TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 404.104 | Formula: C22H17ClN4O2
H donors: 2 H acceptors: 3 LogP: 3.67 Rotable bonds: 5
Rule of 5 violations (Lipinski): 0
SMILES: Clc1ccc(cc1)N(C(=O)c1ccc(cc1)c1[nH]c2c(n1)cc(cc2)C(=O)N)C
InChi: InChI=1S/C22H17ClN4O2/c1-27(17-9-7-16(23)8-10-17)22(29)14-4-2-13(3-5-14)21-25-18-11-6-15(20(24)28)12-19(18)26-21/h2-12H,1H3,(H2,24,28)(H,25,26)
InChiKey: CVGVSWYXRODYIS-UHFFFAOYSA-N

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

Species	Target name	Source	Bibliographic reference
Homo sapiens	checkpoint kinase 2		No references

Predicted pathogen targets for this compound

By orthology

Species	Potential target	Known druggable target/s	Ortholog Group
Schistosoma japonicum	ko:K06641 serine/threonine-protein kinase Chk2, putative	Get druggable targets OG5_128695	All targets in OG5_128695
Echinococcus granulosus	calcium:calmodulin dependent protein kinase I	Get druggable targets OG5_128695	All targets in OG5_128695
Echinococcus multilocularis	calcium:calmodulin dependent protein kinase I	Get druggable targets OG5_128695	All targets in OG5_128695
Candida albicans	kinase involved in DNA repair	Get druggable targets OG5_128695	All targets in OG5_128695
Candida albicans	kinase involved in DNA repair	Get druggable targets OG5_128695	All targets in OG5_128695
Echinococcus granulosus	serine:threonine protein kinase Chk2	Get druggable targets OG5_128695	All targets in OG5_128695
Echinococcus multilocularis	serine:threonine protein kinase Chk2	Get druggable targets OG5_128695	All targets in OG5_128695
Candida albicans	protein kinase	Get druggable targets OG5_128695	All targets in OG5_128695
Schistosoma mansoni	serine/threonine protein kinase	Get druggable targets OG5_128695	All targets in OG5_128695
Candida albicans	protein kinase	Get druggable targets OG5_128695	All targets in OG5_128695
Entamoeba histolytica	protein kinase, putative	Get druggable targets OG5_128695	All targets in OG5_128695
Entamoeba histolytica	protein kinase, putative	Get druggable targets OG5_128695	All targets in OG5_128695

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
Brugia malayi	nuclear hormone receptor	0.0034	0.0256	0.0372
Entamoeba histolytica	protein kinase, putative	0.0046	0.0401	1
Wolbachia endosymbiont of Brugia malayi	exonuclease III	0.0018	0.0053	0.5
Leishmania major	aldehyde dehydrogenase, mitochondrial precursor	0.0059	0.0566	0.7243
Loa Loa (eye worm)	hypothetical protein	0.0016	0.0027	0.004
Echinococcus multilocularis	muscleblind protein 1	0.0145	0.165	0.1627
Brugia malayi	Nuclear hormone receptor family member nhr-40	0.0034	0.0256	0.0372
Loa Loa (eye worm)	nuclear hormone receptor-like 1	0.0018	0.0052	0.0075
Brugia malayi	exodeoxyribonuclease III family protein	0.0018	0.0053	0.0077
Brugia malayi	Intermediate filament tail domain containing protein	0.0026	0.0153	0.0222
Schistosoma mansoni	ap endonuclease	0.0018	0.0053	0.0137
Echinococcus granulosus	lamin dm0	0.0026	0.0153	0.0126
Brugia malayi	hypothetical protein	0.0018	0.0052	0.0075
Brugia malayi	Nuclear hormone receptor E75	0.0016	0.0027	0.004
Brugia malayi	ecdysone receptor	0.0016	0.0027	0.004
Brugia malayi	hypothetical protein	0.0016	0.0027	0.004
Echinococcus granulosus	FTZ F1 nuclear receptor protein	0.0034	0.0256	0.0229
Echinococcus granulosus	ecdysone induced protein 78C	0.0034	0.0256	0.0229
Echinococcus multilocularis	FTZ F1 alpha	0.0034	0.0256	0.0229
Echinococcus granulosus	lipoxygenase domain containing protein	0.0021	0.0089	0.0061
Plasmodium falciparum	hydroxymethyldihydropterin pyrophosphokinase-dihydropteroate synthase	0.0343	0.4146	1
Schistosoma mansoni	ap endonuclease	0.0018	0.0053	0.0137
Loa Loa (eye worm)	hypothetical protein	0.0561	0.6888	1
Loa Loa (eye worm)	hypothetical protein	0.0016	0.0027	0.004
Schistosoma mansoni	3-hydroxyacyl-CoA dehydrogenase	0.0061	0.0595	0.299
Loa Loa (eye worm)	hypothetical protein	0.043	0.5241	0.7609
Brugia malayi	intermediate filament protein	0.0026	0.0153	0.0222
Loa Loa (eye worm)	hypothetical protein	0.0016	0.0027	0.004
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-31	0.0034	0.0256	0.0372
Trichomonas vaginalis	ap endonuclease, putative	0.0018	0.0053	0.5
Plasmodium vivax	hydroxymethylpterin pyrophosphokinase-dihydropteroate synthetase, putative	0.0343	0.4146	1
Echinococcus granulosus	nuclear receptor subfamily 1 group D	0.0018	0.0052	0.0025
Schistosoma mansoni	hypothetical protein	0.0035	0.0263	0.1243
Echinococcus granulosus	COUP TF:Svp nuclear hormone receptor	0.0034	0.0256	0.0229
Mycobacterium tuberculosis	Dihydropteroate synthase 1 FolP (DHPS 1) (dihydropteroate pyrophosphorylase 1) (dihydropteroate diphosphorylase 1)	0.0202	0.2369	1
Brugia malayi	hypothetical protein	0.043	0.5241	0.7609
Loa Loa (eye worm)	transcription factor SMAD2	0.0116	0.1283	0.1863
Loa Loa (eye worm)	hypothetical protein	0.0079	0.0822	0.1194
Schistosoma mansoni	serine/threonine protein kinase	0.0046	0.0401	0.1967
Echinococcus granulosus	lipoxygenase domain containing protein	0.0021	0.0089	0.0061
Brugia malayi	photoreceptor-specific nuclear receptor	0.0034	0.0256	0.0372
Loa Loa (eye worm)	hypothetical protein	0.0145	0.165	0.2396
Brugia malayi	small heat shock protein	0.0561	0.6888	1
Mycobacterium tuberculosis	Dihydrofolate reductase DfrA (DHFR) (tetrahydrofolate dehydrogenase)	0.0167	0.1926	0.8086
Echinococcus granulosus	retinoic acid receptor rxr beta a	0.013	0.1462	0.1438
Echinococcus granulosus	Basic leucine zipper bZIP transcription factor	0.0082	0.085	0.0825
Schistosoma mansoni	rab6-interacting	0.0021	0.0089	0.0322
Brugia malayi	Muscleblind-like protein	0.0145	0.165	0.2396
Schistosoma mansoni	thyroid hormone receptor	0.0034	0.0256	0.1204
Brugia malayi	GTP-binding regulatory protein Gs alpha-S chain, putative	0.0044	0.0383	0.0556
Loa Loa (eye worm)	cytochrome P450 family protein	0.0027	0.0167	0.0243
Brugia malayi	hypothetical protein	0.0021	0.0089	0.0129
Loa Loa (eye worm)	hypothetical protein	0.0018	0.0052	0.0075
Entamoeba histolytica	hypothetical protein	0.0035	0.0263	0.6043
Loa Loa (eye worm)	hypothetical protein	0.0016	0.0027	0.004
Schistosoma mansoni	retinoic acid receptor RXR	0.013	0.1462	0.7556
Brugia malayi	hypothetical protein	0.0016	0.0027	0.004
Brugia malayi	conserved hypotetical protein	0.0016	0.0027	0.004
Echinococcus multilocularis	nuclear receptor subfamily 1 group D	0.0018	0.0052	0.0025
Onchocerca volvulus		0.043	0.5241	1
Loa Loa (eye worm)	hypothetical protein	0.0018	0.0052	0.0075
Loa Loa (eye worm)	hypothetical protein	0.0034	0.0256	0.0372
Onchocerca volvulus	Protein ultraspiracle homolog	0.0034	0.0256	0.0438
Brugia malayi	3-hydroxyacyl-CoA dehydrogenase type II	0.0061	0.0595	0.0864
Echinococcus multilocularis	3 hydroxyacyl coenzyme A dehydrogenase type 2	0.0061	0.0595	0.0569
Plasmodium vivax	bifunctional dihydrofolate reductase-thymidylate synthase, putative	0.0064	0.0627	0.1402
Echinococcus granulosus	3 hydroxyacyl coenzyme A dehydrogenase type 2	0.0061	0.0595	0.0569
Mycobacterium ulcerans	B12-dependent methionine synthase	0.0074	0.0761	0.3057
Echinococcus granulosus	nuclear receptor 2DBD gamma	0.0034	0.0256	0.0229
Loa Loa (eye worm)	DR-78	0.0016	0.0027	0.004
Mycobacterium leprae	DIHYDROFOLATE REDUCTASE DFRA (DHFR) (TETRAHYDROFOLATE DEHYDROGENASE)	0.0167	0.1926	0.7244
Schistosoma mansoni	nuclear hormone receptor	0.0034	0.0256	0.1204
Echinococcus granulosus	Polycystic kidney disease protein	0.0021	0.0089	0.0061
Brugia malayi	nuclear receptor subfamily 1, group D, member 1, putative	0.0016	0.0027	0.004
Brugia malayi	hypothetical protein	0.0064	0.063	0.0914
Echinococcus multilocularis	retinoic acid receptor rxr beta a retinoic acid receptor rxr alpha a retinoic acid receptor rxr alpha	0.0112	0.1233	0.1209
Mycobacterium ulcerans	short-chain type dehydrogenase/reductase	0.0061	0.0595	0.2339
Onchocerca volvulus		0.0021	0.0089	0.0117
Schistosoma mansoni	nuclear hormone receptor nor-1/nor-2	0.0034	0.0256	0.1204
Echinococcus multilocularis	Basic leucine zipper (bZIP) transcription factor	0.0082	0.085	0.0825
Schistosoma mansoni	dihydrofolate reductase	0.0167	0.1926	1
Loa Loa (eye worm)	hypothetical protein	0.0016	0.0027	0.004
Brugia malayi	bZIP transcription factor family protein	0.0082	0.085	0.1235
Brugia malayi	nuclear hormone receptor family member nhr-6	0.0016	0.0027	0.004
Toxoplasma gondii	aldehyde dehydrogenase	0.0059	0.0566	0.1253
Entamoeba histolytica	hypothetical protein	0.0035	0.0263	0.6043
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0044	0.0383	0.1872
Brugia malayi	Nuclear hormone receptor family member nhr-1	0.0034	0.0256	0.0372
Mycobacterium ulcerans	dihydrofolate reductase DfrA	0.0167	0.1926	0.8086
Loa Loa (eye worm)	intermediate filament tail domain-containing protein	0.0026	0.0153	0.0222
Echinococcus multilocularis	Polycystic kidney disease protein	0.0021	0.0089	0.0061
Loa Loa (eye worm)	hypothetical protein	0.043	0.5241	0.7609
Loa Loa (eye worm)	hypothetical protein	0.0021	0.0089	0.0129
Loa Loa (eye worm)	cytochrome P450 family protein	0.0029	0.0187	0.0271
Trypanosoma brucei	dihydrofolate reductase-thymidylate synthase	0.0064	0.0627	1
Schistosoma mansoni	lipoxygenase	0.0021	0.0089	0.0322
Brugia malayi	hypothetical protein	0.0018	0.0052	0.0075
Mycobacterium leprae	Probable2-amino-4-hydroxy-6-hydroxymethyldihydropterine pyrophosphokinase FolK (7,8-dihydro-6-hydroxymethylpterin-pyrophosphokin	0.0141	0.16	0.5219
Onchocerca volvulus	Steroid hormone receptor family member cnr14 homolog	0.0034	0.0256	0.0438
Brugia malayi	nuclear hormone receptor family member odr-7	0.0016	0.0027	0.004
Brugia malayi	hypothetical protein	0.0035	0.0263	0.0382
Mycobacterium ulcerans	aldehyde dehydrogenase	0.0059	0.0566	0.2214
Toxoplasma gondii	bifunctional dihydrofolate reductase-thymidylate synthase	0.0064	0.0627	0.1402
Echinococcus multilocularis	DNA (apurinic or apyrimidinic site) lyase	0.0018	0.0053	0.0026
Schistosoma mansoni	Tr4/Tr2 (homologue)	0.0034	0.0256	0.1204
Loa Loa (eye worm)	hypothetical protein	0.0016	0.0027	0.004
Mycobacterium ulcerans	dihydropteroate synthase 1 FolP1	0.0202	0.2369	1
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-1	0.0034	0.0256	0.0372
Echinococcus granulosus	intermediate filament protein	0.0026	0.0153	0.0126
Entamoeba histolytica	protein kinase, putative	0.0046	0.0401	1
Loa Loa (eye worm)	MH2 domain-containing protein	0.0116	0.1283	0.1863
Echinococcus multilocularis	arachidonate 5 lipoxygenase	0.0059	0.0566	0.054
Loa Loa (eye worm)	nuclear Hormone Receptor family member	0.0034	0.0256	0.0372
Treponema pallidum	exodeoxyribonuclease (exoA)	0.0018	0.0053	0.5
Brugia malayi	Cytochrome P450 family protein	0.0027	0.0167	0.0243
Loa Loa (eye worm)	hypothetical protein	0.0034	0.0256	0.0372
Brugia malayi	Nuclear hormone receptor family member nhr-3	0.0034	0.0256	0.0372
Loa Loa (eye worm)	hypothetical protein	0.0026	0.0147	0.0214
Trichomonas vaginalis	ap endonuclease, putative	0.0018	0.0053	0.5
Brugia malayi	nuclear receptor NHR-88	0.0016	0.0027	0.004
Mycobacterium ulcerans	cytochrome P450 185A4 Cyp185A4	0.0027	0.0167	0.0493
Mycobacterium ulcerans	aldehyde dehydrogenase	0.0059	0.0566	0.2214
Brugia malayi	Nuclear hormone receptor family member nhr-25	0.0034	0.0256	0.0372
Brugia malayi	hypothetical protein	0.0021	0.0089	0.0129
Echinococcus granulosus	nuclear receptor 2DBD gamma	0.0034	0.0256	0.0229
Loa Loa (eye worm)	3-hydroxyacyl-CoA dehydrogenase type II	0.0057	0.0543	0.0788
Echinococcus multilocularis	serine:threonine protein kinase Chk2	0.0046	0.0401	0.0375
Brugia malayi	Nuclear hormone receptor-like 1	0.0018	0.0052	0.0075
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0044	0.0383	0.1872
Loa Loa (eye worm)	runx1	0.0054	0.0503	0.073
Loa Loa (eye worm)	hypothetical protein	0.0018	0.0052	0.0075
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0044	0.0383	0.0356
Onchocerca volvulus		0.0026	0.0153	0.0241
Entamoeba histolytica	hypothetical protein	0.0035	0.0263	0.6043
Echinococcus multilocularis	nuclear receptor 2DBD gamma	0.0034	0.0256	0.0229
Brugia malayi	Ligand-binding domain of nuclear hormone receptor family protein	0.0034	0.0256	0.0372
Schistosoma mansoni	thyroid hormone receptor	0.0034	0.0256	0.1204
Echinococcus multilocularis	calcium:calmodulin dependent protein kinase I	0.0046	0.0401	0.0374
Echinococcus multilocularis	lipoxygenase domain containing protein	0.0021	0.0089	0.0061
Trypanosoma cruzi	dihydrofolate reductase-thymidylate synthase	0.0064	0.0627	1
Loa Loa (eye worm)	hypothetical protein	0.0145	0.165	0.2396
Schistosoma mansoni	lipoxygenase	0.0059	0.0566	0.2837
Loa Loa (eye worm)	hypothetical protein	0.0016	0.0027	0.004
Echinococcus multilocularis	dihydrofolate reductase	0.0167	0.1926	0.1903
Leishmania major	methionine synthase, putative	0.0074	0.0761	1
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-49	0.0034	0.0256	0.0372
Loa Loa (eye worm)	hypothetical protein	0.0034	0.0256	0.0372
Echinococcus multilocularis	lamin dm0	0.0026	0.0153	0.0126
Chlamydia trachomatis	bifunctional 2-amino-4-hydroxy-6-hydroxymethyldihydropteridine pyrophosphokinase/dihydropteroate synthase	0.0343	0.4146	1
Brugia malayi	Nuclear hormone receptor-like 1	0.0018	0.0052	0.0075
Brugia malayi	Dihydrofolate reductase	0.0167	0.1926	0.2796
Echinococcus multilocularis	RUN	0.0021	0.0089	0.0061
Schistosoma mansoni	jun-related protein	0.0066	0.0658	0.3322
Brugia malayi	Nuclear hormone receptor family member nhr-41	0.0034	0.0256	0.0372
Brugia malayi	ecdysteroid receptor	0.0034	0.0256	0.0372
Leishmania major	cytochrome p450-like protein	0.0027	0.0167	0.1613
Loa Loa (eye worm)	dihydrofolate reductase	0.0167	0.1926	0.2796
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0044	0.0383	0.0356
Loa Loa (eye worm)	nuclear receptor nhr-7B	0.0016	0.0027	0.004
Plasmodium falciparum	LCCL domain-containing protein	0.0021	0.0089	0.0086
Onchocerca volvulus		0.0026	0.0153	0.0241
Brugia malayi	Cytochrome P450 family protein	0.0027	0.0167	0.0243
Brugia malayi	tailless protein	0.0016	0.0027	0.004
Echinococcus granulosus	hepatocyte nuclear factor 4 alpha	0.0034	0.0256	0.0229
Echinococcus multilocularis	lipoxygenase domain containing protein	0.0021	0.0089	0.0061
Loa Loa (eye worm)	hypothetical protein	0.0034	0.0256	0.0372
Schistosoma mansoni	retinoid-x-receptor (RXR)	0.0034	0.0256	0.1204
Loa Loa (eye worm)	hypothetical protein	0.0034	0.0256	0.0372
Schistosoma mansoni	hypothetical protein	0.0021	0.0089	0.0322
Loa Loa (eye worm)	hypothetical protein	0.0016	0.0027	0.004
Loa Loa (eye worm)	hypothetical protein	0.0016	0.0027	0.004
Brugia malayi	nuclear hormone receptor	0.0016	0.0027	0.004
Trypanosoma cruzi	cytochrome P450, putative	0.0027	0.0167	0.1989
Schistosoma mansoni	transcription factor LCR-F1	0.0035	0.0263	0.1243
Leishmania major	3-oxoacyl-(acyl-carrier protein) reductase, putative	0.0061	0.0595	0.7653
Onchocerca volvulus		0.0064	0.063	0.1156
Brugia malayi	Steroid receptor seven-up type 2	0.0034	0.0256	0.0372
Echinococcus granulosus	calcium:calmodulin dependent protein kinase I	0.0046	0.0401	0.0374
Echinococcus granulosus	serine:threonine protein kinase Chk2	0.0046	0.0401	0.0375
Schistosoma mansoni	retinoid-x-receptor (RXR)	0.0018	0.0052	0.0129
Echinococcus granulosus	Nuclear hormone receptor family member nhr 41	0.0034	0.0256	0.0229
Loa Loa (eye worm)	doublecortin family protein	0.0021	0.0089	0.0129
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-40	0.0034	0.0256	0.0372
Echinococcus multilocularis	Protein lozenge	0.0054	0.0503	0.0477
Echinococcus multilocularis	jun protein	0.0082	0.085	0.0825
Schistosoma mansoni	aldehyde dehydrogenase	0.0059	0.0566	0.2837
Loa Loa (eye worm)	hypothetical protein	0.0026	0.0153	0.0222
Schistosoma mansoni	ecdysone-induced protein 78c (dr-78)	0.0018	0.0052	0.0129
Echinococcus granulosus	arachidonate 5 lipoxygenase	0.0059	0.0566	0.054
Mycobacterium ulcerans	aldehyde dehydrogenase	0.0059	0.0566	0.2214
Brugia malayi	nuclear receptor RXR	0.0018	0.0052	0.0075
Echinococcus multilocularis	hepatocyte nuclear factor 4 alpha	0.0034	0.0256	0.0229
Brugia malayi	Nuclear hormone receptor family member nhr-25	0.0034	0.0256	0.0372
Schistosoma mansoni	loxhd1	0.0021	0.0089	0.0322
Schistosoma mansoni	lamin	0.0026	0.0153	0.0662
Loa Loa (eye worm)	hypothetical protein	0.0034	0.0256	0.0372
Loa Loa (eye worm)	hypothetical protein	0.0016	0.0027	0.004
Echinococcus multilocularis	ecdysone induced protein 78C	0.0034	0.0256	0.0229
Onchocerca volvulus		0.0034	0.0256	0.0438
Loa Loa (eye worm)	hypothetical protein	0.0034	0.0256	0.0372
Brugia malayi	nuclear receptor NHR-88	0.0034	0.0256	0.0372
Brugia malayi	nuclear receptor RXR	0.0016	0.0027	0.004
Brugia malayi	nuclear receptor NHR-67	0.0016	0.0027	0.004
Brugia malayi	Cytochrome P450 family protein	0.0029	0.0187	0.0271
Mycobacterium ulcerans	short-chain type dehydrogenase/reductase	0.0061	0.0595	0.2339
Onchocerca volvulus		0.0021	0.0089	0.0117
Schistosoma mansoni	polycystin 1-related	0.0021	0.0089	0.0322
Brugia malayi	Nuclear hormone receptor E75	0.0016	0.0027	0.004
Mycobacterium tuberculosis	Dihydropteroate synthase 2 FolP2 (DHPS 2) (dihydropteroate pyrophosphorylase 2)	0.0074	0.0761	0.3057
Echinococcus granulosus	dihydrofolate reductase	0.0167	0.1926	0.1903
Echinococcus granulosus	aldehyde dehydrogenase mitochondrial	0.0059	0.0566	0.054
Giardia lamblia	Endonuclease/Exonuclease/phosphatase	0.0018	0.0053	0.5
Brugia malayi	Nuclear hormone receptor family member nhr-19	0.0034	0.0256	0.0372
Echinococcus multilocularis	tm gpcr rhodopsin gpcr rhodopsin superfamily	0.0808	1	1
Plasmodium vivax	multidomain scavenger receptor, putative	0.0021	0.0089	0.0086
Loa Loa (eye worm)	hypothetical protein	0.0016	0.0027	0.004
Brugia malayi	dihydrofolate reductase family protein	0.0167	0.1926	0.2796
Echinococcus multilocularis	aldehyde dehydrogenase, mitochondrial	0.0059	0.0566	0.054
Schistosoma mansoni	intermediate filament proteins	0.0026	0.0153	0.0662
Schistosoma mansoni	steroid hormone receptor ad4bp	0.0034	0.0256	0.1204
Schistosoma mansoni	nuclear receptor 2DBD-gamma	0.0034	0.0256	0.1204
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0044	0.0383	0.0356
Loa Loa (eye worm)	hypothetical protein	0.0021	0.0089	0.0129
Loa Loa (eye worm)	GTP-binding regulatory protein Gs alpha-S chain	0.0044	0.0383	0.0556
Brugia malayi	orphan nuclear receptor NR2E1	0.0016	0.0027	0.004
Loa Loa (eye worm)	steroid hormone receptor	0.0034	0.0256	0.0372
Schistosoma mansoni	RAR-like nuclear receptor	0.0034	0.0256	0.1204
Brugia malayi	Doublecortin family protein	0.0021	0.0089	0.0129
Schistosoma mansoni	lozenge	0.0054	0.0503	0.2505
Schistosoma mansoni	rab6-interacting	0.0021	0.0089	0.0322
Mycobacterium ulcerans	dihydropteroate synthase 2 FolP2	0.0074	0.0761	0.3057
Echinococcus granulosus	lamin	0.0026	0.0153	0.0126
Echinococcus multilocularis	musashi	0.0026	0.0153	0.0126
Plasmodium falciparum	bifunctional dihydrofolate reductase-thymidylate synthase	0.0064	0.0627	0.1402
Brugia malayi	Nuclear hormone receptor family member nhr-19	0.0034	0.0256	0.0372
Echinococcus granulosus	DNA apurinic or apyrimidinic site lyase	0.0018	0.0053	0.0026
Schistosoma mansoni	aldehyde dehydrogenase	0.0059	0.0566	0.2837
Echinococcus multilocularis	FTZ F1 nuclear receptor protein	0.0034	0.0256	0.0229
Schistosoma mansoni	hypothetical protein	0.0066	0.0658	0.3322
Echinococcus multilocularis	Basic leucine zipper (bZIP) transcription	0.0035	0.0263	0.0237
Echinococcus granulosus	muscleblind protein	0.0145	0.165	0.1627
Echinococcus granulosus	FTZ F1 alpha	0.0034	0.0256	0.0229
Echinococcus multilocularis	lamin	0.0026	0.0153	0.0126
Brugia malayi	Nuclear hormone receptor family member nhr-14	0.0034	0.0256	0.0372
Loa Loa (eye worm)	nuclear receptor NHR-67	0.0016	0.0027	0.004
Brugia malayi	Nuclear hormone receptor-like 1	0.0034	0.0256	0.0372
Echinococcus multilocularis	Nuclear hormone receptor family member nhr 41	0.0034	0.0256	0.0229
Echinococcus granulosus	RUN	0.0021	0.0089	0.0061
Loa Loa (eye worm)	hypothetical protein	0.0018	0.0052	0.0075
Mycobacterium tuberculosis	Probable aldehyde dehydrogenase	0.0059	0.0566	0.2214
Entamoeba histolytica	hypothetical protein	0.0035	0.0263	0.6043
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-41	0.0034	0.0256	0.0372
Trypanosoma brucei	cytochrome P450, putative	0.0027	0.0167	0.1989
Loa Loa (eye worm)	hypothetical protein	0.0018	0.0052	0.0075
Schistosoma mansoni	lamin	0.0026	0.0153	0.0662
Loa Loa (eye worm)	CYP4Cod1	0.0027	0.0167	0.0243
Schistosoma mansoni	coup transcription factor	0.0034	0.0256	0.1204
Leishmania major	dihydrofolate reductase-thymidylate synthase	0.0064	0.0627	0.8107
Loa Loa (eye worm)	hypothetical protein	0.0016	0.0027	0.004
Onchocerca volvulus	Bile acid receptor homolog	0.0034	0.0256	0.0438
Mycobacterium ulcerans	2-amino-4-hydroxy-6-hydroxymethyldihydropteridine pyrophosphokinase	0.0141	0.16	0.6681
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0044	0.0383	0.1872
Mycobacterium leprae	Probable dihydropteroate synthase 1 FolP1 (DHPS 1) (dihydropteroate pyrophosphorylase 1) (dihydropteroate dipyrophosphorylase 1)	0.0202	0.2369	1
Echinococcus multilocularis	muscleblind protein	0.0145	0.165	0.1627
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0044	0.0383	0.0356
Schistosoma mansoni	photoreceptor-specific nuclear receptor related	0.0034	0.0256	0.1204
Loa Loa (eye worm)	intermediate filament protein	0.0026	0.0153	0.0222
Loa Loa (eye worm)	follicle stimulating hormone receptor	0.0227	0.2685	0.3898
Mycobacterium tuberculosis	Probable short-chain type dehydrogenase/reductase	0.0061	0.0595	0.2339
Loa Loa (eye worm)	hypothetical protein	0.0017	0.0038	0.0055
Echinococcus multilocularis	thyroid hormone receptor alpha	0.0034	0.0256	0.0229
Loa Loa (eye worm)	nuclear hormone receptor	0.0016	0.0027	0.004
Trypanosoma cruzi	cytochrome P450, putative	0.0027	0.0167	0.1989
Loa Loa (eye worm)	hypothetical protein	0.0034	0.0256	0.0372
Brugia malayi	follicle stimulating hormone receptor	0.0227	0.2685	0.3898
Brugia malayi	steroid hormone receptor	0.0034	0.0256	0.0372
Brugia malayi	Nuclear hormone receptor family member nhr-49	0.0034	0.0256	0.0372
Echinococcus granulosus	jun protein	0.0082	0.085	0.0825
Echinococcus multilocularis	nuclear receptor 2DBD gamma	0.0034	0.0256	0.0229
Loa Loa (eye worm)	cytochrome P450 family protein	0.0027	0.0167	0.0243
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-14	0.0034	0.0256	0.0372
Toxoplasma gondii	dihydropteroate synthase	0.0343	0.4146	1
Loa Loa (eye worm)	hypothetical protein	0.0016	0.0027	0.004
Loa Loa (eye worm)	exodeoxyribonuclease III family protein	0.0018	0.0053	0.0077
Brugia malayi	Nuclear hormone receptor family member nhr-31	0.0034	0.0256	0.0372
Echinococcus multilocularis	COUP TF:Svp nuclear hormone receptor	0.0034	0.0256	0.0229
Brugia malayi	MH2 domain containing protein	0.0116	0.1283	0.1863
Echinococcus granulosus	Basic leucine zipper bZIP transcription	0.0035	0.0263	0.0237
Brugia malayi	Ligand-binding domain of nuclear hormone receptor family protein	0.0034	0.0256	0.0372
Schistosoma mansoni	FTZ-F1 nuclear receptor-like protein	0.0034	0.0256	0.1204

Activities

Activity type	Activity value	Assay description	Source	Reference
IC50 (binding)	= 896 nM	Inhibition of recombinant human CDS1 using N-terminal biotin-labeled SGLYRSPSMPENLNRPR as substrate in presence of [gamma-33P]-ADP after 3 hrs by scintillation counting method	PATENT.	No reference

Phenotypes

Whole-cell/tissue/organism interactions

We have no records of whole-cell/tissue assays done with this compound What does this mean?

Many chemical entities in TDR Targets come from high-throughput screenings with whole cells or tissue samples, and not all assayed compounds have been tested against a single a single target protein, probably because they get ruled out during screening process. Even if these compounds may have not been of interest in the original screening, they may come as interesting leads for other screening assays. Furthermore, we may be able to propose drug-target associations using chemical similarities and network patterns.

Annotated phenotypes:

We have no manually annotated phenotypes for this drug. What does this mean? / Care to help?

In TDR Targets, information about phenotypes that are caused by drugs, or by genetic manipulation of cells (e.g. gene knockouts or knockdowns) is manually curated from the literature. These descriptions help to describe the potential of the target for drug development. If no information is available for this gene or if the information is incomplete, this may mean that i) the papers containing this information either appeared after the curation effort for this organism was carried out or they were inadvertently missed by curators; or that ii) the curation effort for this organism has not yet started.

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External resources for this compound

ChEMBL: CHEMBL3979896

Bibliographic References

No literature references available for this target.

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Detailed information for compound 2236231