TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 497.557 | Formula: C26H25F2N3O3S
H donors: 2 H acceptors: 3 LogP: 4.16 Rotable bonds: 9
Rule of 5 violations (Lipinski): 1
SMILES: Fc1ccc(cc1)CNC(=O)c1cn(C)c2c(c1=O)cc(s2)CN(CC(c1ccc(cc1)F)O)C
InChi: 1S/C26H25F2N3O3S/c1-30(15-23(32)17-5-9-19(28)10-6-17)13-20-11-21-24(33)22(14-31(2)26(21)35-20)25(34)29-12-16-3-7-18(27)8-4-16/h3-11,14,23,32H,12-13,15H2,1-2H3,(H,29,34)
InChiKey: MXMYSZAOCNDKMW-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
Human cytomegalovirus (strain AD169) (HHV-5) (Human herpesvirus 5)	Human herpesvirus 5 DNA polymerase	Starlite/ChEMBL	References

Predicted pathogen targets for this compound

By orthology

Species	Potential target	Known druggable target/s	Ortholog Group
Plasmodium knowlesi	DNA polymerase delta catalytic subunit, putative	Get druggable targets OG5_127429	All targets in OG5_127429
Theileria parva	DNA polymerase delta catalytic subunit, putative	Get druggable targets OG5_127429	All targets in OG5_127429
Trypanosoma cruzi	DNA polymerase delta catalytic subunit, putative	Get druggable targets OG5_127429	All targets in OG5_127429
Leishmania major	DNA polymerase delta catalytic subunit, putative	Get druggable targets OG5_127429	All targets in OG5_127429
Trypanosoma brucei	DNA polymerase delta catalytic subunit, putative	Get druggable targets OG5_127429	All targets in OG5_127429
Brugia malayi	DNA polymerase delta catalytic subunit	Get druggable targets OG5_127429	All targets in OG5_127429
Plasmodium yoelii	DNA polymerase delta catalytic subunit	Get druggable targets OG5_127429	All targets in OG5_127429
Cryptosporidium parvum	DNA polymerase delta catalytic subunit. DNAQ-like 3-5 exonuclease; RNAseH fold	Get druggable targets OG5_127429	All targets in OG5_127429
Plasmodium falciparum	DNA polymerase delta catalytic subunit	Get druggable targets OG5_127429	All targets in OG5_127429
Babesia bovis	DNA polymerase delta subunit	Get druggable targets OG5_127429	All targets in OG5_127429
Leishmania braziliensis	DNA polymerase delta catalytic subunit, putative	Get druggable targets OG5_127429	All targets in OG5_127429
Trypanosoma congolense	DNA polymerase delta catalytic subunit, putative	Get druggable targets OG5_127429	All targets in OG5_127429
Candida albicans	N terminus of DNA-directed DNA polymerase III (delta)	Get druggable targets OG5_127429	All targets in OG5_127429
Candida albicans	N terminus of DNA-directed DNA polymerase III (delta)	Get druggable targets OG5_127429	All targets in OG5_127429
Echinococcus granulosus	DNA polymerase delta catalytic subunit	Get druggable targets OG5_127429	All targets in OG5_127429
Candida albicans	hypothetical protein	Get druggable targets OG5_127429	All targets in OG5_127429
Plasmodium berghei	DNA polymerase delta catalytic subunit, putative	Get druggable targets OG5_127429	All targets in OG5_127429
Entamoeba histolytica	DNA polymerase delta catalytic subunit, putative	Get druggable targets OG5_127429	All targets in OG5_127429
Leishmania donovani	DNA polymerase delta catalytic subunit, putative	Get druggable targets OG5_127429	All targets in OG5_127429
Schistosoma mansoni	DNA polymerase delta catalytic subunit	Get druggable targets OG5_127429	All targets in OG5_127429
Neospora caninum	DNA polymerase (EC 2.7.7.7), related	Get druggable targets OG5_127429	All targets in OG5_127429
Loa Loa (eye worm)	DNA-directed DNA polymerase III	Get druggable targets OG5_127429	All targets in OG5_127429
Schistosoma japonicum	ko:K02327 DNA polymerase delta subunit 1, putative	Get druggable targets OG5_127429	All targets in OG5_127429
Giardia lamblia	DNA polymerase delta, catalytic subunit	Get druggable targets OG5_127429	All targets in OG5_127429
Onchocerca volvulus	DNA polymerase delta catalytic subunit homolog	Get druggable targets OG5_127429	All targets in OG5_127429
Plasmodium vivax	DNA polymerase delta catalytic subunit, putative	Get druggable targets OG5_127429	All targets in OG5_127429
Leishmania mexicana	DNA polymerase delta catalytic subunit, putative	Get druggable targets OG5_127429	All targets in OG5_127429
Trypanosoma brucei gambiense	DNA polymerase delta catalytic subunit, putative	Get druggable targets OG5_127429	All targets in OG5_127429
Echinococcus multilocularis	DNA polymerase delta catalytic subunit	Get druggable targets OG5_127429	All targets in OG5_127429
Trypanosoma cruzi	DNA polymerase delta catalytic subunit, putative	Get druggable targets OG5_127429	All targets in OG5_127429
Leishmania infantum	DNA polymerase delta catalytic subunit, putative	Get druggable targets OG5_127429	All targets in OG5_127429
Trichomonas vaginalis	DNA polymerase zeta catalytic subunit, putative	Get druggable targets OG5_127429	All targets in OG5_127429
Cryptosporidium hominis	DNA polymerase family B subunit	Get druggable targets OG5_127429	All targets in OG5_127429
Toxoplasma gondii	DNA polymerase	Get druggable targets OG5_127429	All targets in OG5_127429

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
Echinococcus granulosus	inositol monophosphatase 1	0.0036	0.0398	0.057
Toxoplasma gondii	PHD-finger domain-containing protein	0.0065	0.0986	0.6167
Brugia malayi	jmjC domain containing protein	0.0021	0.01	0.0114
Mycobacterium leprae	Probable lipase LipE	0.0035	0.0379	0.0156
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0046	0.0612	0.0876
Echinococcus granulosus	lysine specific demethylase 6a	0.0021	0.01	0.0143
Toxoplasma gondii	DNA polymerase family B protein	0.003	0.0291	0.133
Mycobacterium ulcerans	long-chain-acyl-CoA synthetase	0.0224	0.419	0.6627
Brugia malayi	Corticotropin releasing factor receptor 2 precursor, putative	0.0048	0.0649	0.0742
Echinococcus multilocularis	Jumonji, AT rich interactive domain 1B	0.0021	0.01	0.0143
Mycobacterium tuberculosis	Probable esterase/lipase LipP	0.0035	0.0379	0.0149
Echinococcus granulosus	FTZ F1 nuclear receptor protein	0.003	0.0287	0.0412
Brugia malayi	jmjC domain containing protein	0.0021	0.01	0.0114
Echinococcus granulosus	retinoic acid receptor rxr beta a	0.003	0.0287	0.0412
Brugia malayi	DNA polymerase alpha catalytic subunit	0.003	0.0291	0.0333
Echinococcus granulosus	intermediate filament protein	0.0026	0.0203	0.0292
Echinococcus multilocularis	long chain fatty acid transport protein 4	0.0217	0.4048	0.5801
Echinococcus multilocularis	FTZ F1 alpha	0.003	0.0287	0.0412
Schistosoma mansoni	FFA transport protein	0.0217	0.4048	0.5801
Loa Loa (eye worm)	jmjC domain-containing protein	0.0078	0.1261	0.1441
Loa Loa (eye worm)	hypothetical protein	0.0026	0.0203	0.0233
Echinococcus multilocularis	ecdysone induced protein 78C	0.003	0.0287	0.0412
Schistosoma mansoni	bromodomain-containing nuclear protein 1 brd1	0.0065	0.0986	0.1412
Loa Loa (eye worm)	jmjC domain-containing protein	0.0021	0.01	0.0114
Trichomonas vaginalis	D-aminoacylase, putative	0.0035	0.0379	0.0362
Schistosoma mansoni	nuclear hormone receptor nor-1/nor-2	0.003	0.0287	0.0412
Brugia malayi	Nuclear hormone receptor-like 1	0.003	0.0287	0.0329
Trypanosoma brucei	DNA polymerase delta catalytic subunit, putative	0.0092	0.1536	1
Brugia malayi	Nuclear hormone receptor family member nhr-14	0.003	0.0287	0.0329
Loa Loa (eye worm)	steroid hormone receptor	0.003	0.0287	0.0329
Mycobacterium ulcerans	aldehyde dehydrogenase	0.0064	0.0969	0.1025
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.0296	0.5643	0.5635
Plasmodium vivax	hypothetical protein, conserved	0.0035	0.0379	0.1946
Schistosoma mansoni	DNA polymerase delta catalytic subunit	0.0092	0.1536	0.2201
Echinococcus multilocularis	phd:f box containing protein	0.0021	0.01	0.0143
Brugia malayi	hypothetical protein	0.0035	0.0379	0.0433
Trypanosoma cruzi	hypothetical protein, conserved	0.0035	0.0379	0.0708
Trypanosoma brucei	DNA polymerase alpha catalytic subunit	0.003	0.0291	0.133
Brugia malayi	jmjC domain containing protein	0.0021	0.01	0.0114
Loa Loa (eye worm)	hypothetical protein	0.0017	0.0018	0.0021
Loa Loa (eye worm)	inositol-1	0.0036	0.0398	0.0455
Echinococcus granulosus	Nuclear hormone receptor family member nhr 41	0.003	0.0287	0.0412
Schistosoma mansoni	hypothetical protein	0.0362	0.6978	1
Trichomonas vaginalis	chromobox protein, putative	0.0044	0.0571	0.0554
Brugia malayi	Pre-SET motif family protein	0.045	0.8747	1
Echinococcus multilocularis	thyroid hormone receptor alpha	0.003	0.0287	0.0412
Loa Loa (eye worm)	hypothetical protein	0.0065	0.0979	0.1119
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.0296	0.5643	0.5635
Echinococcus granulosus	nuclear receptor 2DBD gamma	0.003	0.0287	0.0412
Brugia malayi	jmjC domain containing protein	0.0212	0.3961	0.4528
Mycobacterium tuberculosis	Probable fructose-bisphosphate aldolase Fba	0.0144	0.2592	0.5915
Schistosoma mansoni	histone-lysine n-methyltransferase setb1	0.0065	0.0979	0.1403
Brugia malayi	AMP-binding enzyme family protein	0.0224	0.419	0.479
Schistosoma mansoni	Tr4/Tr2 (homologue)	0.003	0.0287	0.0412
Plasmodium vivax	DNA polymerase alpha, putative	0.003	0.0291	0.133
Mycobacterium ulcerans	aldehyde dehydrogenase	0.0064	0.0969	0.1025
Trichomonas vaginalis	penicillin-binding protein, putative	0.0035	0.0379	0.0362
Brugia malayi	jmjC domain containing protein	0.0021	0.01	0.0114
Echinococcus granulosus	5'partial\|histone lysine N methyltransferase SETDB2	0.0062	0.0931	0.1334
Brugia malayi	DNA polymerase family B containing protein	0.003	0.0291	0.0333
Entamoeba histolytica	fructose-1,6-bisphosphate aldolase, putative	0.0296	0.5643	1
Entamoeba histolytica	fructose-1,6-bisphosphate aldolase, putative	0.0296	0.5643	1
Brugia malayi	beta-lactamase family protein	0.0035	0.0379	0.0434
Loa Loa (eye worm)	hypothetical protein	0.003	0.0287	0.0329
Toxoplasma gondii	ABC1 family protein	0.0035	0.0379	0.1946
Echinococcus granulosus	dna polymerase epsilon catalytic subunit a	0.003	0.0291	0.0417
Trichomonas vaginalis	conserved hypothetical protein	0.0041	0.0508	0.0491
Schistosoma mansoni	coup transcription factor	0.003	0.0287	0.0412
Schistosoma mansoni	hypothetical protein	0.0065	0.0986	0.1412
Onchocerca volvulus	DNA polymerase epsilon catalytic subunit A homolog	0.003	0.0291	0.009
Loa Loa (eye worm)	hypothetical protein	0.0065	0.0986	0.1127
Trypanosoma cruzi	DNA polymerase I alpha catalytic subunit, putative	0.003	0.0291	0.0484
Toxoplasma gondii	PHD-finger domain-containing protein	0.0021	0.0105	0.0037
Mycobacterium leprae	possible long-chain acyl-CoA synthase	0.0214	0.3991	1
Loa Loa (eye worm)	hypothetical protein	0.003	0.0291	0.0333
Mycobacterium tuberculosis	Probable hydrolase	0.0035	0.0379	0.0149
Trichomonas vaginalis	inositol monophosphatase, putative	0.0036	0.0398	0.038
Mycobacterium tuberculosis	Probable lipase LipD	0.0035	0.0379	0.0149
Trichomonas vaginalis	D-aminoacylase, putative	0.0035	0.0379	0.0362
Echinococcus granulosus	Basic leucine zipper bZIP transcription	0.0035	0.0379	0.0543
Echinococcus multilocularis	DNA polymerase delta catalytic subunit	0.0092	0.1536	0.2201
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-49	0.003	0.0287	0.0329
Toxoplasma gondii	PHD-finger domain-containing protein	0.0065	0.0986	0.6167
Brugia malayi	Intermediate filament tail domain containing protein	0.0026	0.0203	0.0233
Mycobacterium leprae	Probable fructose bisphosphate aldolase Fba	0.0144	0.2592	0.6187
Mycobacterium tuberculosis	Probable aldehyde dehydrogenase	0.0064	0.0969	0.1684
Loa Loa (eye worm)	hypothetical protein	0.003	0.0287	0.0329
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-14	0.003	0.0287	0.0329
Toxoplasma gondii	histone lysine methyltransferase SET/SUV39	0.0065	0.0979	0.612
Trypanosoma cruzi	myo-inositol-1(or 4)-monophosphatase 1, putative	0.0036	0.0398	0.0754
Loa Loa (eye worm)	beta-lactamase	0.0035	0.0379	0.0434
Loa Loa (eye worm)	hypothetical protein	0.003	0.0287	0.0329
Leishmania major	aldehyde dehydrogenase, mitochondrial precursor	0.0064	0.0969	0.2232
Schistosoma mansoni	chromobox protein	0.0073	0.1159	0.1661
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0046	0.0612	0.0876
Brugia malayi	Steroid receptor seven-up type 2	0.003	0.0287	0.0329
Trichomonas vaginalis	chromobox protein, putative	0.0044	0.0571	0.0554
Loa Loa (eye worm)	hypothetical protein	0.0021	0.01	0.0114
Brugia malayi	glutaminase DH11.1	0.032	0.6129	0.7007
Echinococcus multilocularis	beta LACTamase domain containing family member	0.0035	0.0379	0.0544
Echinococcus granulosus	aldehyde dehydrogenase mitochondrial	0.0064	0.0969	0.1388
Plasmodium vivax	DNA polymerase epsilon, catalytic subunit a, putative	0.003	0.0291	0.133
Mycobacterium ulcerans	extragenic suppressor protein SuhB	0.0036	0.0398	0.0032
Loa Loa (eye worm)	hypothetical protein	0.0035	0.0379	0.0434
Trichomonas vaginalis	conserved hypothetical protein	0.0029	0.0266	0.0248
Mycobacterium tuberculosis	Probable conserved lipoprotein	0.0035	0.0379	0.0149
Trypanosoma brucei	hypothetical protein, conserved	0.0035	0.0379	0.1946
Echinococcus multilocularis	nuclear receptor 2DBD gamma	0.003	0.0287	0.0412
Plasmodium falciparum	JmjC domain-containing protein, putative	0.0021	0.01	0.0539
Loa Loa (eye worm)	beta-LACTamase domain containing family member	0.0035	0.0379	0.0434
Trichomonas vaginalis	conserved hypothetical protein	0.0041	0.0508	0.0491
Wolbachia endosymbiont of Brugia malayi	fructose-1,6-bisphosphatase	0.0036	0.0398	0.5
Echinococcus multilocularis	jumonji domain containing protein	0.009	0.1498	0.2146
Schistosoma mansoni	hypothetical protein	0.0035	0.0379	0.0543
Schistosoma mansoni	chromobox protein	0.0073	0.1159	0.1661
Trypanosoma brucei	PHD-zinc-finger like domain containing protein, putative	0.0021	0.0105	0.0037
Brugia malayi	F/Y-rich N-terminus family protein	0.0024	0.0153	0.0175
Echinococcus multilocularis	lysine specific demethylase 6a	0.0021	0.01	0.0143
Loa Loa (eye worm)	hypothetical protein	0.0171	0.3134	0.3582
Schistosoma mansoni	aldehyde dehydrogenase	0.0064	0.0969	0.1388
Trichomonas vaginalis	DNA polymerase zeta catalytic subunit, putative	0.0092	0.1536	0.152
Schistosoma mansoni	ubiquitously transcribed sex (X/Y) chromosome tetratricopeptide repeat protein-related	0.0021	0.01	0.0143
Loa Loa (eye worm)	glutaminase 2	0.032	0.6129	0.7007
Echinococcus granulosus	peregrin	0.0065	0.0986	0.1412
Giardia lamblia	Fructose-bisphosphate aldolase	0.0296	0.5643	1
Leishmania major	DNA polymerase epsilon catalytic subunit, putative	0.003	0.0291	0.0491
Trypanosoma cruzi	DNA polymerase epsilon catalytic subunit, putative	0.003	0.0291	0.0484
Loa Loa (eye worm)	hypothetical protein	0.0048	0.0649	0.0742
Trichomonas vaginalis	myo inositol monophosphatase, putative	0.0036	0.0398	0.038
Loa Loa (eye worm)	hypothetical protein	0.0021	0.01	0.0114
Echinococcus multilocularis	dna polymerase epsilon catalytic subunit a	0.003	0.0291	0.0417
Brugia malayi	photoreceptor-specific nuclear receptor	0.003	0.0287	0.0329
Schistosoma mansoni	phd/f-box containing protein	0.0021	0.01	0.0143
Echinococcus granulosus	jumonji domain containing 1A	0.0021	0.01	0.0143
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.0296	0.5643	0.5635
Loa Loa (eye worm)	intermediate filament tail domain-containing protein	0.0026	0.0203	0.0233
Trichomonas vaginalis	DNA polymerase alpha catalytic subunit, putative	0.003	0.0291	0.0273
Echinococcus multilocularis	jumonji domain containing 1A	0.0021	0.01	0.0143
Schistosoma mansoni	intermediate filament proteins	0.0026	0.0203	0.0292
Echinococcus granulosus	geminin	0.0362	0.6978	1
Plasmodium vivax	hypothetical protein, conserved	0.0021	0.0105	0.0037
Plasmodium falciparum	conserved Plasmodium membrane protein, unknown function	0.0021	0.0105	0.0574
Giardia lamblia	PHD finger protein 15	0.0065	0.0986	0.1298
Trichomonas vaginalis	myo inositol monophosphatase, putative	0.0036	0.0398	0.038
Schistosoma mansoni	lamin	0.0026	0.0203	0.0292
Onchocerca volvulus	Steroid hormone receptor family member cnr14 homolog	0.003	0.0287	0.0086
Trypanosoma cruzi	fatty acid transporter protein-like, putative	0.0217	0.4048	1
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-41	0.003	0.0287	0.0329
Echinococcus multilocularis	FTZ F1 nuclear receptor protein	0.003	0.0287	0.0412
Loa Loa (eye worm)	hypothetical protein	0.003	0.0287	0.0329
Schistosoma mansoni	family S12 unassigned peptidase (S12 family)	0.0035	0.0379	0.0544
Brugia malayi	Nuclear hormone receptor family member nhr-25	0.003	0.0287	0.0329
Schistosoma mansoni	protein phosphatase 2C	0.0021	0.01	0.0143
Onchocerca volvulus		0.003	0.0287	0.0086
Mycobacterium tuberculosis	Probable lipase LipE	0.0035	0.0379	0.0149
Loa Loa (eye worm)	intermediate filament protein	0.0026	0.0203	0.0233
Onchocerca volvulus	Heterochromatin protein 1 homolog	0.0044	0.0571	0.0375
Schistosoma mansoni	jumonji domain containing protein	0.0169	0.308	0.4415
Echinococcus multilocularis	lysine specific demethylase 5A	0.0078	0.1261	0.1807
Onchocerca volvulus	Alhambra homolog	0.0065	0.0986	0.0798
Schistosoma mansoni	transcription factor LCR-F1	0.0035	0.0379	0.0543
Schistosoma mansoni	DNA polymerase zeta catalytic subunit	0.003	0.0291	0.0417
Brugia malayi	PHD-finger family protein	0.0065	0.0986	0.1127
Schistosoma mansoni	nuclear hormone receptor	0.003	0.0287	0.0412
Mycobacterium tuberculosis	Conserved protein	0.0035	0.0379	0.0149
Onchocerca volvulus	DNA polymerase homolog	0.003	0.0291	0.009
Mycobacterium ulcerans	fructose-bisphosphate aldolase	0.0144	0.2592	0.3848
Loa Loa (eye worm)	nuclear Hormone Receptor family member	0.003	0.0287	0.0329
Schistosoma mansoni	DNA polymerase alpha catalytic subunit	0.003	0.0291	0.0417
Schistosoma mansoni	photoreceptor-specific nuclear receptor related	0.003	0.0287	0.0412
Trichomonas vaginalis	conserved hypothetical protein	0.0167	0.3039	0.3026
Loa Loa (eye worm)	PHD-finger family protein	0.0065	0.0986	0.1127
Schistosoma mansoni	jumonji/arid domain-containing protein	0.0078	0.1261	0.1807
Schistosoma mansoni	hypothetical protein	0.0033	0.0342	0.049
Schistosoma mansoni	RAR-like nuclear receptor	0.003	0.0287	0.0412
Leishmania major	DNA polymerase delta catalytic subunit, putative	0.0092	0.1536	0.369
Echinococcus multilocularis	PHD finger protein rhinoceros	0.0065	0.0986	0.1412
Trypanosoma cruzi	DNA polymerase delta catalytic subunit, putative	0.0075	0.1196	0.2775
Schistosoma mansoni	family S12 unassigned peptidase (S12 family)	0.0035	0.0379	0.0544
Schistosoma mansoni	histone-lysine n-methyltransferase setb1	0.0065	0.0979	0.1403
Echinococcus granulosus	Transcription factor JmjC domain containing protein	0.0212	0.3961	0.5676
Echinococcus multilocularis	Transcription factor, JmjC domain containing protein	0.0212	0.3961	0.5676
Brugia malayi	beta-lactamase	0.0035	0.0379	0.0434
Brugia malayi	Nuclear hormone receptor family member nhr-41	0.003	0.0287	0.0329
Toxoplasma gondii	DNA polymerase	0.0092	0.1536	1
Brugia malayi	AF-10 protein	0.0021	0.0105	0.0121
Schistosoma mansoni	FTZ-F1 nuclear receptor-like protein	0.003	0.0287	0.0412
Schistosoma mansoni	jumonji/arid domain-containing protein	0.0078	0.1261	0.1807
Trypanosoma brucei	DNA polymerase zeta catalytic subunit, putative	0.003	0.0291	0.133
Loa Loa (eye worm)	hypothetical protein	0.0021	0.0105	0.0121
Brugia malayi	nuclear hormone receptor	0.003	0.0287	0.0329
Echinococcus multilocularis	DNA polymerase alpha catalytic subunit	0.003	0.0291	0.0417
Echinococcus granulosus	long chain fatty acid transport protein 4	0.0217	0.4048	0.5801
Loa Loa (eye worm)	hypothetical protein	0.0035	0.0379	0.0434
Echinococcus granulosus	DNA polymerase alpha catalytic subunit	0.003	0.0291	0.0417
Schistosoma mansoni	steroid hormone receptor ad4bp	0.003	0.0287	0.0412
Brugia malayi	Calcitonin receptor-like protein seb-1	0.0048	0.0649	0.0742
Schistosoma mansoni	aldehyde dehydrogenase	0.0064	0.0969	0.1388
Schistosoma mansoni	thyroid hormone receptor	0.003	0.0287	0.0412
Brugia malayi	PHD-finger family protein	0.0021	0.0105	0.0121
Loa Loa (eye worm)	hypothetical protein	0.003	0.0287	0.0329
Loa Loa (eye worm)	jmjC domain-containing protein	0.0021	0.01	0.0114
Trypanosoma cruzi	DNA polymerase epsilon catalytic subunit, putative	0.003	0.0291	0.0484
Brugia malayi	Bromodomain containing protein	0.0065	0.0986	0.1127
Loa Loa (eye worm)	hypothetical protein	0.003	0.0287	0.0329
Loa Loa (eye worm)	heterochromatin protein 1	0.0073	0.1159	0.1325
Echinococcus multilocularis	peregrin	0.0065	0.0986	0.1412
Brugia malayi	jmjC domain containing protein	0.0078	0.1261	0.1441
Plasmodium vivax	DNA polymerase delta catalytic subunit, putative	0.0092	0.1536	1
Treponema pallidum	fructose-bisphosphate aldolase	0.0296	0.5643	0.5
Trypanosoma cruzi	fatty acid transporter protein-like, putative	0.0217	0.4048	1
Loa Loa (eye worm)	hypothetical protein	0.0035	0.0379	0.0434
Brugia malayi	Ligand-binding domain of nuclear hormone receptor family protein	0.003	0.0287	0.0329
Loa Loa (eye worm)	pigment dispersing factor receptor c	0.0048	0.0649	0.0742
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0046	0.0612	0.0876
Echinococcus granulosus	COUP TF:Svp nuclear hormone receptor	0.003	0.0287	0.0412
Leishmania major	DNA polymerase I alpha catalytic subunit, putative	0.003	0.0291	0.0491
Brugia malayi	beta-lactamase family protein	0.0035	0.0379	0.0434
Echinococcus granulosus	JmjC domain containing protein 4	0.0021	0.01	0.0143
Echinococcus multilocularis	aldehyde dehydrogenase, mitochondrial	0.0064	0.0969	0.1388
Brugia malayi	Voltage-gated calcium channel, T-type, alpha subunit. C. elegans cca-1 ortholog	0.0171	0.3134	0.3582
Brugia malayi	ecdysteroid receptor	0.003	0.0287	0.0329
Brugia malayi	Nuclear hormone receptor family member nhr-19	0.003	0.0287	0.0329
Brugia malayi	nuclear receptor NHR-88	0.003	0.0287	0.0329
Echinococcus granulosus	lamin	0.0026	0.0203	0.0292
Plasmodium vivax	SET domain protein, putative	0.0065	0.0979	0.612
Echinococcus multilocularis	Basic leucine zipper (bZIP) transcription	0.0035	0.0379	0.0543
Mycobacterium leprae	conserved hypothetical protein	0.0035	0.0379	0.0156
Toxoplasma gondii	WD domain, G-beta repeat-containing protein	0.0021	0.0105	0.0037
Onchocerca volvulus	Heterochromatin protein 1 homolog	0.0041	0.0508	0.0311
Brugia malayi	Ligand-binding domain of nuclear hormone receptor family protein	0.003	0.0287	0.0329
Schistosoma mansoni	mixed-lineage leukemia protein mll	0.0024	0.0153	0.022
Echinococcus granulosus	hepatocyte nuclear factor 4 alpha	0.003	0.0287	0.0412
Onchocerca volvulus	DNA polymerase alpha catalytic subunit homolog	0.003	0.0291	0.009
Trypanosoma cruzi	myo-inositol-1(or 4)-monophosphatase 1, putative	0.0036	0.0398	0.0754
Onchocerca volvulus		0.0035	0.0379	0.018
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0046	0.0612	0.0876
Schistosoma mansoni	inositol monophosphatase	0.0036	0.0398	0.057
Plasmodium vivax	DNA polymerase zeta catalytic subunit, putative	0.003	0.0291	0.133
Trichomonas vaginalis	D-aminoacylase, putative	0.0035	0.0379	0.0362
Loa Loa (eye worm)	hypothetical protein	0.0035	0.0379	0.0434
Echinococcus multilocularis	hepatocyte nuclear factor 4 alpha	0.003	0.0287	0.0412
Schistosoma mansoni	lamin	0.0026	0.0203	0.0292
Loa Loa (eye worm)	pre-SET domain-containing protein family protein	0.045	0.8747	1
Schistosoma mansoni	DNA polymerase epsilon catalytic subunit	0.003	0.0291	0.0417
Brugia malayi	Nuclear hormone receptor family member nhr-25	0.003	0.0287	0.0329
Trichomonas vaginalis	set domain proteins, putative	0.0512	1	1
Brugia malayi	Heterochromatin protein 1	0.0073	0.1159	0.1325
Trichomonas vaginalis	chromobox protein, putative	0.0073	0.1159	0.1142
Brugia malayi	Nuclear hormone receptor family member nhr-31	0.003	0.0287	0.0329
Echinococcus granulosus	chromobox protein 1	0.0073	0.1159	0.1661
Onchocerca volvulus	DNA polymerase delta catalytic subunit homolog	0.0092	0.1536	0.136
Mycobacterium tuberculosis	Possible conserved lipoprotein LpqK	0.0035	0.0379	0.0149
Echinococcus granulosus	phd:f box containing protein	0.0021	0.01	0.0143
Echinococcus granulosus	ecdysone induced protein 78C	0.003	0.0287	0.0412
Loa Loa (eye worm)	AMP-binding enzyme family protein	0.0224	0.419	0.479
Brugia malayi	GTP-binding regulatory protein Gs alpha-S chain, putative	0.0046	0.0612	0.0699
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.0296	0.5643	0.5635
Trypanosoma brucei	inositol-1(or 4)-monophosphatase 1, putative	0.0036	0.0398	0.2072
Echinococcus multilocularis	inositol monophosphatase 1	0.0036	0.0398	0.057
Leishmania major	hypothetical protein, conserved	0.0035	0.0379	0.0718
Schistosoma mansoni	retinoid-x-receptor (RXR)	0.003	0.0287	0.0412
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-31	0.003	0.0287	0.0329
Echinococcus granulosus	lysine specific demethylase 5A	0.0078	0.1261	0.1807
Brugia malayi	DNA polymerase family B, exonuclease domain containing protein	0.003	0.0291	0.0333
Loa Loa (eye worm)	hypothetical protein	0.003	0.0287	0.0329
Trichomonas vaginalis	penicillin-binding protein, putative	0.0035	0.0379	0.0362
Loa Loa (eye worm)	hypothetical protein	0.0017	0.0018	0.0021
Brugia malayi	intermediate filament protein	0.0026	0.0203	0.0233
Echinococcus granulosus	PHD finger protein rhinoceros	0.0065	0.0986	0.1412
Schistosoma mansoni	hypothetical protein	0.0021	0.0105	0.0151
Onchocerca volvulus		0.0077	0.1221	0.1039
Brugia malayi	latrophilin 2 splice variant baaae	0.0033	0.0342	0.0391
Trichomonas vaginalis	DNA polymerase alpha catalytic subunit, putative	0.003	0.0291	0.0273
Echinococcus multilocularis	histone lysine N methyltransferase SETMAR	0.0065	0.0979	0.1403
Loa Loa (eye worm)	GTP-binding regulatory protein Gs alpha-S chain	0.0046	0.0612	0.0699
Trichomonas vaginalis	DNA polymerase II, putative	0.003	0.0291	0.0273
Trichomonas vaginalis	esterase, putative	0.0035	0.0379	0.0362
Brugia malayi	Nuclear hormone receptor family member nhr-3	0.003	0.0287	0.0329
Loa Loa (eye worm)	hypothetical protein	0.0111	0.192	0.2195
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.0296	0.5643	0.5635
Onchocerca volvulus		0.0032	0.0329	0.0128
Echinococcus granulosus	chromobox protein 1	0.0073	0.1159	0.1661
Echinococcus granulosus	DNA polymerase zeta catalytic subunit	0.003	0.0291	0.0417
Mycobacterium tuberculosis	Probable esterase LipL	0.0035	0.0379	0.0149
Loa Loa (eye worm)	glutaminase	0.032	0.6129	0.7007
Plasmodium vivax	hypothetical protein, conserved	0.0065	0.0986	0.6167
Schistosoma mansoni	glutaminase	0.032	0.6129	0.8783
Onchocerca volvulus	Bile acid receptor homolog	0.003	0.0287	0.0086
Leishmania major	fatty acid transporter protein-like protein	0.0214	0.3991	1
Echinococcus granulosus	nuclear receptor 2DBD gamma	0.003	0.0287	0.0412
Mycobacterium tuberculosis	Probable fatty-acid-CoA ligase FadD6 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase)	0.0214	0.3991	0.9561
Trypanosoma cruzi	hypothetical protein, conserved	0.0035	0.0379	0.0708
Brugia malayi	Pre-SET motif family protein	0.0065	0.0979	0.1119
Trichomonas vaginalis	chromobox protein, putative	0.0073	0.1159	0.1142
Echinococcus granulosus	histone lysine methyltransferase setb	0.0065	0.0979	0.1403
Entamoeba histolytica	DNA polymerase delta catalytic subunit, putative	0.0092	0.1536	0.2198
Echinococcus multilocularis	DNA polymerase zeta catalytic subunit	0.003	0.0291	0.0417
Brugia malayi	steroid hormone receptor	0.003	0.0287	0.0329
Echinococcus granulosus	Jumonji AT rich interactive domain 1B	0.0021	0.01	0.0143
Onchocerca volvulus		0.0035	0.0379	0.018
Loa Loa (eye worm)	jmjC domain-containing protein	0.0134	0.2378	0.2719
Schistosoma mansoni	retinoic acid receptor RXR	0.003	0.0287	0.0412
Schistosoma mansoni	inositol monophosphatase	0.0036	0.0398	0.057
Onchocerca volvulus	Protein ultraspiracle homolog	0.003	0.0287	0.0086
Toxoplasma gondii	aldehyde dehydrogenase	0.0064	0.0969	0.6048
Loa Loa (eye worm)	hypothetical protein	0.0033	0.0342	0.0391
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.0296	0.5643	0.5635
Brugia malayi	Inositol-1	0.0036	0.0398	0.0455
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0046	0.0612	0.0876
Plasmodium falciparum	DNA polymerase delta catalytic subunit	0.0092	0.1536	1
Trichomonas vaginalis	DNA polymerase delta catalytic subunit, putative	0.003	0.0291	0.0273
Toxoplasma gondii	inositol(myo)-1(or 4)-monophosphatase 2, putative	0.0036	0.0398	0.2072
Echinococcus multilocularis	musashi	0.0026	0.0203	0.0292
Echinococcus granulosus	FTZ F1 alpha	0.003	0.0287	0.0412
Toxoplasma gondii	DNA polymerase (pol2) superfamily protein	0.003	0.0291	0.133
Mycobacterium ulcerans	glutaminase	0.032	0.6129	1
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0046	0.0612	0.0876
Schistosoma mansoni	histone-lysine n-methyltransferase setb1	0.0065	0.0979	0.1403
Loa Loa (eye worm)	hypothetical protein	0.0035	0.0379	0.0434
Trichomonas vaginalis	glutaminase, putative	0.032	0.6129	0.6122
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-1	0.003	0.0287	0.0329
Echinococcus multilocularis	JmjC domain containing protein 4	0.0021	0.01	0.0143
Echinococcus multilocularis	lamin dm0	0.0026	0.0203	0.0292
Mycobacterium tuberculosis	Conserved protein	0.0035	0.0379	0.0149
Brugia malayi	Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative	0.0035	0.0379	0.0434
Echinococcus multilocularis	COUP TF:Svp nuclear hormone receptor	0.003	0.0287	0.0412
Schistosoma mansoni	jumonji domain containing protein	0.0021	0.01	0.0143
Echinococcus granulosus	DNA polymerase delta catalytic subunit	0.0092	0.1536	0.2201
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-40	0.003	0.0287	0.0329
Loa Loa (eye worm)	hypothetical protein	0.0041	0.0508	0.0581
Trypanosoma brucei	DNA polymerase epsilon catalytic subunit, putative	0.003	0.0291	0.133
Giardia lamblia	DNA polymerase delta, catalytic subunit	0.0092	0.1536	0.2326
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.0296	0.5643	0.5635
Brugia malayi	Nuclear hormone receptor family member nhr-19	0.003	0.0287	0.0329
Schistosoma mansoni	thyroid hormone receptor	0.003	0.0287	0.0412
Mycobacterium ulcerans	aldehyde dehydrogenase	0.0064	0.0969	0.1025
Echinococcus granulosus	lamin dm0	0.0026	0.0203	0.0292
Brugia malayi	Nuclear hormone receptor family member nhr-40	0.003	0.0287	0.0329
Loa Loa (eye worm)	hypothetical protein	0.0035	0.0379	0.0434
Schistosoma mansoni	hypothetical protein	0.0362	0.6978	1
Trypanosoma cruzi	DNA polymerase delta catalytic subunit, putative	0.0092	0.1536	0.3637
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0046	0.0612	0.0876
Entamoeba histolytica	myo-inositol monophosphatase, putative	0.0036	0.0398	0.0035
Loa Loa (eye worm)	hypothetical protein	0.0032	0.0329	0.0376
Echinococcus multilocularis	lamin	0.0026	0.0203	0.0292
Plasmodium falciparum	phd finger protein, putative	0.0065	0.0986	0.6374
Trypanosoma brucei	PHD-zinc-finger like domain containing protein, putative	0.0021	0.0105	0.0037
Leishmania major	myo-inositol-1(or 4)-monophosphatase 1, putative	0.0036	0.0398	0.0765
Mycobacterium tuberculosis	Possible penicillin-binding protein	0.0222	0.4159	1
Schistosoma mansoni	nuclear receptor 2DBD-gamma	0.003	0.0287	0.0412
Echinococcus multilocularis	geminin	0.0362	0.6978	1
Loa Loa (eye worm)	jmjC domain-containing protein	0.0021	0.01	0.0114
Echinococcus multilocularis	histone lysine methyltransferase setb histone lysine methyltransferase eggless	0.0065	0.0979	0.1403
Echinococcus multilocularis	chromobox protein 1	0.0073	0.1159	0.1661
Trichomonas vaginalis	conserved hypothetical protein	0.0029	0.0266	0.0248
Loa Loa (eye worm)	hypothetical protein	0.0026	0.0194	0.0222
Loa Loa (eye worm)	DNA-directed DNA polymerase III	0.0092	0.1536	0.1756
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.0296	0.5643	0.5635
Echinococcus granulosus	beta LACTamase domain containing family member	0.0035	0.0379	0.0544
Brugia malayi	Nuclear hormone receptor family member nhr-49	0.003	0.0287	0.0329
Mycobacterium tuberculosis	Conserved protein	0.0035	0.0379	0.0149
Echinococcus multilocularis	nuclear receptor 2DBD gamma	0.003	0.0287	0.0412
Brugia malayi	chromobox protein homolog 3	0.0041	0.0508	0.0581
Schistosoma mansoni	phosphatidylserine receptor	0.0021	0.01	0.0143
Brugia malayi	Nuclear hormone receptor family member nhr-1	0.003	0.0287	0.0329
Echinococcus granulosus	jumonji domain containing protein	0.009	0.1498	0.2146
Loa Loa (eye worm)	hypothetical protein	0.003	0.0287	0.0329
Loa Loa (eye worm)	DNA polymerase epsilon catalytic subunit	0.0017	0.0018	0.0021
Onchocerca volvulus		0.0035	0.0379	0.018
Brugia malayi	DNA polymerase delta catalytic subunit	0.0092	0.1536	0.1756
Echinococcus multilocularis	chromobox protein 1	0.0073	0.1159	0.1661
Echinococcus multilocularis	Nuclear hormone receptor family member nhr 41	0.003	0.0287	0.0412
Schistosoma mansoni	histone-lysine n-methyltransferase suv9	0.0077	0.1221	0.175

Activities

Activity type	Activity value	Assay description	Source	Reference
IC50 (functional)	= 200 nM	Antiviral activity against HCMV Davis in HFF cells by plaque reduction assay	ChEMBL.	17434304
IC50 (binding)	= 220 nM	Inhibition of HCMV DNA polymerase by scintillation proximity assay	ChEMBL.	17434304
IC50 (binding)	= 220 nM	Inhibition of HCMV DNA polymerase by scintillation proximity assay	ChEMBL.	17434304

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: CHEMBL246523

Bibliographic References

1 literature reference was collected for this gene.

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Detailed information for compound 457056