TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 484.581 | Formula: C28H36O7
H donors: 2 H acceptors: 4 LogP: 6.41 Rotable bonds: 10
Rule of 5 violations (Lipinski): 1
SMILES: CCCc1c(OCCCOc2c(C)c(C)c3c(c2C)CCC(O3)(C)C(=O)O)ccc(c1O)C(=O)C
InChi: 1S/C28H36O7/c1-7-9-22-23(11-10-21(19(5)29)24(22)30)33-14-8-15-34-25-16(2)17(3)26-20(18(25)4)12-13-28(6,35-26)27(31)32/h10-11,30H,7-9,12-15H2,1-6H3,(H,31,32)
InChiKey: GYAVXQLBLZJDGC-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

No curated genes were found associated with this compound

Predicted pathogen targets for this compound

By orthology

No druggable targets predicted by orthology data

By sequence similarity to non orthologous known druggable targets

No druggable targets predicted by sequence similarity

Ranking Plot

Putative Targets List

Species	Potential target	Raw	Global	Species
Loa Loa (eye worm)	hypothetical protein	0.0036	0.0638	0.1164
Loa Loa (eye worm)	hypothetical protein	0.0043	0.0779	0.1427
Trypanosoma cruzi	apurinic/apyrimidinic endonuclease, putative	0.0023	0.0354	0.2327
Echinococcus granulosus	histone lysine N methyltransferase MLL3	0.0009	0.0065	0.0048
Giardia lamblia	Sgs1 DNA helicase, putative	0.0034	0.0597	0.0839
Loa Loa (eye worm)	hypothetical protein	0.0019	0.0285	0.0502
Trichomonas vaginalis	chromodomain helicase DNA binding protein, putative	0.0008	0.005	0.00000000041307
Wolbachia endosymbiont of Brugia malayi	exonuclease III	0.0023	0.0354	0.5
Brugia malayi	Nuclear hormone receptor family member nhr-41	0.0036	0.0638	0.1164
Brugia malayi	Nuclear hormone receptor family member nhr-40	0.0036	0.0638	0.1164
Plasmodium falciparum	ATP-dependent DNA helicase Q1	0.0034	0.0597	0.698
Onchocerca volvulus	Protein ultraspiracle homolog	0.0036	0.0638	0.0775
Brugia malayi	exodeoxyribonuclease III family protein	0.0023	0.0354	0.0631
Giardia lamblia	Histone acetyltransferase GCN5	0.0047	0.0855	0.1202
Giardia lamblia	Endonuclease/Exonuclease/phosphatase	0.0023	0.0354	0.0497
Trichomonas vaginalis	ap endonuclease, putative	0.0023	0.0354	0.043
Trichomonas vaginalis	DNA polymerase eta, putative	0.0049	0.0904	0.1209
Schistosoma mansoni	hypothetical protein	0.049	1	1
Schistosoma mansoni	RAR-like nuclear receptor	0.0036	0.0638	0.0638
Mycobacterium tuberculosis	Probable hydrolase	0.0043	0.0779	0.1316
Schistosoma mansoni	bromodomain containing protein	0.0006	0.0017	0.0017
Echinococcus multilocularis	nuclear receptor subfamily 4 group A	0.0017	0.0242	0.0226
Brugia malayi	Nuclear hormone receptor E75	0.0017	0.0242	0.0422
Echinococcus granulosus	Nuclear hormone receptor HR96	0.0017	0.0242	0.0226
Brugia malayi	Nuclear hormone receptor family member nhr-25	0.0036	0.0638	0.1164
Echinococcus multilocularis	hepatocyte nuclear factor 4 alpha	0.0036	0.0638	0.0622
Brugia malayi	photoreceptor-specific nuclear receptor	0.0036	0.0638	0.1164
Plasmodium vivax	AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative	0.0023	0.0354	0.3754
Entamoeba histolytica	deoxycytidyl transferase, putative	0.0017	0.0247	0.0016
Trypanosoma cruzi	DNA polymerase kappa, putative	0.0049	0.0904	0.5945
Trypanosoma brucei	DNA polymerase kappa, putative	0.0049	0.0904	0.5945
Echinococcus granulosus	terminal deoxycytidyl transferase rev1	0.0017	0.0247	0.023
Loa Loa (eye worm)	hypothetical protein	0.0043	0.0779	0.1427
Echinococcus granulosus	nuclear receptor subfamily 1 group D	0.0019	0.0285	0.0268
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-41	0.0036	0.0638	0.1164
Brugia malayi	orphan nuclear receptor NR2E1	0.0017	0.0242	0.0422
Loa Loa (eye worm)	hypothetical protein	0.0037	0.0657	0.1199
Echinococcus granulosus	retinoic acid receptor rxr beta a	0.0036	0.0638	0.0622
Mycobacterium tuberculosis	Possible penicillin-binding protein	0.0276	0.5575	1
Giardia lamblia	DINP protein human, muc B family	0.0025	0.041	0.0576
Echinococcus multilocularis	Nuclear hormone receptor HR96	0.0017	0.0242	0.0226
Echinococcus granulosus	histone acetyltransferase KAT2B	0.0169	0.3371	0.336
Schistosoma mansoni	FTZ-F1 nuclear receptor-like protein	0.0036	0.0638	0.0638
Echinococcus granulosus	COUP TF:Svp nuclear hormone receptor	0.0036	0.0638	0.0622
Schistosoma mansoni	nuclear hormone receptor nor-1/nor-2	0.0036	0.0638	0.0638
Echinococcus multilocularis	histone lysine N methyltransferase MLL3	0.0009	0.0065	0.0048
Trypanosoma brucei	unspecified product	0.0012	0.0136	0.0892
Brugia malayi	conserved hypotetical protein	0.0017	0.0242	0.0422
Brugia malayi	ATP-dependent DNA helicase, RecQ family protein	0.0034	0.0597	0.1086
Loa Loa (eye worm)	RecQ helicase	0.0049	0.0906	0.1666
Schistosoma mansoni	gcn5proteinral control of amino-acid synthesis 5-like 2 gcnl2	0.0174	0.3472	0.3472
Brugia malayi	polk-prov protein	0.0037	0.0657	0.1199
Loa Loa (eye worm)	hypothetical protein	0.0017	0.0242	0.0422
Schistosoma mansoni	rab geranylgeranyl transferase alpha subunit	0.0017	0.0247	0.0247
Schistosoma mansoni	thyroid hormone receptor	0.0187	0.375	0.375
Onchocerca volvulus		0.0034	0.0599	0.0697
Echinococcus multilocularis	mixed lineage leukemia protein mll	0.0009	0.0065	0.0048
Echinococcus granulosus	vesicular acetylcholine transporter	0.0265	0.5354	0.5346
Loa Loa (eye worm)	transcription factor SMAD2	0.0117	0.2303	0.4282
Schistosoma mansoni	blooms syndrome DNA helicase	0.0032	0.0546	0.0546
Entamoeba histolytica	exodeoxyribonuclease III, putative	0.0023	0.0354	0.0171
Echinococcus granulosus	mixed lineage leukemia protein mll	0.0009	0.0065	0.0048
Trichomonas vaginalis	penicillin-binding protein, putative	0.0043	0.0779	0.1032
Schistosoma mansoni	hepatocyte nuclear factor 4-alpha (hnf-4-alpha)	0.0017	0.0242	0.0242
Trypanosoma brucei	tyrosyl-DNA Phosphodiesterase (Tdp1), putative	0.0079	0.1521	1
Echinococcus granulosus	thyroid hormone receptor alpha	0.0017	0.0242	0.0226
Loa Loa (eye worm)	hypothetical protein	0.0017	0.0242	0.0422
Treponema pallidum	fructose-bisphosphate aldolase	0.035	0.7114	1
Mycobacterium ulcerans	beta-lactamase	0.0043	0.0779	0.2279
Loa Loa (eye worm)	DR-78	0.0017	0.0242	0.0422
Mycobacterium tuberculosis	Probable conserved lipoprotein	0.0043	0.0779	0.1316
Trichomonas vaginalis	bromodomain-containing protein, putative	0.0051	0.0943	0.1264
Schistosoma mansoni	retinoid-x-receptor (RXR)	0.0019	0.0285	0.0285
Loa Loa (eye worm)	MH2 domain-containing protein	0.0117	0.2303	0.4282
Echinococcus granulosus	nuclear receptor subfamily 4 group A	0.0017	0.0242	0.0226
Echinococcus granulosus	ATP dependent DNA helicase Q5	0.0034	0.0597	0.058
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.035	0.7114	1
Echinococcus multilocularis	dna polymerase kappa	0.0049	0.0904	0.0888
Brugia malayi	nuclear receptor RXR	0.0017	0.0242	0.0422
Loa Loa (eye worm)	hypothetical protein	0.0019	0.0285	0.0502
Schistosoma mansoni	nuclear hormone receptor superfamily protein-related	0.0017	0.0242	0.0242
Plasmodium vivax	histone acetyltransferase GCN5, putative	0.0051	0.0943	1
Brugia malayi	steroid hormone receptor	0.0036	0.0638	0.1164
Brugia malayi	ImpB/MucB/SamB family protein	0.0017	0.0247	0.043
Schistosoma mansoni	nuclear receptor	0.0017	0.0242	0.0242
Echinococcus multilocularis	TGF beta signal transducer SmadC	0.0008	0.0053	0.0036
Schistosoma mansoni	TGF-beta signal transducer Smad2	0.0008	0.0053	0.0053
Brugia malayi	tailless protein	0.0017	0.0242	0.0422
Loa Loa (eye worm)	hypothetical protein	0.0017	0.0242	0.0422
Echinococcus multilocularis	DNA (apurinic or apyrimidinic site) lyase	0.0023	0.0354	0.0337
Treponema pallidum	exodeoxyribonuclease (exoA)	0.0023	0.0354	0.0152
Loa Loa (eye worm)	hypothetical protein	0.0017	0.0242	0.0422
Mycobacterium tuberculosis	Probable fructose-bisphosphate aldolase Fba	0.0171	0.3418	0.6095
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.035	0.7114	1
Schistosoma mansoni	Tr4/Tr2 (homologue)	0.0036	0.0638	0.0638
Schistosoma mansoni	smad	0.0008	0.0053	0.0053
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.035	0.7114	1
Schistosoma mansoni	coup transcription factor	0.0036	0.0638	0.0638
Loa Loa (eye worm)	nuclear hormone receptor	0.0017	0.0242	0.0422
Schistosoma mansoni	cpg binding protein	0.0036	0.0639	0.0639
Echinococcus multilocularis	nuclear receptor subfamily 1 group D	0.0019	0.0285	0.0268
Loa Loa (eye worm)	hypothetical protein	0.0036	0.0638	0.1164
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.035	0.7114	1
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.035	0.7114	1
Trichomonas vaginalis	DNA helicase recq, putative	0.0037	0.0661	0.0865
Echinococcus multilocularis	COUP TF:Svp nuclear hormone receptor	0.0036	0.0638	0.0622
Loa Loa (eye worm)	CXXC zinc finger family protein	0.0034	0.0599	0.109
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-31	0.0036	0.0638	0.1164
Trypanosoma brucei	DNA polymerase kappa, putative	0.002	0.0299	0.1965
Trypanosoma cruzi	DNA polymerase kappa, putative	0.0049	0.0904	0.5945
Mycobacterium ulcerans	DNA polymerase IV	0.0049	0.0904	0.2645
Loa Loa (eye worm)	hypothetical protein	0.0036	0.0638	0.1164
Brugia malayi	Ligand-binding domain of nuclear hormone receptor family protein	0.0036	0.0638	0.1164
Mycobacterium ulcerans	esterase/lipase LipP	0.0043	0.0779	0.2279
Echinococcus multilocularis	nuclear receptor 2DBD gamma	0.0036	0.0638	0.0622
Trypanosoma brucei	DNA polymerase kappa, putative	0.0049	0.0904	0.5945
Leishmania major	hypothetical protein, conserved	0.0043	0.0779	0.5122
Echinococcus multilocularis	vesicular acetylcholine transporter	0.0265	0.5354	0.5346
Echinococcus multilocularis	histone lysine N methyltransferase MLL3	0.0011	0.0109	0.0092
Brugia malayi	F/Y-rich N-terminus family protein	0.0011	0.0106	0.0166
Schistosoma mansoni	ap endonuclease	0.0023	0.0354	0.0354
Leishmania major	apurinic/apyrimidinic endonuclease-redox protein	0.0023	0.0354	0.2327
Toxoplasma gondii	ATP-dependent DNA helicase, RecQ family protein	0.0034	0.0597	0.4514
Entamoeba histolytica	recQ family DNA helicase	0.0017	0.025	0.002
Loa Loa (eye worm)	hypothetical protein	0.0043	0.0779	0.1427
Schistosoma mansoni	hypothetical protein	0.0151	0.3001	0.3001
Mycobacterium ulcerans	lipase LipD	0.0043	0.0779	0.2279
Trypanosoma brucei	ATP-dependent DEAD/H DNA helicase recQ, putative	0.0037	0.0661	0.4344
Brugia malayi	Nuclear hormone receptor family member nhr-1	0.0036	0.0638	0.1164
Trypanosoma brucei	DNA polymerase kappa, putative	0.0049	0.0904	0.5945
Trichomonas vaginalis	chromodomain-helicase-DNA-binding protein, putative	0.0008	0.005	0.00000000041307
Echinococcus multilocularis	Mitotic checkpoint protein PRCC, C terminal	0.0151	0.3001	0.2989
Trichomonas vaginalis	cat eye syndrome critical region protein 2, cscr2, putative	0.0051	0.0943	0.1264
Echinococcus granulosus	Nuclear hormone receptor family member nhr 41	0.0036	0.0638	0.0622
Brugia malayi	hypothetical protein	0.0019	0.0285	0.0502
Mycobacterium ulcerans	fusion of enoyl-CoA hydratase, EchA21 and lipase, LipE	0.0043	0.0779	0.2279
Brugia malayi	ATP-dependent DNA helicase, RecQ family protein	0.0034	0.0597	0.1086
Leishmania major	tyrosyl-DNA phosphodiesterase 1	0.0079	0.1521	1
Loa Loa (eye worm)	nuclear hormone receptor-like 1	0.0019	0.0285	0.0502
Onchocerca volvulus		0.0043	0.0779	0.1049
Echinococcus multilocularis	tyrosyl DNA phosphodiesterase 1	0.0079	0.1521	0.1506
Mycobacterium tuberculosis	Probable lipase LipE	0.0043	0.0779	0.1316
Trypanosoma brucei	DNA polymerase kappa, putative	0.002	0.0299	0.1965
Entamoeba histolytica	fructose-1,6-bisphosphate aldolase, putative	0.035	0.7114	1
Echinococcus granulosus	nuclear receptor 2DBD gamma	0.0036	0.0638	0.0622
Echinococcus multilocularis	dnaJ subfamily B	0.049	1	1
Plasmodium vivax	ATP-dependent DNA helicase Q1, putative	0.0017	0.0236	0.2503
Echinococcus multilocularis	transcription factor Dp 1	0.0046	0.0834	0.0818
Brugia malayi	CXXC zinc finger family protein	0.0034	0.0599	0.109
Mycobacterium tuberculosis	Conserved protein	0.0043	0.0779	0.1316
Echinococcus multilocularis	smad	0.0008	0.0053	0.0036
Trichomonas vaginalis	esterase, putative	0.0043	0.0779	0.1032
Schistosoma mansoni	nuclear hormone receptor	0.0017	0.0242	0.0242
Trichomonas vaginalis	chromodomain helicase DNA binding protein, putative	0.0008	0.005	0.00000000041307
Trypanosoma brucei	DNA polymerase kappa, putative	0.0037	0.0657	0.4322
Onchocerca volvulus	Steroid hormone receptor family member cnr14 homolog	0.0036	0.0638	0.0775
Plasmodium vivax	hypothetical protein, conserved	0.0043	0.0779	0.8264
Loa Loa (eye worm)	hypothetical protein	0.0036	0.0638	0.1164
Echinococcus multilocularis	ATP dependent DNA helicase Q5	0.0034	0.0597	0.058
Brugia malayi	beta-lactamase family protein	0.0043	0.0779	0.1427
Trypanosoma brucei	DNA polymerase kappa, putative	0.002	0.0299	0.1965
Echinococcus multilocularis	Smad4	0.0008	0.0053	0.0036
Schistosoma mansoni	Smad4	0.0008	0.0053	0.0053
Echinococcus granulosus	TGF beta signal transducer SmadC	0.0008	0.0053	0.0036
Schistosoma mansoni	family S12 unassigned peptidase (S12 family)	0.0043	0.0779	0.0779
Echinococcus granulosus	beta LACTamase domain containing family member	0.0043	0.0779	0.0763
Echinococcus multilocularis	nuclear receptor nhr 48	0.0017	0.0242	0.0226
Schistosoma mansoni	DNA polymerase eta	0.0017	0.0247	0.0247
Echinococcus multilocularis	nuclear receptor 2DBD gamma	0.0036	0.0638	0.0622
Mycobacterium tuberculosis	Possible conserved lipoprotein LpqK	0.0043	0.0779	0.1316
Brugia malayi	hypothetical protein	0.0019	0.0285	0.0502
Trypanosoma brucei	DNA polymerase kappa, putative	0.0037	0.0657	0.4322
Loa Loa (eye worm)	hypothetical protein	0.0017	0.0242	0.0422
Echinococcus granulosus	DNA apurinic or apyrimidinic site lyase	0.0023	0.0354	0.0337
Mycobacterium tuberculosis	Possible DNA-damage-inducible protein P DinP (DNA polymerase V) (pol IV 2) (DNA nucleotidyltransferase (DNA-directed))	0.0025	0.041	0.0648
Leishmania major	DNA polymerase kappa, putative,DNA polymerase IV, putative	0.0025	0.041	0.2695
Plasmodium falciparum	AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative	0.0023	0.0354	0.414
Trichomonas vaginalis	DNA helicase recq1, putative	0.0049	0.0906	0.1213
Plasmodium falciparum	histone acetyltransferase GCN5	0.0047	0.0855	1
Loa Loa (eye worm)	hypothetical protein	0.0036	0.0638	0.1164
Echinococcus multilocularis	mothers against decapentaplegic 5	0.0008	0.0053	0.0036
Echinococcus granulosus	Mitotic checkpoint protein PRCC C terminal	0.0151	0.3001	0.2989
Schistosoma mansoni	smad1 5 8 and	0.0008	0.0053	0.0053
Echinococcus multilocularis	FTZ F1 alpha	0.0036	0.0638	0.0622
Loa Loa (eye worm)	hypothetical protein	0.0017	0.0242	0.0422
Schistosoma mansoni	terminal deoxycytidyl transferase	0.0017	0.0247	0.0247
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.035	0.7114	1
Loa Loa (eye worm)	hypothetical protein	0.0019	0.0285	0.0502
Brugia malayi	MH1 domain containing protein	0.0008	0.0053	0.0068
Echinococcus granulosus	smad	0.0008	0.0053	0.0036
Brugia malayi	Nuclear hormone receptor family member nhr-25	0.0036	0.0638	0.1164
Echinococcus granulosus	FTZ F1 alpha	0.0036	0.0638	0.0622
Brugia malayi	ecdysone receptor	0.0017	0.0242	0.0422
Mycobacterium tuberculosis	Probable lipase LipD	0.0043	0.0779	0.1316
Toxoplasma gondii	histone lysine acetyltransferase GCN5-A	0.0051	0.0943	0.7131
Brugia malayi	acetyltransferase, GNAT family protein	0.0174	0.3472	0.6473
Schistosoma mansoni	photoreceptor-specific nuclear receptor related	0.0036	0.0638	0.0638
Loa Loa (eye worm)	nuclear receptor NHR-67	0.0017	0.0242	0.0422
Schistosoma mansoni	nuclear hormone receptor	0.0017	0.0242	0.0242
Toxoplasma gondii	BRCA1 C Terminus (BRCT) domain-containing protein	0.0013	0.0163	0.1234
Schistosoma mansoni	nuclear receptor 2DBD-gamma	0.0036	0.0638	0.0638
Trypanosoma brucei	apurinic/apyrimidinic endonuclease, putative	0.0023	0.0354	0.2327
Echinococcus multilocularis	cpg binding protein	0.0036	0.0639	0.0623
Echinococcus granulosus	histone acetyltransferase KAT2B	0.0051	0.0943	0.0927
Brugia malayi	Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative	0.0043	0.0779	0.1427
Schistosoma mansoni	tyrosyl-DNA phosphodiesterase	0.0079	0.1521	0.1521
Schistosoma mansoni	DNA helicase recq5	0.0034	0.0597	0.0597
Trypanosoma cruzi	ATP-dependent DEAD/H DNA helicase recQ, putative	0.0017	0.025	0.1642
Plasmodium falciparum	ADP-dependent DNA helicase RecQ	0.0046	0.0842	0.9854
Loa Loa (eye worm)	MH2 domain-containing protein	0.0008	0.0053	0.0068
Mycobacterium ulcerans	fructose-bisphosphate aldolase	0.0171	0.3418	1
Brugia malayi	MH2 domain containing protein	0.0117	0.2303	0.4282
Trypanosoma brucei	DNA polymerase kappa, putative	0.0049	0.0904	0.5945
Schistosoma mansoni	zinc finger protein	0.0006	0.0017	0.0017
Echinococcus multilocularis	Nuclear hormone receptor HR96	0.0017	0.0242	0.0226
Mycobacterium tuberculosis	Probable esterase LipL	0.0043	0.0779	0.1316
Schistosoma mansoni	smad1 5 8 and	0.0008	0.0053	0.0053
Brugia malayi	nuclear hormone receptor family member odr-7	0.0017	0.0242	0.0422
Echinococcus granulosus	histone lysine N methyltransferase MLL3	0.0011	0.0109	0.0092
Loa Loa (eye worm)	nuclear receptor nhr-7B	0.0017	0.0242	0.0422
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-49	0.0036	0.0638	0.1164
Schistosoma mansoni	nuclear receptor nhr-48	0.0017	0.0242	0.0242
Trypanosoma brucei	unspecified product	0.0012	0.0136	0.0892
Loa Loa (eye worm)	acetyltransferase	0.0174	0.3472	0.6473
Giardia lamblia	Fructose-bisphosphate aldolase	0.035	0.7114	1
Mycobacterium ulcerans	exodeoxyribonuclease III protein XthA	0.0023	0.0354	0.1035
Trypanosoma brucei	DNA polymerase eta, putative	0.0017	0.0247	0.1623
Loa Loa (eye worm)	hypothetical protein	0.0036	0.0638	0.1164
Loa Loa (eye worm)	nuclear Hormone Receptor family member	0.0036	0.0638	0.1164
Trypanosoma brucei	DNA polymerase IV, putative	0.0049	0.0904	0.5945
Trypanosoma cruzi	DNA polymerase eta, putative	0.0017	0.0247	0.1623
Echinococcus granulosus	transcription factor Dp 1	0.0046	0.0834	0.0818
Brugia malayi	Nuclear hormone receptor family member nhr-49	0.0036	0.0638	0.1164
Brugia malayi	Smad1	0.0008	0.0053	0.0068
Schistosoma mansoni	retinoid-x-receptor (RXR)	0.0036	0.0638	0.0638
Schistosoma mansoni	thyroid hormone receptor	0.0187	0.375	0.375
Brugia malayi	hypothetical protein	0.0017	0.0242	0.0422
Brugia malayi	beta-lactamase	0.0043	0.0779	0.1427
Mycobacterium tuberculosis	Conserved protein	0.0043	0.0779	0.1316
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.035	0.7114	1
Schistosoma mansoni	smad1 5 8 and	0.0008	0.0053	0.0053
Trypanosoma cruzi	tyrosyl-DNA Phosphodiesterase (Tdp1), putative	0.0079	0.1521	1
Echinococcus multilocularis	FTZ F1 nuclear receptor protein	0.0036	0.0638	0.0622
Loa Loa (eye worm)	steroid hormone receptor	0.0036	0.0638	0.1164
Trichomonas vaginalis	DNA helicase recq, putative	0.0049	0.0906	0.1213
Brugia malayi	Nuclear hormone receptor-like 1	0.0036	0.0638	0.1164
Loa Loa (eye worm)	vesicular acetylcholine transporter unc-17	0.0265	0.5354	1
Onchocerca volvulus		0.0043	0.0779	0.1049
Trichomonas vaginalis	chromodomain helicase DNA binding protein, putative	0.0008	0.005	0.00000000041307
Loa Loa (eye worm)	hypothetical protein	0.0036	0.0638	0.1164
Brugia malayi	Steroid receptor seven-up type 2	0.0036	0.0638	0.1164
Echinococcus granulosus	Nuclear hormone receptor HR96	0.0017	0.0242	0.0226
Schistosoma mansoni	cpg binding protein	0.0036	0.0639	0.0639
Brugia malayi	MH1 domain containing protein	0.0008	0.0053	0.0068
Brugia malayi	Nuclear hormone receptor family member nhr-19	0.0036	0.0638	0.1164
Loa Loa (eye worm)	hypothetical protein	0.0036	0.0638	0.1164
Trypanosoma brucei	DNA polymerase IV, putative	0.0041	0.0741	0.4873
Brugia malayi	nuclear receptor subfamily 1, group D, member 1, putative	0.0017	0.0242	0.0422
Brugia malayi	vesicular acetylcholine transporter unc-17	0.0265	0.5354	1
Onchocerca volvulus	Vesicular acetylcholine transporter homolog	0.0265	0.5354	1
Loa Loa (eye worm)	ATP-dependent DNA helicase	0.0034	0.0597	0.1086
Schistosoma mansoni	nuclear hormone receptor	0.0036	0.0638	0.0638
Toxoplasma gondii	ABC1 family protein	0.0043	0.0779	0.5894
Brugia malayi	MH2 domain containing protein	0.0008	0.0053	0.0068
Loa Loa (eye worm)	histone methyltransferase	0.0011	0.0109	0.0171
Loa Loa (eye worm)	hypothetical protein	0.0017	0.0242	0.0422
Trichomonas vaginalis	chromodomain helicase DNA binding protein, putative	0.0008	0.005	0.00000000041307
Brugia malayi	nuclear hormone receptor family member nhr-6	0.0017	0.0242	0.0422
Brugia malayi	Nuclear hormone receptor-like 1	0.0019	0.0285	0.0502
Trypanosoma brucei	DNA polymerase kappa, putative	0.0049	0.0904	0.5945
Entamoeba histolytica	recQ family helicase, putative	0.0037	0.0661	0.0618
Echinococcus granulosus	tyrosyl DNA phosphodiesterase 1	0.0079	0.1521	0.1506
Loa Loa (eye worm)	MH1 domain-containing protein	0.0008	0.0053	0.0068
Brugia malayi	Nuclear hormone receptor family member nhr-31	0.0036	0.0638	0.1164
Loa Loa (eye worm)	tyrosyl-DNA phosphodiesterase	0.0079	0.1521	0.2817
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-14	0.0036	0.0638	0.1164
Schistosoma mansoni	ap endonuclease	0.0023	0.0354	0.0354
Loa Loa (eye worm)	hypothetical protein	0.0017	0.0242	0.0422
Leishmania major	ATP-dependent DEAD/H DNA helicase recQ, putative	0.0037	0.0661	0.4344
Toxoplasma gondii	histone lysine acetyltransferase GCN5-B	0.0051	0.0943	0.7131
Echinococcus multilocularis	beta LACTamase domain containing family member	0.0043	0.0779	0.0763
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-40	0.0036	0.0638	0.1164
Entamoeba histolytica	acetyltransferase, GNAT family	0.0047	0.0855	0.09
Schistosoma mansoni	steroid hormone receptor ad4bp	0.0036	0.0638	0.0638
Echinococcus multilocularis	Nuclear hormone receptor family member nhr 41	0.0036	0.0638	0.0622
Loa Loa (eye worm)	hypothetical protein	0.0017	0.0242	0.0422
Brugia malayi	Nuclear hormone receptor family member nhr-3	0.0036	0.0638	0.1164
Brugia malayi	Nuclear hormone receptor family member nhr-14	0.0036	0.0638	0.1164
Trypanosoma brucei	DNA polymerase kappa, putative	0.0049	0.0904	0.5945
Schistosoma mansoni	bromodomain containing protein	0.0006	0.0017	0.0017
Trichomonas vaginalis	D-aminoacylase, putative	0.0043	0.0779	0.1032
Trypanosoma cruzi	hypothetical protein, conserved	0.0043	0.0779	0.5122
Brugia malayi	Nuclear hormone receptor-like 1	0.0019	0.0285	0.0502
Echinococcus multilocularis	retinoic acid receptor rxr beta a retinoic acid receptor rxr alpha a retinoic acid receptor rxr alpha	0.0017	0.0242	0.0226
Echinococcus granulosus	FTZ F1 nuclear receptor protein	0.0036	0.0638	0.0622
Trypanosoma brucei	DNA polymerase kappa, putative	0.0049	0.0904	0.5945
Brugia malayi	nuclear receptor RXR	0.0019	0.0285	0.0502
Schistosoma mansoni	blooms syndrome DNA helicase	0.0017	0.025	0.025
Echinococcus granulosus	Smad4	0.0008	0.0053	0.0036
Loa Loa (eye worm)	hypothetical protein	0.0017	0.0242	0.0422
Loa Loa (eye worm)	beta-LACTamase domain containing family member	0.0043	0.0779	0.1427
Toxoplasma gondii	histone lysine methyltransferase SET1	0.0069	0.1322	1
Toxoplasma gondii	exonuclease III APE	0.0023	0.0354	0.2677
Brugia malayi	nuclear receptor NHR-88	0.0017	0.0242	0.0422
Mycobacterium tuberculosis	Conserved hypothetical protein	0.0017	0.0247	0.0353
Echinococcus granulosus	mothers against decapentaplegic 5	0.0008	0.0053	0.0036
Brugia malayi	nuclear receptor NHR-67	0.0017	0.0242	0.0422
Schistosoma mansoni	cpg binding protein	0.0034	0.0599	0.0599
Brugia malayi	nuclear hormone receptor	0.0017	0.0242	0.0422
Trichomonas vaginalis	D-aminoacylase, putative	0.0043	0.0779	0.1032
Trypanosoma cruzi	DNA polymerase kappa, putative	0.0049	0.0904	0.5945
Echinococcus multilocularis	terminal deoxycytidyl transferase rev1	0.0017	0.0247	0.023
Echinococcus granulosus	nuclear receptor 2DBD gamma	0.0017	0.0242	0.0226
Loa Loa (eye worm)	hypothetical protein	0.0033	0.0559	0.1016
Trichomonas vaginalis	penicillin-binding protein, putative	0.0043	0.0779	0.1032
Loa Loa (eye worm)	hypothetical protein	0.0017	0.0247	0.043
Loa Loa (eye worm)	ImpB/MucB/SamB family protein	0.0017	0.0247	0.043
Trypanosoma brucei	DNA polymerase kappa, putative	0.0025	0.041	0.2695
Toxoplasma gondii	ATP-dependent DNA helicase, RecQ family protein	0.0029	0.0482	0.3644
Schistosoma mansoni	mixed-lineage leukemia protein mll	0.0009	0.0065	0.0065
Brugia malayi	ecdysteroid receptor	0.0036	0.0638	0.1164
Trichomonas vaginalis	chromodomain-helicase-DNA-binding protein, putative	0.0008	0.005	0.00000000041307
Plasmodium vivax	ADP-dependent DNA helicase RecQ, putative	0.0029	0.0495	0.5255
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.035	0.7114	1
Echinococcus granulosus	nuclear receptor 2DBD gamma	0.0036	0.0638	0.0622
Echinococcus granulosus	dna polymerase eta	0.0017	0.0247	0.023
Loa Loa (eye worm)	hypothetical protein	0.0017	0.025	0.0436
Echinococcus multilocularis	bloom syndrome protein	0.0049	0.0906	0.0891
Schistosoma mansoni	nuclear receptor	0.0017	0.0242	0.0242
Loa Loa (eye worm)	hypothetical protein	0.0017	0.0242	0.0422
Echinococcus granulosus	ATP dependent DNA helicase Q1	0.0034	0.0597	0.058
Mycobacterium tuberculosis	Conserved protein	0.0043	0.0779	0.1316
Trichomonas vaginalis	ap endonuclease, putative	0.0023	0.0354	0.043
Schistosoma mansoni	zinc finger protein	0.0017	0.0242	0.0242
Trypanosoma cruzi	DNA polymerase kappa, putative	0.0049	0.0904	0.5945
Schistosoma mansoni	ecdysone-induced protein 78c (dr-78)	0.0019	0.0285	0.0285
Brugia malayi	nuclear receptor NHR-88	0.0036	0.0638	0.1164
Echinococcus multilocularis	gcn5proteinral control of amino acid synthesis	0.0174	0.3472	0.3461
Loa Loa (eye worm)	Smad1	0.0008	0.0053	0.0068
Mycobacterium tuberculosis	Probable esterase/lipase LipP	0.0043	0.0779	0.1316
Echinococcus multilocularis	thyroid hormone receptor alpha	0.0187	0.375	0.374
Brugia malayi	Tyrosyl-DNA phosphodiesterase family protein	0.0079	0.1521	0.2817
Leishmania major	DNA polymerase eta, putative	0.0017	0.0247	0.1623
Loa Loa (eye worm)	hypothetical protein	0.0017	0.0242	0.0422
Toxoplasma gondii	ATP-dependent DNA helicase, RecQ family protein	0.0017	0.025	0.1889
Echinococcus multilocularis	ecdysone induced protein 78C	0.0036	0.0638	0.0622
Trypanosoma cruzi	tyrosyl-DNA Phosphodiesterase (Tdp1), putative	0.0079	0.1521	1
Loa Loa (eye worm)	hypothetical protein	0.0034	0.0597	0.1086
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-1	0.0036	0.0638	0.1164
Trypanosoma cruzi	apurinic/apyrimidinic endonuclease	0.0023	0.0354	0.2327
Loa Loa (eye worm)	hypothetical protein	0.0019	0.0285	0.0502
Entamoeba histolytica	fructose-1,6-bisphosphate aldolase, putative	0.035	0.7114	1
Mycobacterium ulcerans	DNA polymerase IV	0.0049	0.0904	0.2645
Echinococcus multilocularis	ATP dependent DNA helicase Q1	0.0034	0.0597	0.058
Onchocerca volvulus		0.0036	0.0638	0.0775
Toxoplasma gondii	ATP-dependent DNA helicase, RecQ family protein	0.0034	0.0597	0.4514
Loa Loa (eye worm)	exodeoxyribonuclease III family protein	0.0023	0.0354	0.0631
Brugia malayi	beta-lactamase family protein	0.0043	0.0779	0.1427
Leishmania major	DNA polymerase kappa, putative	0.0025	0.041	0.2695
Trypanosoma cruzi	ATP-dependent DEAD/H DNA helicase recQ, putative	0.0017	0.025	0.1642
Trypanosoma brucei	DNA polymerase IV, putative	0.0049	0.0904	0.5945
Loa Loa (eye worm)	hypothetical protein	0.0019	0.0285	0.0502
Schistosoma mansoni	mixed-lineage leukemia protein mll	0.0073	0.1395	0.1395
Loa Loa (eye worm)	beta-lactamase	0.0043	0.0779	0.1427
Brugia malayi	nuclear hormone receptor	0.0036	0.0638	0.1164
Loa Loa (eye worm)	hypothetical protein	0.0043	0.0779	0.1427
Loa Loa (eye worm)	hypothetical protein	0.0017	0.0242	0.0422
Trypanosoma brucei	unspecified product	0.0041	0.0741	0.4873
Schistosoma mansoni	retinoic acid receptor RXR	0.0036	0.0638	0.0638
Trichomonas vaginalis	chromodomain helicase DNA binding protein, putative	0.0008	0.005	0.00000000041307
Trypanosoma cruzi	hypothetical protein, conserved	0.0043	0.0779	0.5122
Echinococcus granulosus	hepatocyte nuclear factor 4 alpha	0.0036	0.0638	0.0622
Brugia malayi	Nuclear hormone receptor family member nhr-19	0.0036	0.0638	0.1164
Brugia malayi	Bloom's syndrome protein homolog	0.0049	0.0906	0.1666
Schistosoma mansoni	vesicular acetylcholine transporter	0.0265	0.5354	0.5354
Trichomonas vaginalis	DNA polymerase IV / kappa, putative	0.0049	0.0904	0.1209
Echinococcus multilocularis	nuclear receptor 2DBD gamma	0.0017	0.0242	0.0226
Loa Loa (eye worm)	hypothetical protein	0.0043	0.0779	0.1427
Schistosoma mansoni	DNA helicase recq1	0.0034	0.0597	0.0597
Brugia malayi	hypothetical protein	0.0017	0.0242	0.0422
Echinococcus granulosus	dna polymerase kappa	0.0049	0.0904	0.0888
Echinococcus granulosus	cpg binding protein	0.0036	0.0639	0.0623
Echinococcus granulosus	nuclear receptor nhr 48	0.0017	0.0242	0.0226
Mycobacterium ulcerans	hypothetical protein	0.0043	0.0779	0.2279
Onchocerca volvulus	Bile acid receptor homolog	0.0036	0.0638	0.0775
Trypanosoma brucei	DNA polymerase kappa, putative	0.0049	0.0904	0.5945
Trypanosoma brucei	hypothetical protein, conserved	0.0043	0.0779	0.5122
Echinococcus multilocularis	dna polymerase eta	0.0017	0.0247	0.023
Schistosoma mansoni	family S12 unassigned peptidase (S12 family)	0.0043	0.0779	0.0779
Echinococcus granulosus	bloom syndrome protein	0.0049	0.0906	0.0891
Trypanosoma cruzi	ATP-dependent DEAD/H DNA helicase recQ, putative	0.0037	0.0661	0.4344
Mycobacterium tuberculosis	Probable exodeoxyribonuclease III protein XthA (exonuclease III) (EXO III) (AP endonuclease VI)	0.0023	0.0354	0.0546
Loa Loa (eye worm)	hypothetical protein	0.0043	0.0779	0.1427
Entamoeba histolytica	tyrosyl-DNA phosphodiesterase, putative	0.0079	0.1521	0.1868
Brugia malayi	ImpB/MucB/SamB family protein	0.0017	0.0247	0.043
Brugia malayi	Ligand-binding domain of nuclear hormone receptor family protein	0.0036	0.0638	0.1164
Brugia malayi	MH2 domain containing protein	0.0008	0.0053	0.0068
Onchocerca volvulus		0.0043	0.0779	0.1049
Mycobacterium leprae	Probable fructose bisphosphate aldolase Fba	0.0171	0.3418	1
Trypanosoma brucei	DNA polymerase kappa, putative	0.0049	0.0904	0.5945
Brugia malayi	Nuclear hormone receptor E75	0.0017	0.0242	0.0422
Trichomonas vaginalis	chromodomain helicase DNA binding protein, putative	0.0008	0.005	0.00000000041307
Trichomonas vaginalis	D-aminoacylase, putative	0.0043	0.0779	0.1032
Echinococcus granulosus	ecdysone induced protein 78C	0.0036	0.0638	0.0622

Activities

Activity type	Activity value	Assay description	Source	Reference
IC50 (binding)	uM	Inhibitory activity of compound to block binding of [3H]-leukotriene D4 to LTD4 receptor sites in homogenized guinea pig lung; NT means not tested.	ChEMBL.	2547071
IC50 (binding)	0 uM	Inhibitory activity of compound to block binding of [3H]-leukotriene D4 to LTD4 receptor sites in homogenized guinea pig lung; NT means not tested.	ChEMBL.	2547071
Inhibition (functional)	0 %	Inhibition of leukotriene D4 induced bronchoconstriction in anesthetized guinea pigs after aerosol administration as 1% solution;NT means not tested.	ChEMBL.	2547071
Inhibition (functional)	= 53 %	Inhibition of leukotriene E4 induced bronchoconstriction in anesthetized guinea pigs after aerosol administration as 1% solution	ChEMBL.	2547071
Inhibition (binding)	= 88 %	Inhibitory activity to block binding of [3H]-leukotriene D4 to LTD4 receptor sites in homogenized guinea pig lung at 10 uM	ChEMBL.	2547071
Inhibition (binding)	= 88 %	Inhibitory activity to block binding of [3H]-leukotriene D4 to LTD4 receptor sites in homogenized guinea pig lung at 10 uM	ChEMBL.	2547071
Inhibition (functional)	= 99 %	Inhibition of leukotriene E4 induced bronchoconstriction in anesthetized guinea pigs after intravenous administration at a dose of 10 mg/kg	ChEMBL.	2547071

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: CHEMBL432106

Bibliographic References

1 literature reference was collected for this gene.

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Detailed information for compound 80465