047	0.0458	0.0458
Wolbachia endosymbiont of Brugia malayi	bacterioferritin/cytochrome b1	0.0018	0.0072	0.5
Leishmania major	target of rapamycin kinase (TOR) kinase 3	0.0035	0.0299	0.4813
Schistosoma mansoni	lamin	0.0053	0.0537	0.0515
Echinococcus multilocularis	survival motor neuron protein 1	0.0233	0.2917	0.2917
Echinococcus multilocularis	cpg binding protein	0.003	0.0232	0.0232
Loa Loa (eye worm)	hypothetical protein	0.0047	0.0458	0.0868
Echinococcus granulosus	ferritin	0.0018	0.0072	0.0072
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0035	0.0299	0.0496
Plasmodium vivax	ataxin-2 like protein, putative	0.005	0.0496	0.6148
Echinococcus granulosus	phosphatidylinositol 3 and 4 kinase	0.0015	0.0031	0.0031
Toxoplasma gondii	aldehyde dehydrogenase	0.0059	0.0622	0.9961
Loa Loa (eye worm)	hypothetical protein	0.0025	0.0162	0.0306
Echinococcus multilocularis	phosphatidylinositol 3 and 4 kinase	0.0015	0.0031	0.0031
Entamoeba histolytica	hypothetical protein	0.0034	0.0292	0.0111
Echinococcus granulosus	netrin receptor unc 5	0.0014	0.0022	0.0022
Echinococcus multilocularis	netrin receptor unc 5	0.0014	0.0022	0.0022
Trichomonas vaginalis	rotamase, putative	0.0032	0.0258	0.0429
Brugia malayi	hypothetical protein	0.0032	0.0262	0.0456
Loa Loa (eye worm)	hypoxia-induced factor 1	0.0147	0.1784	0.3383
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0033	0.0269	0.0446
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0038	0.0333	0.0552
Loa Loa (eye worm)	intermediate filament tail domain-containing protein	0.0053	0.0537	0.1018
Trichomonas vaginalis	conserved hypothetical protein	0.0034	0.0292	0.0485
Trypanosoma cruzi	phosphatidylinositol 3-related kinase, putative	0.0015	0.0031	0.0634
Echinococcus granulosus	5'partial\|histone lysine N methyltransferase SETDB2	0.0057	0.0586	0.0586
Echinococcus multilocularis	transcription factor btf3	0.0034	0.0292	0.0292
Schistosoma mansoni	mixed-lineage leukemia protein mll	0.0062	0.0659	0.0638
Schistosoma mansoni	ataxia telangiectasia mutated (atm)-related	0.0044	0.0418	0.0396
Leishmania major	phosphatidylinositol 3-kinase, putative	0.0015	0.0031	0.0505
Schistosoma mansoni	survival motor neuron protein	0.0048	0.0465	0.0443
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0024	0.015	0.025
Schistosoma mansoni	hypothetical protein	0.0102	0.1179	0.1159
Onchocerca volvulus		0.0035	0.0302	0.0502
Loa Loa (eye worm)	hypothetical protein	0.005	0.0496	0.094
Schistosoma mansoni	hypothetical protein	0.0047	0.0458	0.0436
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0015	0.0031	0.0052
Schistosoma mansoni	cpg binding protein	0.003	0.0232	0.021
Brugia malayi	hypothetical protein	0.005	0.0496	0.0901
Schistosoma mansoni	ankyrin 23/unc44	0.0014	0.0022	0.000000043493
Onchocerca volvulus	Netrin receptor homolog	0.0014	0.0022	0.0037
Schistosoma mansoni	single-minded	0.0048	0.0466	0.0444
Echinococcus multilocularis	lamin dm0	0.0053	0.0537	0.0537
Schistosoma mansoni	histone-lysine n-methyltransferase setb1	0.006	0.0623	0.0602
Onchocerca volvulus		0.0468	0.6025	1
Loa Loa (eye worm)	hypothetical protein	0.0025	0.0162	0.0306
Toxoplasma gondii	LsmAD domain-containing protein	0.005	0.0496	0.6503
Schistosoma mansoni	ferritin	0.0018	0.0072	0.005
Loa Loa (eye worm)	pigment dispersing factor receptor c	0.0149	0.18	0.3413
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0045	0.0432	0.0411
Echinococcus multilocularis	histone lysine methyltransferase setb histone lysine methyltransferase eggless	0.006	0.0623	0.0623
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0015	0.0031	0.0052
Toxoplasma gondii	NAC domain-containing protein	0.0034	0.0292	0.0923
Brugia malayi	hypothetical protein	0.016	0.1947	0.3666
Echinococcus multilocularis	Ankyrin	0.0014	0.0024	0.0024
Echinococcus multilocularis	histone lysine N methyltransferase SETMAR	0.006	0.0623	0.0623
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0024	0.015	0.0249
Plasmodium vivax	SET domain protein, putative	0.006	0.0623	1
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0045	0.0432	0.0411
Schistosoma mansoni	retinoblastoma-binding protein 4 (rbbp4)	0.0014	0.0024	0.0002
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0026	0.0184	0.0305
Trypanosoma brucei	PAB1-binding protein , putative	0.005	0.0496	1
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0015	0.0031	0.0052
Trypanosoma brucei	target of rapamycin kinase 3, putative	0.0035	0.0299	0.577
Schistosoma mansoni	aldehyde dehydrogenase	0.0059	0.0622	0.0601
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0026	0.0184	0.0305
Echinococcus granulosus	expressed protein	0.0033	0.0268	0.0268
Echinococcus multilocularis	geminin	0.0333	0.4236	0.4236
Loa Loa (eye worm)	hypothetical protein	0.0053	0.0537	0.1018
Brugia malayi	Death domain containing protein	0.0014	0.0022	0.000000082647
Mycobacterium ulcerans	aldehyde dehydrogenase	0.0059	0.0622	1
Echinococcus multilocularis	tumor protein p63	0.0336	0.4274	0.4274
Entamoeba histolytica	hypothetical protein	0.0261	0.328	1
Echinococcus multilocularis	cytoplasmic intermediate filament protein	0.0026	0.0174	0.0174
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0035	0.0299	0.0496
Loa Loa (eye worm)	hypothetical protein	0.006	0.0623	0.1182
Brugia malayi	beta-NAC-like protein	0.0034	0.0292	0.0513
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0035	0.0299	0.0496
Echinococcus multilocularis	ferritin	0.0018	0.0072	0.0072
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0033	0.0269	0.0446
Schistosoma mansoni	hypothetical protein	0.0261	0.328	0.3265
Schistosoma mansoni	aryl hydrocarbon receptor	0.0048	0.0466	0.0444
Echinococcus granulosus	FKBP12 rapamycin complex associated protein	0.0044	0.0418	0.0418
Schistosoma mansoni	transcription factor btf3	0.0034	0.0292	0.027
Echinococcus granulosus	cytoplasmic intermediate filament protein	0.0026	0.0174	0.0174
Loa Loa (eye worm)	hypothetical protein	0.0014	0.0024	0.0046
Leishmania major	hypothetical protein, conserved	0.005	0.0496	0.7971
Schistosoma mansoni	hypothetical protein	0.0047	0.0458	0.0436
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0045	0.0432	0.0432
Trypanosoma cruzi	Phosphatidylinositol 3-kinase tor1	0.0044	0.0418	0.8428
Loa Loa (eye worm)	hypothetical protein	0.0149	0.18	0.3413
Schistosoma mansoni	transcription factor LCR-F1	0.0261	0.328	0.3265
Trypanosoma cruzi	peptidyl-prolyl cis-trans isomerase	0.0032	0.0258	0.5212
Loa Loa (eye worm)	hypothetical protein	0.0026	0.0174	0.0331
Trypanosoma brucei	FAT domain/Rapamycin binding domain/Phosphatidylinositol 3- and 4-kinase, putative	0.0018	0.0078	0.1002
Toxoplasma gondii	target of rapamycin (TOR), putative	0.0033	0.0269	0.0287
Echinococcus multilocularis	cadherin EGF LAG seven pass G type receptor	0.0047	0.0458	0.0458
Entamoeba histolytica	FKBP-rapamycin associated protein (FRAP), putative	0.0044	0.0418	0.0528
Leishmania major	target of rapamycin (TOR) kinase 2, putative	0.0044	0.0418	0.6718
Leishmania major	phosphatidylinositol 3-related kinase, putative	0.0015	0.0031	0.0505
Schistosoma mansoni	microtubule-associated protein tau	0.0769	1	1
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0015	0.0031	0.0052
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0045	0.0432	0.0432
Loa Loa (eye worm)	CXXC zinc finger family protein	0.0028	0.0211	0.0399
Schistosoma mansoni	ferritin light chain	0.0018	0.0072	0.005
Entamoeba histolytica	hypothetical protein	0.0261	0.328	1
Schistosoma mansoni	ferritin	0.0018	0.0072	0.005
Echinococcus granulosus	death domain containing protein	0.0014	0.0022	0.0022
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0024	0.015	0.025
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0033	0.0269	0.0446
Loa Loa (eye worm)	hypothetical protein	0.016	0.1947	0.3693
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0015	0.0031	0.0052
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0033	0.0269	0.0446
Loa Loa (eye worm)	latrophilin receptor protein 2	0.0047	0.0458	0.0868
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0033	0.0269	0.0446
Schistosoma mansoni	hypothetical protein	0.0102	0.1178	0.1159
Brugia malayi	calcium-independent alpha-latrotoxin receptor 2, putative	0.0047	0.0458	0.0829
Brugia malayi	Phosphatidylinositol 3- and 4-kinase family protein	0.0015	0.0031	0.0017
Trypanosoma cruzi	transcription factor btf3, putative	0.0034	0.0292	0.5891
Giardia lamblia	GTOR	0.0044	0.0418	0.5
Toxoplasma gondii	histone lysine methyltransferase SET1	0.0056	0.0574	0.865
Echinococcus multilocularis	musashi	0.0053	0.0537	0.0537
Brugia malayi	hypoxia-induced factor 1	0.0147	0.1784	0.3355
Brugia malayi	Cytochrome P450 family protein	0.0044	0.0422	0.076
Brugia malayi	latrophilin 2 splice variant baaae	0.0102	0.1178	0.2202
Schistosoma mansoni	apoferritin-2	0.0018	0.0072	0.005
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0024	0.015	0.0249
Echinococcus granulosus	GPCR family 2	0.0047	0.0458	0.0458
Brugia malayi	Intermediate filament tail domain containing protein	0.0053	0.0537	0.0979
Chlamydia trachomatis	two component regulatory system sensor histidine kinase	0.0012	0	0.5
Loa Loa (eye worm)	cytochrome P450 family protein	0.0044	0.0422	0.08
Plasmodium falciparum	ataxin-2 like protein, putative	0.005	0.0496	1
Brugia malayi	Protein kinase domain containing protein	0.0014	0.0022	0.000000082647
Echinococcus multilocularis	aldehyde dehydrogenase, mitochondrial	0.0059	0.0622	0.0622
Loa Loa (eye worm)	hypothetical protein	0.0052	0.0524	0.0993
Brugia malayi	Corticotropin releasing factor receptor 2 precursor, putative	0.0149	0.18	0.3385
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0045	0.0432	0.0411
Entamoeba histolytica	phosphatidylinositol3-kinaseTor2, putative	0.0044	0.0418	0.0528
Echinococcus multilocularis	expressed protein	0.0033	0.0268	0.0268
Loa Loa (eye worm)	ICD-1 protein	0.0034	0.0292	0.0554
Brugia malayi	Pin1-type peptidyl-prolyl cis-trans isomerase, BmPin1	0.0033	0.0268	0.0469
Trichomonas vaginalis	conserved hypothetical protein	0.0033	0.0268	0.0446
Onchocerca volvulus		0.0049	0.0486	0.0807
Entamoeba histolytica	transcription factor BTF3, putative	0.0034	0.0292	0.0111
Schistosoma mansoni	lamin	0.0053	0.0537	0.0515
Loa Loa (eye worm)	Pin1-type peptidyl-prolyl cis-trans isomerase	0.0033	0.0268	0.0509
Trichomonas vaginalis	set domain proteins, putative	0.0468	0.6023	1
Echinococcus granulosus	transcription factor btf3	0.0034	0.0292	0.0292
Echinococcus multilocularis	FKBP12 rapamycin complex associated protein	0.0044	0.0418	0.0418
Echinococcus granulosus	survival motor neuron protein 1	0.0233	0.2917	0.2917
Trypanosoma cruzi	transcription factor btf3, putative	0.0034	0.0292	0.5891
Schistosoma mansoni	hypothetical protein	0.0022	0.0132	0.011
Loa Loa (eye worm)	intermediate filament protein	0.0053	0.0537	0.1018
Schistosoma mansoni	cpg binding protein	0.003	0.0232	0.021
Trypanosoma brucei	transcription factor BTF3, putative	0.0034	0.0292	0.5613
Schistosoma mansoni	hypothetical protein	0.0333	0.4236	0.4223
Brugia malayi	Calcitonin receptor-like protein seb-1	0.0149	0.18	0.3385
Echinococcus multilocularis	Basic leucine zipper (bZIP) transcription	0.0261	0.328	0.328
Trypanosoma brucei	peptidyl-prolyl cis-trans isomerase/rotamase, putative	0.0032	0.0258	0.4888
Trypanosoma brucei	phosphatidylinositol 4-kinase, putative	0.0044	0.0418	0.8322
Trypanosoma cruzi	peptidyl-prolyl cis-trans isomerase	0.0032	0.0258	0.5212
Echinococcus granulosus	lamin dm0	0.0053	0.0537	0.0537
Echinococcus granulosus	Ataxin 2 N terminaldomain containing protein	0.0022	0.0132	0.0132
Loa Loa (eye worm)	pre-SET domain-containing protein family protein	0.0411	0.5273	1
Onchocerca volvulus		0.0028	0.0211	0.035
Onchocerca volvulus		0.006	0.0623	0.1035
Schistosoma mansoni	cellular tumor antigen P53	0.0049	0.0486	0.0465
Brugia malayi	Latrophilin receptor protein 2	0.0047	0.0458	0.0829
Schistosoma mansoni	hypothetical protein	0.0048	0.0465	0.0443
Echinococcus granulosus	ankyrin repeat and death domain containing protein	0.0014	0.0022	0.0022
Brugia malayi	bHLH-PAS transcription factor	0.0035	0.0302	0.0533
Leishmania major	basic transcription factor 3a, putative	0.0034	0.0292	0.4696

Activities

Activity type	Activity value	Assay description	Source	Reference
Log 1/ED50 (functional)	= 3.567	Effective dosage for inhibition of maximal electroshock stimulated convulsions	ChEMBL.	7932523
Log 1/I50 (ADMET)	= 3.189	The compound was tested for neurotoxicity by rotorod test in mice	ChEMBL.	7932523
Log delta (1/T2) (functional)	= 1.204	The compound was tested in vivo for relaxation rates in the mice	ChEMBL.	7932523

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

ChEMBL: 267612

Bibliographic References

1 literature reference was collected for this gene.

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Detailed information for compound 168605