TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 265.244 | Formula: C11H12FN5O2
H donors: 3 H acceptors: 3 LogP: -1.28 Rotable bonds: 3
Rule of 5 violations (Lipinski): 1
SMILES: OCC1(CF)C/C/1=C\n1cnc2c1nc(N)[nH]c2=O
InChi: 1S/C11H12FN5O2/c12-3-11(4-18)1-6(11)2-17-5-14-7-8(17)15-10(13)16-9(7)19/h2,5,18H,1,3-4H2,(H3,13,15,16,19)/b6-2+
InChiKey: SPTYJADPUUVWCD-QHHAFSJGSA-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

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
Trypanosoma cruzi	DNA polymerase kappa, putative	0.0042	0.0083	0.1552
Loa Loa (eye worm)	hypothetical protein	0.0018	0.0011	0.0011
Loa Loa (eye worm)	hypothetical protein	0.002	0.0017	0.0017
Echinococcus multilocularis	nuclear receptor 2DBD gamma	0.0018	0.0011	0.0014
Echinococcus granulosus	CREB binding protein	0.0016	0.0004	0.0005
Echinococcus multilocularis	carnitine O palmitoyltransferase 1, liver	0.0162	0.0451	0.055
Brugia malayi	Nuclear hormone receptor family member nhr-25	0.0039	0.0075	0.0075
Schistosoma mansoni	CREB-binding protein 2	0.0099	0.0257	0.1454
Schistosoma mansoni	thyroid hormone receptor	0.0039	0.0075	0.0422
Schistosoma mansoni	choline o-acyltransferase	0.0185	0.0522	0.2954
Trichomonas vaginalis	DNA polymerase IV / kappa, putative	0.0042	0.0083	0.0814
Schistosoma mansoni	zinc finger protein	0.0018	0.0011	0.0064
Schistosoma mansoni	family S12 unassigned peptidase (S12 family)	0.0037	0.0068	0.0386
Brugia malayi	beta-lactamase family protein	0.0037	0.0068	0.0068
Loa Loa (eye worm)	exodeoxyribonuclease III family protein	0.0019	0.0014	0.0014
Leishmania major	ATP-dependent DEAD/H DNA helicase recQ, putative	0.002	0.0017	0.0312
Schistosoma mansoni	RAR-like nuclear receptor	0.0039	0.0075	0.0422
Trypanosoma cruzi	DNA polymerase kappa, putative	0.0042	0.0083	0.1552
Brugia malayi	Choline/Carnitine o-acyltransferase family protein	0.0162	0.0451	0.0451
Echinococcus multilocularis	retinoic acid receptor rxr beta a retinoic acid receptor rxr alpha a retinoic acid receptor rxr alpha	0.0018	0.0011	0.0014
Schistosoma mansoni	nuclear receptor nhr-48	0.0018	0.0011	0.0064
Onchocerca volvulus		0.0055	0.0124	0.0849
Echinococcus granulosus	intermediate filament protein	0.0055	0.0124	0.0152
Brugia malayi	calcium-independent alpha-latrotoxin receptor 2, putative	0.0273	0.0793	0.0793
Echinococcus multilocularis	FTZ F1 alpha	0.0039	0.0075	0.0091
Echinococcus multilocularis	CREB binding protein	0.0016	0.0004	0.0005
Echinococcus granulosus	dna polymerase kappa	0.0042	0.0083	0.0102
Echinococcus granulosus	choline O acetyltransferase	0.0185	0.0522	0.0637
Mycobacterium tuberculosis	Probable lipase LipE	0.0037	0.0068	0.0244
Echinococcus multilocularis	Protein lozenge	0.0057	0.0129	0.0157
Schistosoma mansoni	hepatocyte nuclear factor 4-alpha (hnf-4-alpha)	0.0018	0.0011	0.0064
Onchocerca volvulus	Protein ultraspiracle homolog	0.0039	0.0075	0.0476
Brugia malayi	cytoplasmic intermediate filament protein	0.003	0.0045	0.0045
Echinococcus granulosus	COUP TF:Svp nuclear hormone receptor	0.0039	0.0075	0.0091
Trichomonas vaginalis	DNA polymerase eta, putative	0.0042	0.0083	0.0814
Loa Loa (eye worm)	hypothetical protein	0.0054	0.0121	0.0121
Plasmodium vivax	hypothetical protein, conserved	0.0037	0.0068	0.1044
Mycobacterium ulcerans	phosphopantetheinyl transferase, PptII	0.0024	0.0028	0.0051
Schistosoma mansoni	nuclear hormone receptor	0.0039	0.0075	0.0422
Echinococcus multilocularis	COUP TF:Svp nuclear hormone receptor	0.0039	0.0075	0.0091
Brugia malayi	Nuclear hormone receptor family member nhr-41	0.0039	0.0075	0.0075
Brugia malayi	Nuclear hormone receptor-like 1	0.0021	0.0018	0.0018
Brugia malayi	beta-lactamase family protein	0.0037	0.0068	0.0068
Echinococcus multilocularis	lamin dm0	0.0055	0.0124	0.0152
Echinococcus multilocularis	transcription factor btf3	0.0072	0.0176	0.0215
Brugia malayi	Intermediate filament tail domain containing protein	0.0055	0.0124	0.0124
Trypanosoma brucei	carnitine O-acetyltransferase, putative	0.0049	0.0105	0.1963
Onchocerca volvulus		0.0452	0.1342	1
Mycobacterium leprae	conserved hypothetical protein	0.0037	0.0068	0.0145
Schistosoma mansoni	nuclear receptor	0.0018	0.0011	0.0064
Leishmania major	choline/Carnitine o-acyltransferase-like protein	0.0162	0.0451	0.8398
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-41	0.0039	0.0075	0.0075
Schistosoma mansoni	FTZ-F1 nuclear receptor-like protein	0.0039	0.0075	0.0422
Echinococcus multilocularis	choline O acetyltransferase	0.0185	0.0522	0.0637
Plasmodium falciparum	ATP-dependent DNA helicase Q1	0.002	0.0017	0.0061
Echinococcus granulosus	retinoic acid receptor rxr beta a	0.0039	0.0075	0.0091
Brugia malayi	Ligand-binding domain of nuclear hormone receptor family protein	0.0039	0.0075	0.0075
Loa Loa (eye worm)	RecQ helicase	0.002	0.0017	0.0017
Trypanosoma cruzi	DNA polymerase kappa, putative	0.0042	0.0083	0.1552
Echinococcus granulosus	CREB binding protein	0.0016	0.0004	0.0005
Brugia malayi	hypothetical protein	0.0452	0.1342	0.1342
Schistosoma mansoni	hypothetical protein	0.0273	0.0793	0.4491
Brugia malayi	Nuclear hormone receptor family member nhr-40	0.0039	0.0075	0.0075
Loa Loa (eye worm)	nuclear Hormone Receptor family member	0.0039	0.0075	0.0075
Trichomonas vaginalis	N-myristoyl transferase, putative	0.019	0.0537	0.6108
Trypanosoma brucei	unspecified product	0.0035	0.0063	0.1167
Loa Loa (eye worm)	beta-lactamase	0.0037	0.0068	0.0068
Trypanosoma cruzi	N-myristoyl transferase, putative	0.019	0.0537	1
Echinococcus granulosus	carnitine O palmitoyltransferase 1 liver	0.0162	0.0451	0.055
Trypanosoma cruzi	hypothetical protein, conserved	0.0037	0.0068	0.1271
Toxoplasma gondii	NAC domain-containing protein	0.0072	0.0176	1
Mycobacterium tuberculosis	Class a beta-lactamase BlaC	0.0138	0.0377	0.1348
Schistosoma mansoni	nuclear receptor	0.0018	0.0011	0.0064
Brugia malayi	nuclear hormone receptor family member nhr-6	0.0018	0.0011	0.0011
Trypanosoma brucei	DNA polymerase IV, putative	0.0042	0.0083	0.1552
Brugia malayi	Nuclear hormone receptor family member nhr-25	0.0039	0.0075	0.0075
Schistosoma mansoni	hypothetical protein	0.0273	0.0793	0.4491
Trichomonas vaginalis	DNA helicase recq, putative	0.002	0.0017	0.0037
Loa Loa (eye worm)	hypothetical protein	0.0037	0.0068	0.0068
Leishmania major	hypothetical protein, conserved	0.0037	0.0068	0.1271
Echinococcus granulosus	beta LACTamase domain containing family member	0.0037	0.0068	0.0083
Trichomonas vaginalis	DNA helicase recq1, putative	0.002	0.0017	0.0037
Echinococcus multilocularis	L aminoadipate semialdehyde	0.0085	0.0215	0.0263
Trypanosoma brucei	hypothetical protein, conserved	0.0049	0.0105	0.1963
Onchocerca volvulus		0.0037	0.0068	0.0428
Echinococcus granulosus	nuclear receptor 2DBD gamma	0.0039	0.0075	0.0091
Echinococcus granulosus	nuclear receptor 2DBD gamma	0.0039	0.0075	0.0091
Trypanosoma brucei	DNA polymerase kappa, putative	0.0017	0.0007	0.0123
Echinococcus multilocularis	Nuclear hormone receptor HR96	0.0018	0.0011	0.0014
Trypanosoma cruzi	hypothetical protein, conserved	0.0049	0.0105	0.1963
Echinococcus multilocularis	diuretic hormone 44 receptor GPRdih2	0.2686	0.8188	1
Echinococcus multilocularis	Nuclear hormone receptor family member nhr 41	0.0039	0.0075	0.0091
Brugia malayi	Nuclear hormone receptor-like 1	0.0021	0.0018	0.0018
Mycobacterium tuberculosis	Naphthoate synthase MenB (dihydroxynaphthoic acid synthetase) (DHNA synthetase)	0.0928	0.28	1
Loa Loa (eye worm)	hypothetical protein	0.0021	0.0018	0.0018
Loa Loa (eye worm)	hypothetical protein	0.0039	0.0075	0.0075
Brugia malayi	conserved hypotetical protein	0.0018	0.0011	0.0011
Trichomonas vaginalis	D-aminoacylase, putative	0.0037	0.0068	0.0638
Echinococcus granulosus	nuclear receptor subfamily 4 group A	0.0018	0.0011	0.0014
Trypanosoma brucei	DNA polymerase kappa, putative	0.0042	0.0083	0.1552
Trypanosoma brucei	DNA polymerase kappa, putative	0.0042	0.0083	0.1552
Brugia malayi	Nuclear hormone receptor family member nhr-49	0.0039	0.0075	0.0075
Schistosoma mansoni	family S12 unassigned peptidase (S12 family)	0.0037	0.0068	0.0386
Loa Loa (eye worm)	beta-LACTamase domain containing family member	0.0037	0.0068	0.0068
Echinococcus granulosus	Nuclear hormone receptor HR96	0.0018	0.0011	0.0014
Loa Loa (eye worm)	choline O-acetyltransferase	0.0185	0.0522	0.0522
Trypanosoma cruzi	carnitine O-acetyltransferase, putative	0.0049	0.0105	0.1963
Echinococcus multilocularis	glycylpeptide N tetradecanoyltransferase	0.019	0.0537	0.0655
Giardia lamblia	DINP protein human, muc B family	0.0022	0.0021	0.0083
Echinococcus granulosus	L aminoadipate semialdehyde	0.0085	0.0215	0.0263
Trypanosoma brucei	hypothetical protein, conserved	0.0037	0.0068	0.1271
Brugia malayi	nuclear receptor RXR	0.0018	0.0011	0.0011
Brugia malayi	Nuclear hormone receptor family member nhr-1	0.0039	0.0075	0.0075
Echinococcus multilocularis	musashi	0.0055	0.0124	0.0152
Schistosoma mansoni	nuclear hormone receptor	0.0018	0.0011	0.0064
Brugia malayi	exodeoxyribonuclease III family protein	0.0019	0.0014	0.0014
Brugia malayi	Choline/Carnitine o-acyltransferase family protein	0.0049	0.0105	0.0105
Trypanosoma cruzi	transcription factor btf3, putative	0.0072	0.0176	0.3285
Trypanosoma cruzi	carnitine O-palmitoyltransferase II, putative	0.0049	0.0105	0.1963
Mycobacterium ulcerans	fructose-bisphosphate aldolase	0.0146	0.0402	0.1393
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.0298	0.087	1
Trypanosoma cruzi	DNA polymerase kappa, putative	0.0042	0.0083	0.1552
Loa Loa (eye worm)	nuclear hormone receptor	0.0018	0.0011	0.0011
Loa Loa (eye worm)	hypothetical protein	0.3276	1	1
Brugia malayi	Calcitonin receptor-like protein seb-1	0.0864	0.2605	0.2605
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-14	0.0039	0.0075	0.0075
Echinococcus granulosus	CREB binding protein	0.0099	0.0257	0.0314
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.0298	0.087	1
Loa Loa (eye worm)	hypothetical protein	0.0027	0.0036	0.0036
Brugia malayi	N-myristoyltransferase 2	0.019	0.0537	0.0537
Echinococcus multilocularis	CREB binding protein	0.0016	0.0004	0.0005
Schistosoma mansoni	intermediate filament proteins	0.0055	0.0124	0.0703
Brugia malayi	hypothetical protein	0.0018	0.0011	0.0011
Trypanosoma brucei	DNA polymerase IV, putative	0.0035	0.0063	0.1167
Mycobacterium tuberculosis	Possible conserved lipoprotein LpqK	0.0037	0.0068	0.0244
Loa Loa (eye worm)	hypothetical protein	0.0021	0.0018	0.0018
Loa Loa (eye worm)	hypothetical protein	0.0046	0.0097	0.0097
Brugia malayi	hypothetical protein	0.0021	0.0018	0.0018
Brugia malayi	orphan nuclear receptor NR2E1	0.0018	0.0011	0.0011
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-49	0.0039	0.0075	0.0075
Brugia malayi	tailless protein	0.0018	0.0011	0.0011
Trypanosoma cruzi	choline/carnitine O-acyltransferase, putative	0.0049	0.0105	0.1963
Brugia malayi	ecdysone receptor	0.0018	0.0011	0.0011
Loa Loa (eye worm)	pigment dispersing factor receptor c	0.0864	0.2605	0.2605
Loa Loa (eye worm)	hypothetical protein	0.0032	0.0052	0.0052
Mycobacterium leprae	PROBABLE NAPHTHOATE SYNTHASE MENB (DIHYDROXYNAPHTHOIC ACID SYNTHETASE) (DHNA SYNTHETASE)	0.0928	0.28	1
Plasmodium vivax	holo-[acyl-carrier-protein] synthase, putative	0.0024	0.0028	0.0274
Leishmania major	phosphopantetheinyl transferase-like protein	0.0024	0.0028	0.052
Mycobacterium ulcerans	esterase/lipase LipP	0.0037	0.0068	0.0196
Trypanosoma brucei	ATP-dependent DEAD/H DNA helicase recQ, putative	0.002	0.0017	0.0312
Mycobacterium leprae	PROBABLE CONSERVED LIPOPROTEIN LPQF	0.0066	0.0158	0.0468
Schistosoma mansoni	ap endonuclease	0.0019	0.0014	0.0077
Plasmodium falciparum	holo-[acyl-carrier-protein] synthase, putative	0.0024	0.0028	0.0274
Brugia malayi	Bloom's syndrome protein homolog	0.002	0.0017	0.0017
Onchocerca volvulus	Bile acid receptor homolog	0.0039	0.0075	0.0476
Mycobacterium ulcerans	lipase LipD	0.0037	0.0068	0.0196
Loa Loa (eye worm)	hypothetical protein	0.0273	0.0793	0.0793
Trypanosoma brucei	DNA polymerase kappa, putative	0.0042	0.0083	0.1552
Loa Loa (eye worm)	hypothetical protein	0.0452	0.1342	0.1342
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.0298	0.087	1
Brugia malayi	nuclear receptor subfamily 1, group D, member 1, putative	0.0018	0.0011	0.0011
Loa Loa (eye worm)	hypothetical protein	0.0037	0.0068	0.0068
Loa Loa (eye worm)	hypothetical protein	0.0037	0.0068	0.0068
Trypanosoma brucei	beta lactamase	0.0066	0.0158	0.2937
Trichomonas vaginalis	esterase, putative	0.0037	0.0068	0.0638
Echinococcus multilocularis	DNA (apurinic or apyrimidinic site) lyase	0.0019	0.0014	0.0017
Echinococcus granulosus	DNA apurinic or apyrimidinic site lyase	0.0019	0.0014	0.0017
Loa Loa (eye worm)	hypothetical protein	0.0018	0.0011	0.0011
Echinococcus multilocularis	GPCR, family 2	0.0273	0.0793	0.0969
Trypanosoma brucei	DNA polymerase kappa, putative	0.0042	0.0083	0.1552
Loa Loa (eye worm)	hypothetical protein	0.0039	0.0075	0.0075
Loa Loa (eye worm)	hypothetical protein	0.0039	0.0075	0.0075
Toxoplasma gondii	ABC1 family protein	0.0037	0.0068	0.3356
Echinococcus granulosus	Nuclear hormone receptor HR96	0.0018	0.0011	0.0014
Onchocerca volvulus		0.0085	0.0215	0.1532
Mycobacterium ulcerans	lipoprotein LpqF	0.0066	0.0158	0.0517
Leishmania major	DNA polymerase kappa, putative,DNA polymerase IV, putative	0.0022	0.0021	0.0385
Schistosoma mansoni	hypothetical protein	0.0273	0.0793	0.4491
Loa Loa (eye worm)	ICD-1 protein	0.0072	0.0176	0.0176
Loa Loa (eye worm)	hypothetical protein	0.0021	0.0018	0.0018
Brugia malayi	latrophilin 2 splice variant baaae	0.0591	0.1766	0.1766
Loa Loa (eye worm)	hypothetical protein	0.0039	0.0075	0.0075
Plasmodium vivax	glycylpeptide N-tetradecanoyltransferase, putative	0.019	0.0537	1
Loa Loa (eye worm)	hypothetical protein	0.0018	0.0011	0.0011
Echinococcus multilocularis	ATP dependent DNA helicase Q5	0.002	0.0017	0.002
Echinococcus granulosus	bloom syndrome protein	0.002	0.0017	0.002
Echinococcus granulosus	Nuclear hormone receptor family member nhr 41	0.0039	0.0075	0.0091
Echinococcus multilocularis	bloom syndrome protein	0.002	0.0017	0.002
Mycobacterium tuberculosis	Probable conserved lipoprotein LpqF	0.0066	0.0158	0.0563
Trypanosoma cruzi	carnitine/choline acetyltransferase, putative	0.0049	0.0105	0.1963
Trypanosoma brucei	DNA polymerase kappa, putative	0.0042	0.0083	0.1552
Brugia malayi	ATP-dependent DNA helicase, RecQ family protein	0.002	0.0017	0.0017
Mycobacterium leprae	Probable lipase LipE	0.0037	0.0068	0.0145
Trichomonas vaginalis	penicillin-binding protein, putative	0.0037	0.0068	0.0638
Mycobacterium tuberculosis	Conserved protein	0.0037	0.0068	0.0244
Loa Loa (eye worm)	nuclear hormone receptor-like 1	0.0021	0.0018	0.0018
Trypanosoma cruzi	carnitine/choline acetyltransferase, putative	0.0049	0.0105	0.1963
Onchocerca volvulus		0.0039	0.0075	0.0476
Echinococcus multilocularis	lamin	0.0055	0.0124	0.0152
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-40	0.0039	0.0075	0.0075
Schistosoma mansoni	steroid hormone receptor ad4bp	0.0039	0.0075	0.0422
Echinococcus multilocularis	cytoplasmic intermediate filament protein	0.0027	0.0036	0.0045
Echinococcus multilocularis	ecdysone induced protein 78C	0.0039	0.0075	0.0091
Echinococcus granulosus	ATP dependent DNA helicase Q5	0.002	0.0017	0.002
Loa Loa (eye worm)	hypothetical protein	0.0018	0.0011	0.0011
Trypanosoma brucei	carnitine O-palmitoyltransferase II, putative	0.0049	0.0105	0.1963
Giardia lamblia	Fructose-bisphosphate aldolase	0.0298	0.087	1
Schistosoma mansoni	ecdysone-induced protein 78c (dr-78)	0.0021	0.0018	0.0102
Schistosoma mansoni	photoreceptor-specific nuclear receptor related	0.0039	0.0075	0.0422
Loa Loa (eye worm)	hypothetical protein	0.0018	0.0011	0.0011
Loa Loa (eye worm)	hypothetical protein	0.0039	0.0075	0.0075
Mycobacterium tuberculosis	Probable conserved lipoprotein	0.0037	0.0068	0.0244
Loa Loa (eye worm)	hypothetical protein	0.0037	0.0068	0.0068
Brugia malayi	photoreceptor-specific nuclear receptor	0.0039	0.0075	0.0075
Loa Loa (eye worm)	hypothetical protein	0.0162	0.0451	0.0451
Entamoeba histolytica	transcription factor BTF3, putative	0.0072	0.0176	0.2026
Schistosoma mansoni	Tr4/Tr2 (homologue)	0.0039	0.0075	0.0422
Echinococcus granulosus	FTZ F1 nuclear receptor protein	0.0039	0.0075	0.0091
Schistosoma mansoni	nuclear hormone receptor	0.0018	0.0011	0.0064
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.0298	0.087	1
Echinococcus granulosus	CREB binding protein	0.0061	0.0141	0.0172
Loa Loa (eye worm)	nuclear receptor nhr-7B	0.0018	0.0011	0.0011
Leishmania major	DNA polymerase kappa, putative	0.0022	0.0021	0.0385
Echinococcus granulosus	diuretic hormone 44 receptor GPRdih2	0.2686	0.8188	1
Loa Loa (eye worm)	steroid hormone receptor	0.0039	0.0075	0.0075
Echinococcus multilocularis	beta LACTamase domain containing family member	0.0037	0.0068	0.0083
Schistosoma mansoni	retinoic acid receptor RXR	0.0039	0.0075	0.0422
Onchocerca volvulus		0.0037	0.0068	0.0428
Brugia malayi	nuclear receptor NHR-88	0.0018	0.0011	0.0011
Onchocerca volvulus		0.0055	0.0124	0.0849
Plasmodium falciparum	ADP-dependent DNA helicase RecQ	0.002	0.0017	0.0061
Plasmodium falciparum	glycylpeptide N-tetradecanoyltransferase	0.019	0.0537	1
Echinococcus multilocularis	nuclear receptor subfamily 4 group A	0.0018	0.0011	0.0014
Loa Loa (eye worm)	hypothetical protein	0.0037	0.0068	0.0068
Trypanosoma brucei	carnitine O-palmitoyltransferase II, putative	0.0049	0.0105	0.1963
Trichomonas vaginalis	D-aminoacylase, putative	0.0037	0.0068	0.0638
Schistosoma mansoni	thyroid hormone receptor	0.0039	0.0075	0.0422
Echinococcus multilocularis	CREB binding protein	0.0016	0.0004	0.0005
Echinococcus multilocularis	thyroid hormone receptor alpha	0.0039	0.0075	0.0091
Brugia malayi	Steroid receptor seven-up type 2	0.0039	0.0075	0.0075
Brugia malayi	hypothetical protein	0.0021	0.0018	0.0018
Brugia malayi	Nuclear hormone receptor-like 1	0.0039	0.0075	0.0075
Echinococcus granulosus	glycylpeptide N tetradecanoyltransferase	0.019	0.0537	0.0655
Echinococcus multilocularis	FTZ F1 nuclear receptor protein	0.0039	0.0075	0.0091
Loa Loa (eye worm)	hypothetical protein	0.0185	0.0522	0.0522
Schistosoma mansoni	lozenge	0.0057	0.0129	0.0728
Loa Loa (eye worm)	cytoplasmic intermediate filament protein	0.003	0.0045	0.0045
Echinococcus multilocularis	nuclear receptor 2DBD gamma	0.0039	0.0075	0.0091
Plasmodium vivax	basic transcription factor 3b, putative	0.0072	0.0176	0.3111
Trypanosoma cruzi	apurinic/apyrimidinic endonuclease, putative	0.0019	0.0014	0.0253
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-31	0.0039	0.0075	0.0075
Brugia malayi	Nuclear hormone receptor family member nhr-14	0.0039	0.0075	0.0075
Treponema pallidum	fructose-bisphosphate aldolase	0.0298	0.087	1
Brugia malayi	steroid hormone receptor	0.0039	0.0075	0.0075
Loa Loa (eye worm)	runx1	0.0057	0.0129	0.0129
Loa Loa (eye worm)	CBP-B	0.0068	0.0164	0.0164
Echinococcus granulosus	cytoplasmic intermediate filament protein	0.0027	0.0036	0.0045
Brugia malayi	Nuclear hormone receptor E75	0.0018	0.0011	0.0011
Loa Loa (eye worm)	hypothetical protein	0.0018	0.0011	0.0011
Loa Loa (eye worm)	hypothetical protein	0.0021	0.0018	0.0018
Echinococcus granulosus	nuclear receptor subfamily 1 group D	0.0021	0.0018	0.0022
Entamoeba histolytica	fructose-1,6-bisphosphate aldolase, putative	0.0298	0.087	1
Brugia malayi	nuclear hormone receptor family member odr-7	0.0018	0.0011	0.0011
Schistosoma mansoni	nuclear hormone receptor nor-1/nor-2	0.0039	0.0075	0.0422
Loa Loa (eye worm)	hypothetical protein	0.0021	0.0018	0.0018
Mycobacterium tuberculosis	Probable exodeoxyribonuclease III protein XthA (exonuclease III) (EXO III) (AP endonuclease VI)	0.0019	0.0014	0.0048
Trypanosoma brucei	DNA polymerase kappa, putative	0.0017	0.0007	0.0123
Schistosoma mansoni	hypothetical protein	0.0591	0.1766	1
Schistosoma mansoni	coup transcription factor	0.0039	0.0075	0.0422
Brugia malayi	nuclear hormone receptor	0.0039	0.0075	0.0075
Toxoplasma gondii	ATP-dependent DNA helicase, RecQ family protein	0.002	0.0017	0.0195
Echinococcus granulosus	lamin	0.0055	0.0124	0.0152
Schistosoma mansoni	N-myristoyltransferase	0.019	0.0537	0.3038
Leishmania major	N-myristoyl transferase, putative	0.019	0.0537	1
Schistosoma mansoni	retinoid-x-receptor (RXR)	0.0021	0.0018	0.0102
Schistosoma mansoni	nuclear hormone receptor superfamily protein-related	0.0018	0.0011	0.0064
Mycobacterium tuberculosis	Conserved protein	0.0037	0.0068	0.0244
Onchocerca volvulus		0.0037	0.0068	0.0428
Schistosoma mansoni	hypothetical protein	0.0273	0.0793	0.4491
Echinococcus multilocularis	cadherin EGF LAG seven pass G type receptor	0.0273	0.0793	0.0969
Loa Loa (eye worm)	hypothetical protein	0.0018	0.0011	0.0011
Brugia malayi	beta-NAC-like protein	0.0072	0.0176	0.0176
Leishmania major	basic transcription factor 3a, putative	0.0072	0.0176	0.3285
Brugia malayi	aminoadipate-semialdehyde dehydrogenase-phosphopantetheinyl transferase	0.0085	0.0215	0.0215
Schistosoma mansoni	DNA helicase recq5	0.002	0.0017	0.0095
Trypanosoma cruzi	choline/carnitine O-acetyltransferase, putative	0.0049	0.0105	0.1963
Trichomonas vaginalis	conserved hypothetical protein	0.0072	0.0176	0.19
Brugia malayi	beta-lactamase	0.0037	0.0068	0.0068
Echinococcus granulosus	thyroid hormone receptor alpha	0.0018	0.0011	0.0014
Trypanosoma brucei	hypothetical protein, conserved	0.0024	0.0028	0.052
Mycobacterium ulcerans	naphthoate synthase	0.0928	0.28	1
Onchocerca volvulus	Steroid hormone receptor family member cnr14 homolog	0.0039	0.0075	0.0476
Brugia malayi	Nuclear hormone receptor E75	0.0018	0.0011	0.0011
Loa Loa (eye worm)	hypothetical protein	0.0039	0.0075	0.0075
Brugia malayi	Nuclear hormone receptor family member nhr-19	0.0039	0.0075	0.0075
Trichomonas vaginalis	penicillin-binding protein, putative	0.0037	0.0068	0.0638
Entamoeba histolytica	fructose-1,6-bisphosphate aldolase, putative	0.0298	0.087	1
Trypanosoma brucei	DNA polymerase kappa, putative	0.0032	0.0052	0.0969
Brugia malayi	nuclear receptor NHR-67	0.0018	0.0011	0.0011
Mycobacterium tuberculosis	Probable esterase LipL	0.0037	0.0068	0.0244
Loa Loa (eye worm)	hypothetical protein	0.0018	0.0011	0.0011
Echinococcus granulosus	cadherin EGF LAG seven pass G type receptor	0.0273	0.0793	0.0969
Echinococcus granulosus	nuclear receptor nhr 48	0.0018	0.0011	0.0014
Loa Loa (eye worm)	hypothetical protein	0.0026	0.0033	0.0033
Leishmania major	carnitine/choline acetyltransferase, putative	0.0049	0.0105	0.1963
Giardia lamblia	Sgs1 DNA helicase, putative	0.002	0.0017	0.0037
Brugia malayi	TAZ zinc finger family protein	0.0099	0.0257	0.0257
Schistosoma mansoni	lamin	0.0055	0.0124	0.0703
Trichomonas vaginalis	N-myristoyl transferase, putative	0.0125	0.0337	0.3778
Trypanosoma cruzi	N-myristoyl transferase, putative	0.019	0.0537	1
Trypanosoma brucei	DNA polymerase kappa, putative	0.0017	0.0007	0.0123
Echinococcus multilocularis	hepatocyte nuclear factor 4 alpha	0.0039	0.0075	0.0091
Mycobacterium ulcerans	DNA polymerase IV	0.0042	0.0083	0.025
Loa Loa (eye worm)	intermediate filament tail domain-containing protein	0.0055	0.0124	0.0124
Trypanosoma cruzi	hypothetical protein, conserved	0.0049	0.0105	0.1963
Mycobacterium ulcerans	4'-phosphopantetheinyl transferase	0.0024	0.0028	0.0051
Trypanosoma brucei	transcription factor BTF3, putative	0.0072	0.0176	0.3285
Mycobacterium tuberculosis	Possible penicillin-binding protein	0.0237	0.068	0.2428
Brugia malayi	hypothetical protein	0.0018	0.0011	0.0011
Leishmania major	apurinic/apyrimidinic endonuclease-redox protein	0.0019	0.0014	0.0253
Brugia malayi	ecdysteroid receptor	0.0039	0.0075	0.0075
Loa Loa (eye worm)	N-myristoyltransferase 2	0.019	0.0537	0.0537
Echinococcus granulosus	FTZ F1 alpha	0.0039	0.0075	0.0091
Echinococcus multilocularis	carnitine O palmitoyltransferase 2	0.0049	0.0105	0.0129
Loa Loa (eye worm)	hypothetical protein	0.0026	0.0033	0.0033
Brugia malayi	nuclear receptor NHR-88	0.0039	0.0075	0.0075
Brugia malayi	Choline/Carnitine o-acyltransferase family protein	0.0049	0.0105	0.0105
Toxoplasma gondii	4'-phosphopantetheinyl transferase superfamily protein	0.0024	0.0028	0.0881
Trypanosoma cruzi	transcription factor btf3, putative	0.0072	0.0176	0.3285
Wolbachia endosymbiont of Brugia malayi	4'-phosphopantetheinyl transferase	0.0024	0.0028	1
Brugia malayi	Choline O-acetyltransferase	0.0185	0.0522	0.0522
Trypanosoma brucei	carnitine O-palmitoyltransferase, putative	0.0049	0.0105	0.1963
Trypanosoma brucei	N-myristoyltransferase	0.019	0.0537	1
Loa Loa (eye worm)	hypothetical protein	0.0018	0.0011	0.0011
Loa Loa (eye worm)	hypothetical protein	0.0039	0.0075	0.0075
Echinococcus granulosus	nuclear receptor 2DBD gamma	0.0018	0.0011	0.0014
Schistosoma mansoni	DNA helicase recq1	0.002	0.0017	0.0095
Mycobacterium tuberculosis	Probable esterase/lipase LipP	0.0037	0.0068	0.0244
Trypanosoma brucei	DNA polymerase kappa, putative	0.0042	0.0083	0.1552
Trichomonas vaginalis	conserved hypothetical protein	0.0072	0.0176	0.19
Mycobacterium tuberculosis	Conserved protein	0.0037	0.0068	0.0244
Brugia malayi	Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative	0.0037	0.0068	0.0068
Trypanosoma cruzi	hypothetical protein, conserved	0.0037	0.0068	0.1271
Echinococcus granulosus	transcription factor btf3	0.0072	0.0176	0.0215
Chlamydia trachomatis	holo [acyl-carrier protein] synthase	0.0024	0.0028	0.5
Entamoeba histolytica	glycylpeptide N-tetradecanoyltransferase, putative	0.019	0.0537	0.6169
Brugia malayi	nuclear hormone receptor	0.0018	0.0011	0.0011
Echinococcus multilocularis	ATP dependent DNA helicase Q1	0.002	0.0017	0.002
Loa Loa (eye worm)	nuclear receptor NHR-67	0.0018	0.0011	0.0011
Loa Loa (eye worm)	intermediate filament protein	0.0055	0.0124	0.0124
Loa Loa (eye worm)	hypothetical protein	0.0018	0.0011	0.0011
Echinococcus multilocularis	nuclear receptor subfamily 1 group D	0.0021	0.0018	0.0022
Trypanosoma brucei	DNA polymerase kappa, putative	0.0022	0.0021	0.0385
Schistosoma mansoni	retinoid-x-receptor (RXR)	0.0039	0.0075	0.0422
Echinococcus multilocularis	nuclear receptor 2DBD gamma	0.0039	0.0075	0.0091
Brugia malayi	intermediate filament protein	0.0055	0.0124	0.0124
Schistosoma mansoni	lamin	0.0055	0.0124	0.0703
Echinococcus granulosus	ATP dependent DNA helicase Q1	0.002	0.0017	0.002
Echinococcus granulosus	ecdysone induced protein 78C	0.0039	0.0075	0.0091
Loa Loa (eye worm)	hypothetical protein	0.0018	0.0011	0.0011
Trypanosoma cruzi	choline/carnitine O-acyltransferase, putative	0.0162	0.0451	0.8398
Echinococcus multilocularis	nuclear receptor nhr 48	0.0018	0.0011	0.0014
Mycobacterium tuberculosis	Probable hydrolase	0.0037	0.0068	0.0244
Trypanosoma brucei	N-myristoyl transferase, putative	0.019	0.0537	1
Leishmania major	carnitine palmitoyltransferase-like protein	0.0049	0.0105	0.1963
Mycobacterium tuberculosis	Probable lipase LipD	0.0037	0.0068	0.0244
Loa Loa (eye worm)	DR-78	0.0018	0.0011	0.0011
Mycobacterium ulcerans	DNA polymerase IV	0.0042	0.0083	0.025
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.0298	0.087	1
Mycobacterium ulcerans	hypothetical protein	0.0037	0.0068	0.0196
Onchocerca volvulus		0.0049	0.0105	0.0707
Mycobacterium leprae	Probable fructose bisphosphate aldolase Fba	0.0146	0.0402	0.1349
Mycobacterium ulcerans	fusion of enoyl-CoA hydratase, EchA21 and lipase, LipE	0.0044	0.0091	0.0278
Trypanosoma brucei	DNA polymerase kappa, putative	0.0032	0.0052	0.0969
Giardia lamblia	CDC72	0.019	0.0537	0.6108
Loa Loa (eye worm)	carnitine O-palmitoyltransferase I isoform	0.0049	0.0105	0.0105
Schistosoma mansoni	CREB-binding protein 1 (SmCBP1)	0.0099	0.0257	0.1454
Schistosoma mansoni	aminoadipate-semialdehyde dehydrogenase	0.0085	0.0215	0.1217
Entamoeba histolytica	hypothetical protein	0.0072	0.0176	0.2026
Mycobacterium tuberculosis	holo-[acyl-carrier protein] synthase AcpS (holo-ACP synthase) (CoA:APO-[ACP]pantetheinephosphotransferase) (CoA:APO-[acyl-carrie	0.0024	0.0028	0.01
Trypanosoma brucei	apurinic/apyrimidinic endonuclease, putative	0.0019	0.0014	0.0253
Schistosoma mansoni	nuclear receptor 2DBD-gamma	0.0039	0.0075	0.0422
Onchocerca volvulus		0.0049	0.0105	0.0707
Toxoplasma gondii	4'-phosphopantetheinyl transferase domain-containing protein	0.0024	0.0028	0.0881
Echinococcus granulosus	lamin dm0	0.0055	0.0124	0.0152
Onchocerca volvulus		0.0049	0.0105	0.0707
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.0298	0.087	1
Toxoplasma gondii	ATP-dependent DNA helicase, RecQ family protein	0.002	0.0017	0.0195
Brugia malayi	Nuclear hormone receptor family member nhr-31	0.0039	0.0075	0.0075
Schistosoma mansoni	choline o-acyltransferase	0.0049	0.0105	0.0596
Loa Loa (eye worm)	latrophilin receptor protein 2	0.0273	0.0793	0.0793
Schistosoma mansoni	ap endonuclease	0.0019	0.0014	0.0077
Brugia malayi	Ligand-binding domain of nuclear hormone receptor family protein	0.0039	0.0075	0.0075
Mycobacterium tuberculosis	Probable fructose-bisphosphate aldolase Fba	0.0146	0.0402	0.1435
Loa Loa (eye worm)	ATP-dependent DNA helicase	0.002	0.0017	0.0017
Brugia malayi	Nuclear hormone receptor family member nhr-19	0.0039	0.0075	0.0075
Brugia malayi	nuclear receptor RXR	0.0021	0.0018	0.0018
Plasmodium falciparum	basic transcription factor 3b, putative	0.0072	0.0176	0.3111
Mycobacterium ulcerans	beta-lactamase	0.0037	0.0068	0.0196
Trypanosoma cruzi	choline/carnitine O-acyltransferase, putative	0.0162	0.0451	0.8398
Trypanosoma cruzi	ATP-dependent DEAD/H DNA helicase recQ, putative	0.002	0.0017	0.0312
Trypanosoma cruzi	hypothetical protein, conserved	0.0049	0.0105	0.1963
Trypanosoma cruzi	hypothetical protein, conserved	0.0049	0.0105	0.1963
Echinococcus granulosus	GPCR family 2	0.0273	0.0793	0.0969
Entamoeba histolytica	recQ family helicase, putative	0.002	0.0017	0.0192
Trypanosoma cruzi	apurinic/apyrimidinic endonuclease	0.0019	0.0014	0.0253
Trypanosoma brucei	DNA polymerase kappa, putative	0.0042	0.0083	0.1552
Echinococcus multilocularis	dna polymerase kappa	0.0042	0.0083	0.0102
Loa Loa (eye worm)	hypothetical protein	0.0055	0.0124	0.0124
Trichomonas vaginalis	DNA helicase recq, putative	0.002	0.0017	0.0037
Treponema pallidum	4'-phosphopantetheinyl transferase	0.0024	0.0028	0.0167
Onchocerca volvulus		0.0049	0.0105	0.0707
Echinococcus granulosus	hepatocyte nuclear factor 4 alpha	0.0039	0.0075	0.0091
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.0298	0.087	1
Trypanosoma brucei	DNA polymerase IV, putative	0.0042	0.0083	0.1552
Loa Loa (eye worm)	hypothetical protein	0.0039	0.0075	0.0075
Brugia malayi	Nuclear hormone receptor family member nhr-3	0.0039	0.0075	0.0075
Loa Loa (eye worm)	hypothetical protein	0.0018	0.0011	0.0011
Schistosoma mansoni	transcription factor btf3	0.0072	0.0176	0.0998
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.0298	0.087	1
Brugia malayi	ATP-dependent DNA helicase, RecQ family protein	0.002	0.0017	0.0017
Mycobacterium tuberculosis	Possible DNA-damage-inducible protein P DinP (DNA polymerase V) (pol IV 2) (DNA nucleotidyltransferase (DNA-directed))	0.0022	0.0021	0.0074
Trypanosoma brucei	DNA polymerase kappa, putative	0.0042	0.0083	0.1552
Loa Loa (eye worm)	choline/Carnitine O-acyltransferase	0.0049	0.0105	0.0105
Trichomonas vaginalis	D-aminoacylase, putative	0.0037	0.0068	0.0638
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-1	0.0039	0.0075	0.0075
Loa Loa (eye worm)	hypothetical protein	0.0037	0.0068	0.0068
Trypanosoma cruzi	hypothetical protein, conserved	0.0049	0.0105	0.1963
Loa Loa (eye worm)	hypothetical protein	0.0085	0.0215	0.0215
Brugia malayi	Latrophilin receptor protein 2	0.0273	0.0793	0.0793
Echinococcus multilocularis	CREB binding protein	0.0068	0.0162	0.0198
Loa Loa (eye worm)	hypothetical protein	0.0452	0.1342	0.1342
Loa Loa (eye worm)	hypothetical protein	0.0018	0.0011	0.0011
Entamoeba histolytica	exodeoxyribonuclease III, putative	0.0019	0.0014	0.0156
Echinococcus granulosus	carnitine O palmitoyltransferase 2	0.0049	0.0105	0.0129
Trypanosoma brucei	DNA polymerase kappa, putative	0.0042	0.0083	0.1552
Entamoeba histolytica	hypothetical protein	0.0024	0.0028	0.0321
Brugia malayi	Choline O-acetyltransferase	0.0185	0.0522	0.0522
Brugia malayi	polk-prov protein	0.0032	0.0052	0.0052
Mycobacterium ulcerans	class a beta-lactamase, BlaC	0.0138	0.0377	0.1306
Echinococcus multilocularis	Nuclear hormone receptor HR96	0.0018	0.0011	0.0014
Loa Loa (eye worm)	hypothetical protein	0.0591	0.1766	0.1766
Trichomonas vaginalis	conserved hypothetical protein	0.0072	0.0176	0.19

Activities

Activity type	Activity value	Assay description	Source	Reference
CC50 (ADMET)	= 64.1 uM	Cytotoxicity against human akata cells by DNA hybridization assay	ChEMBL.	18082410
EC50 (functional)	= 3.2 uM	Antiviral activity against Epstein-Barr virus infected in human akata cells	ChEMBL.	18082410
Selectivity index (functional)	= 20	Selectivity index, ratio of EC50 for Epstein-Barr virus to CC50 for human akata cells	ChEMBL.	18082410

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: CHEMBL263371

Bibliographic References

1 literature reference was collected for this gene.

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Detailed information for compound 515931