TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 490.937 | Formula: C23H27ClN4O6
H donors: 2 H acceptors: 3 LogP: 1.48 Rotable bonds: 10
Rule of 5 violations (Lipinski): 1
SMILES: CCO/C(=C/1\C(=NC(=C(C1c1ccccc1Cl)C(=O)OC)C)COCCN1CC(=O)N=C1N)/O
InChi: 1S/C23H27ClN4O6/c1-4-34-22(31)20-16(12-33-10-9-28-11-17(29)27-23(28)25)26-13(2)18(21(30)32-3)19(20)14-7-5-6-8-15(14)24/h5-8,19,31H,4,9-12H2,1-3H3,(H2,25,27,29)/b22-20+
InChiKey: JKLJBBVJBVZOJE-LSDHQDQOSA-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
Echinococcus multilocularis	ecdysone induced protein 78C	0.0015	0.0066	0.0051
Mycobacterium ulcerans	lysyl-tRNA synthetase	0.0023	0.0252	1
Schistosoma mansoni	cellular tumor antigen P53	0.0051	0.0924	0.4278
Toxoplasma gondii	calcium-dependent protein kinase CDPK3	0.0032	0.0464	0.0633
Toxoplasma gondii	calcium-dependent protein kinase CDPK2B	0.0032	0.0464	0.0633
Loa Loa (eye worm)	hypothetical protein	0.0014	0.0053	0.0053
Trichomonas vaginalis	conserved hypothetical protein	0.0032	0.0462	0.0749
Loa Loa (eye worm)	hypothetical protein	0.0042	0.0711	0.0711
Trichomonas vaginalis	conserved hypothetical protein	0.0102	0.2125	0.3799
Echinococcus multilocularis	calcium dependent protein kinase	0.0029	0.0407	0.0479
Onchocerca volvulus		0.0015	0.0066	0.0013
Echinococcus multilocularis	calcium:calmodulin dependent protein kinase type	0.0032	0.0463	0.055
Echinococcus granulosus	solute carrier family 2 facilitated glucose	0.0102	0.2125	0.264
Loa Loa (eye worm)	hypothetical protein	0.003	0.0425	0.0425
Trichomonas vaginalis	chromobox protein, putative	0.0041	0.069	0.1168
Loa Loa (eye worm)	hypothetical protein	0.0044	0.0757	0.0757
Schistosoma mansoni	histone-lysine n-methyltransferase setb1	0.0049	0.0861	0.398
Leishmania major	prolyl-tRNA synthetase, putative,bifunctional aminoacyl-tRNA synthetase, putative	0.0036	0.0557	0.5907
Brugia malayi	Cam kinase protein 1	0.0032	0.0463	0.0463
Brugia malayi	photoreceptor-specific nuclear receptor	0.0015	0.0066	0.0066
Echinococcus granulosus	nuclear receptor 2DBD gamma	0.0015	0.0066	0.0051
Schistosoma mansoni	sugar transporter	0.0014	0.0053	0.0131
Schistosoma mansoni	histone-lysine n-methyltransferase suv9	0.0042	0.0709	0.3255
Leishmania major	prolyl-tRNA synthetase, putative,bifunctional aminoacyl-tRNA synthetase, putative	0.0036	0.0557	0.5907
Trypanosoma brucei	protein kinase, putative	0.0052	0.0944	1
Entamoeba histolytica	hypothetical protein	0.0035	0.055	1
Trypanosoma cruzi	lysyl-tRNA synthetase, putative	0.0023	0.0252	0.2675
Trypanosoma brucei	calcium/calmodulin-dependent protein kinase, putative	0.0032	0.0463	0.4909
Trypanosoma cruzi	hexose transporter, putative	0.0032	0.0462	0.4895
Echinococcus multilocularis	chromobox protein 1	0.0068	0.1332	0.1643
Brugia malayi	Heterochromatin protein 1	0.0068	0.1332	0.1332
Leishmania major	glucose transporter, lmgt1	0.0032	0.0462	0.4895
Echinococcus granulosus	hepatocyte nuclear factor 4 alpha	0.0015	0.0066	0.0051
Echinococcus multilocularis	Nuclear hormone receptor family member nhr 41	0.0015	0.0066	0.0051
Trichomonas vaginalis	glucose transporter, putative	0.0032	0.0462	0.0749
Leishmania major	myo-inositol/proton symporter (MIT)	0.0014	0.0053	0.0565
Echinococcus granulosus	calcium:calmodulin dependent protein kinase type	0.0032	0.0463	0.055
Schistosoma mansoni	lozenge	0.0055	0.1005	0.4663
Trichomonas vaginalis	CAMK family protein kinase	0.0032	0.0463	0.0752
Giardia lamblia	Prolyl-tRNA synthetase	0.0031	0.0438	0.4316
Plasmodium vivax	FAD-linked sulfhydryl oxidase ERV1, putative	0.0036	0.0553	0.0505
Chlamydia trachomatis	lysine--tRNA ligase	0.0023	0.0252	0.5
Loa Loa (eye worm)	hypothetical protein	0.0014	0.0053	0.0053
Schistosoma mansoni	thyroid hormone receptor	0.0015	0.0066	0.0193
Loa Loa (eye worm)	hypothetical protein	0.0014	0.0053	0.0053
Loa Loa (eye worm)	hypothetical protein	0.0014	0.0053	0.0053
Entamoeba histolytica	protein kinase, putative	0.0032	0.0463	0.7088
Trichomonas vaginalis	set domain proteins, putative	0.0245	0.5507	1
Loa Loa (eye worm)	sugar transporter	0.0014	0.0053	0.0053
Trypanosoma brucei	myo-inositol/proton symporter (MIT)	0.0014	0.0053	0.0565
Onchocerca volvulus	Protein ultraspiracle homolog	0.0015	0.0066	0.0013
Schistosoma mansoni	glutamyl-tRNA synthetase cytoplasmic (glutamate--tRNA ligase) (glurs)	0.0031	0.0438	0.1961
Echinococcus multilocularis	zinc finger protein	0.002	0.0193	0.021
Brugia malayi	hypothetical protein	0.0014	0.0053	0.0053
Loa Loa (eye worm)	PHD-finger family protein	0.0021	0.0219	0.0219
Trypanosoma cruzi	ISWI complex protein	0.0016	0.0088	0.0938
Trypanosoma cruzi	glucose transporter, putative	0.0014	0.0053	0.0565
Toxoplasma gondii	prolyl-tRNA synthetase (ProRS)	0.0036	0.0557	0.0778
Entamoeba histolytica	hypothetical protein	0.0035	0.055	1
Plasmodium vivax	lysine--tRNA ligase, putative	0.0023	0.0252	0.0201
Trypanosoma brucei	lysyl-tRNA synthetase, putative	0.0023	0.0252	0.2675
Brugia malayi	follicle stimulating hormone receptor	0.0228	0.5093	0.5093
Brugia malayi	Nuclear hormone receptor family member nhr-49	0.0015	0.0066	0.0066
Loa Loa (eye worm)	hypothetical protein	0.0032	0.0463	0.0463
Loa Loa (eye worm)	hypothetical protein	0.0435	1	1
Loa Loa (eye worm)	bifunctional aminoacyl-tRNA synthetase	0.0013	0.0011	0.0011
Schistosoma mansoni	glutamyl-tRNA synthetase cytoplasmic (glutamate--tRNA ligase) (glurs)	0.0031	0.0438	0.1961
Echinococcus granulosus	solute carrier family 2 facilitated glucose	0.0102	0.2125	0.264
Trichomonas vaginalis	conserved hypothetical protein	0.0027	0.0356	0.0556
Echinococcus multilocularis	glutamyl tRNA synthetase cytoplasmic	0.0031	0.0438	0.0518
Brugia malayi	Sugar transporter family protein	0.0014	0.0053	0.0053
Loa Loa (eye worm)	runx1	0.0055	0.1005	0.1005
Loa Loa (eye worm)	sugar transporter	0.0102	0.2125	0.2125
Brugia malayi	nuclear hormone receptor	0.0015	0.0066	0.0066
Trypanosoma cruzi	mitogen activated protein kinase 4, putative	0.0052	0.0944	1
Brugia malayi	Nuclear hormone receptor family member nhr-25	0.0015	0.0066	0.0066
Plasmodium falciparum	calcium-dependent protein kinase 1	0.0032	0.0464	0.0414
Schistosoma mansoni	hypothetical protein	0.0021	0.0219	0.092
Brugia malayi	hypothetical protein	0.0014	0.0053	0.0053
Echinococcus multilocularis	Protein lozenge	0.0055	0.1005	0.1231
Onchocerca volvulus	Heterochromatin protein 1 homolog	0.0041	0.069	0.064
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-40	0.0015	0.0066	0.0066
Loa Loa (eye worm)	hypothetical protein	0.0014	0.0053	0.0053
Loa Loa (eye worm)	hypothetical protein	0.0051	0.0924	0.0924
Plasmodium vivax	mitogen-activated protein kinase 2, putative	0.0165	0.362	0.3602
Schistosoma mansoni	steroid hormone receptor ad4bp	0.0015	0.0066	0.0193
Plasmodium vivax	calcium-dependent protein kinase, putative	0.0032	0.0464	0.0414
Schistosoma mansoni	FTZ-F1 nuclear receptor-like protein	0.0015	0.0066	0.0193
Loa Loa (eye worm)	hypothetical protein	0.0023	0.0252	0.0252
Schistosoma mansoni	sugar transporter	0.0014	0.0053	0.0131
Trichomonas vaginalis	conserved hypothetical protein	0.0027	0.0356	0.0556
Brugia malayi	Sugar transporter family protein	0.0014	0.0053	0.0053
Schistosoma mansoni	nuclear transcription factor X-box binding 1 (nfx1)	0.0014	0.0053	0.0131
Echinococcus granulosus	fetal alzheimer antigen falz	0.0023	0.0266	0.0302
Entamoeba histolytica	prolyl-tRNA synthetase, putative	0.0031	0.0438	0.6226
Brugia malayi	Nuclear hormone receptor family member nhr-1	0.0015	0.0066	0.0066
Trypanosoma brucei	glucose transporter, putative	0.0032	0.0462	0.4895
Trypanosoma brucei	glucose transporter, putative	0.0032	0.0462	0.4895
Echinococcus multilocularis	tumor protein p63	0.035	0.7977	1
Echinococcus granulosus	lysyl tRNA synthetase	0.0023	0.0252	0.0285
Loa Loa (eye worm)	major facilitator superfamily transporter	0.0014	0.0053	0.0053
Leishmania major	protein kinase, putative	0.0032	0.0463	0.4909
Loa Loa (eye worm)	hypothetical protein	0.0014	0.0053	0.0053
Trypanosoma brucei	glucose transporter, putative	0.0032	0.0462	0.4895
Loa Loa (eye worm)	hypothetical protein	0.0014	0.0053	0.0053
Echinococcus multilocularis	nuclear receptor 2DBD gamma	0.0015	0.0066	0.0051
Toxoplasma gondii	cell-cycle-associated protein kinase MAPK, putative	0.0165	0.362	0.5503
Giardia lamblia	Kinase, CMGC MAPK	0.0052	0.0944	1
Loa Loa (eye worm)	hypothetical protein	0.0025	0.0302	0.0302
Loa Loa (eye worm)	hypothetical protein	0.0015	0.0066	0.0066
Echinococcus multilocularis	FTZ F1 alpha	0.0015	0.0066	0.0051
Loa Loa (eye worm)	nuclear Hormone Receptor family member	0.0015	0.0066	0.0066
Loa Loa (eye worm)	CAMK/CAMK2 protein kinase	0.0032	0.0463	0.0463
Loa Loa (eye worm)	hypothetical protein	0.0014	0.0053	0.0053
Trichomonas vaginalis	CMGC family protein kinase	0.0052	0.0944	0.1633
Echinococcus multilocularis	methyl CpG binding domain protein 2	0.0018	0.0131	0.0133
Echinococcus granulosus	calcium:calmodulin dependent protein kinase type	0.0032	0.0463	0.055
Echinococcus multilocularis	General substrate transporter	0.0088	0.1786	0.2214
Echinococcus granulosus	histone lysine methyltransferase setb	0.0049	0.0861	0.1051
Loa Loa (eye worm)	heterochromatin protein 1	0.0068	0.1332	0.1332
Brugia malayi	bifunctional aminoacyl-tRNA synthetase	0.0031	0.0438	0.0438
Plasmodium falciparum	protein kinase 6	0.0434	0.9956	1
Loa Loa (eye worm)	hypothetical protein	0.0014	0.0053	0.0053
Trypanosoma brucei	glucose transporter, putative	0.0032	0.0462	0.4895
Brugia malayi	major facilitator superfamily protein	0.0014	0.0053	0.0053
Brugia malayi	Pre-SET motif family protein	0.0031	0.0444	0.0444
Trypanosoma cruzi	hexose transporter, putative	0.0032	0.0462	0.4895
Schistosoma mansoni	glucose transport protein	0.0102	0.2125	1
Schistosoma mansoni	retinoic acid receptor RXR	0.0015	0.0066	0.0193
Echinococcus multilocularis	hepatocyte nuclear factor 4 alpha	0.0015	0.0066	0.0051
Wolbachia endosymbiont of Brugia malayi	major facilitator superfamily permease	0.0014	0.0053	0.5
Schistosoma mansoni	sugar transporter	0.0014	0.0053	0.0131
Trichomonas vaginalis	chromobox protein, putative	0.0041	0.069	0.1168
Loa Loa (eye worm)	hypothetical protein	0.0015	0.0066	0.0066
Schistosoma mansoni	transcription factor LCR-F1	0.0035	0.055	0.2496
Plasmodium falciparum	FAD-linked sulfhydryl oxidase ERV1, putative	0.0036	0.0553	0.0505
Echinococcus granulosus	solute carrier family 22	0.0014	0.0053	0.0035
Brugia malayi	hypothetical protein	0.0035	0.055	0.055
Toxoplasma gondii	facilitative glucose transporter GT1	0.0102	0.2125	0.3196
Schistosoma mansoni	photoreceptor-specific nuclear receptor related	0.0015	0.0066	0.0193
Schistosoma mansoni	glucose transport protein	0.0102	0.2125	1
Echinococcus granulosus	mitogen activated protein kinase	0.0052	0.0944	0.1154
Loa Loa (eye worm)	steroid hormone receptor	0.0015	0.0066	0.0066
Plasmodium falciparum	calcium-dependent protein kinase 2	0.0032	0.0464	0.0414
Brugia malayi	Bromodomain containing protein	0.004	0.0651	0.0651
Plasmodium vivax	CDK-related protein kinase 6, putative	0.0434	0.9956	1
Trypanosoma cruzi	mitogen activated protein kinase 2, putative	0.0052	0.0944	1
Echinococcus granulosus	FTZ F1 alpha	0.0015	0.0066	0.0051
Echinococcus multilocularis	solute carrier family 2 facilitated glucose	0.0102	0.2125	0.264
Entamoeba histolytica	protein kinase, putative	0.0032	0.0463	0.7088
Onchocerca volvulus		0.0245	0.5507	0.5483
Echinococcus granulosus	solute carrier family 2 facilitated glucose	0.0102	0.2125	0.264
Trichomonas vaginalis	conserved hypothetical protein	0.0032	0.0462	0.0749
Schistosoma mansoni	nuclear hormone receptor nor-1/nor-2	0.0015	0.0066	0.0193
Echinococcus multilocularis	calcium:calmodulin dependent protein kinase type	0.0032	0.0463	0.055
Echinococcus multilocularis	histone lysine N methyltransferase SETMAR	0.0031	0.0444	0.0526
Trypanosoma brucei	ERV/ALR sulfhydryl oxidase domain-containing protein	0.0036	0.0553	0.5862
Brugia malayi	CHD4 protein	0.0013	0.0026	0.0026
Echinococcus granulosus	Nuclear hormone receptor family member nhr 41	0.0015	0.0066	0.0051
Trypanosoma brucei	glucose transporter, putative	0.0032	0.0462	0.4895
Entamoeba histolytica	hypothetical protein	0.0035	0.055	1
Brugia malayi	PHD-finger family protein	0.0026	0.0324	0.0324
Brugia malayi	Ligand-binding domain of nuclear hormone receptor family protein	0.0015	0.0066	0.0066
Echinococcus granulosus	Sugar transporter ERD6 protein	0.0014	0.0053	0.0035
Brugia malayi	Bifunctional aminoacyl-tRNA synthetase	0.0031	0.0438	0.0438
Brugia malayi	hypothetical protein	0.0149	0.3223	0.3223
Mycobacterium ulcerans	fusion protein of transposase for IS2606 and sialic acid-transport integral membrane protein NanT	0.0014	0.0053	0.2112
Trypanosoma brucei	THT1 - hexose transporter, putative	0.0032	0.0462	0.4895
Mycobacterium ulcerans	sugar transporter	0.0014	0.0053	0.2112
Loa Loa (eye worm)	hypothetical protein	0.0014	0.0053	0.0053
Trypanosoma cruzi	hexose transporter, putative	0.0014	0.0053	0.0565
Brugia malayi	Ligand-binding domain of nuclear hormone receptor family protein	0.0015	0.0066	0.0066
Brugia malayi	MAP kinase sur-1	0.0052	0.0944	0.0944
Loa Loa (eye worm)	hypothetical protein	0.0014	0.0053	0.0053
Onchocerca volvulus	Bile acid receptor homolog	0.0015	0.0066	0.0013
Toxoplasma gondii	calcium-dependent protein kinase CDPK2A	0.0032	0.0464	0.0633
Echinococcus multilocularis	synaptic vesicle 2 protein	0.0014	0.0053	0.0035
Trichomonas vaginalis	glucose transporter, putative	0.0032	0.0462	0.0749
Trypanosoma brucei	THT1 - hexose transporter, putative	0.0032	0.0462	0.4895
Trichomonas vaginalis	lysyl-tRNA synthetase, putative	0.002	0.0186	0.0244
Plasmodium vivax	hexose transporter	0.0102	0.2125	0.2092
Echinococcus multilocularis	solute carrier family 22	0.0014	0.0053	0.0035
Schistosoma mansoni	histone-lysine n-methyltransferase setb1	0.0049	0.0861	0.398
Loa Loa (eye worm)	hypothetical protein	0.0014	0.0053	0.0053
Onchocerca volvulus		0.0435	1	1
Toxoplasma gondii	Erv1 / Alr family protein	0.0036	0.0553	0.0771
Schistosoma mansoni	lysyl-tRNA synthetase	0.0023	0.0252	0.1079
Mycobacterium tuberculosis	Lysyl-tRNA synthetase 1 LysS (lysine--tRNA ligase 1) (LysRS 1) (lysine translase)	0.0019	0.0171	1
Brugia malayi	Nuclear hormone receptor family member nhr-41	0.0015	0.0066	0.0066
Trypanosoma brucei	glucose transporter 2A	0.0032	0.0462	0.4895
Brugia malayi	steroid hormone receptor	0.0015	0.0066	0.0066
Plasmodium falciparum	proline--tRNA ligase	0.0036	0.0557	0.0509
Echinococcus granulosus	Basic leucine zipper bZIP transcription	0.0035	0.055	0.0659
Mycobacterium ulcerans	sugar-transport integral membrane protein SugI	0.0014	0.0053	0.2112
Echinococcus granulosus	retinoic acid receptor rxr beta a	0.0015	0.0066	0.0051
Loa Loa (eye worm)	CHromoDomain protein family member	0.0013	0.0026	0.0026
Echinococcus multilocularis	solute carrier family 22	0.0014	0.0053	0.0035
Schistosoma mansoni	thyroid hormone receptor	0.0015	0.0066	0.0193
Leishmania major	hypothetical protein, conserved	0.0036	0.0553	0.5862
Loa Loa (eye worm)	hypothetical protein	0.004	0.0653	0.0653
Plasmodium falciparum	calcium-dependent protein kinase 4	0.0032	0.0464	0.0414
Echinococcus granulosus	calcium:calmodulin dependent protein kinase type 1	0.0032	0.0463	0.055
Plasmodium vivax	proline--tRNA ligase, putative	0.0036	0.0557	0.0509
Echinococcus granulosus	FTZ F1 nuclear receptor protein	0.0015	0.0066	0.0051
Brugia malayi	SET domain containing protein	0.0012	0.0006	0.0006
Trichomonas vaginalis	CMGC family protein kinase	0.0052	0.0944	0.1633
Echinococcus multilocularis	histone lysine methyltransferase setb histone lysine methyltransferase eggless	0.0049	0.0861	0.1051
Plasmodium falciparum	mitogen-activated protein kinase 2	0.0165	0.362	0.3602
Brugia malayi	lysyl-tRNA synthetase	0.0023	0.0252	0.0252
Brugia malayi	Calcium/calmodulin-dependent protein kinase type II alpha chain	0.0032	0.0463	0.0463
Trypanosoma brucei	THT1 - hexose transporter, putative	0.0032	0.0462	0.4895
Schistosoma mansoni	protein kinase	0.0032	0.0463	0.2083
Mycobacterium leprae	Possible lysyl-tRNA synthetase 2 LysX	0.0023	0.0252	0.3046
Loa Loa (eye worm)	hypothetical protein	0.0031	0.0438	0.0438
Trichomonas vaginalis	sugar transporter, putative	0.0032	0.0462	0.0749
Echinococcus granulosus	bromodomain adjacent to zinc finger domain	0.0037	0.0593	0.0713
Schistosoma mansoni	coup transcription factor	0.0015	0.0066	0.0193
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-1	0.0015	0.0066	0.0066
Echinococcus multilocularis	bromodomain adjacent to zinc finger domain	0.0037	0.0593	0.0713
Loa Loa (eye worm)	hypothetical protein	0.0031	0.0438	0.0438
Brugia malayi	Major Facilitator Superfamily protein	0.0014	0.0053	0.0053
Echinococcus granulosus	calcium dependent protein kinase	0.0029	0.0407	0.0479
Trichomonas vaginalis	sugar transporter, putative	0.0032	0.0462	0.0749
Echinococcus granulosus	chromobox protein 1	0.0068	0.1332	0.1643
Schistosoma mansoni	methyl-cpg binding protein mbd	0.0018	0.0131	0.0503
Schistosoma mansoni	RAR-like nuclear receptor	0.0015	0.0066	0.0193
Echinococcus granulosus	nuclear receptor 2DBD gamma	0.0015	0.0066	0.0051
Leishmania major	glucose transporter, lmgt2	0.0032	0.0462	0.4895
Leishmania major	hypothetical protein, conserved	0.0016	0.0088	0.0938
Echinococcus multilocularis	mitogen activated protein kinase	0.0052	0.0944	0.1154
Schistosoma mansoni	glucose transport protein	0.0102	0.2125	1
Schistosoma mansoni	acetyl-CoA C-acetyltransferase	0.0023	0.0266	0.1142
Onchocerca volvulus	Steroid hormone receptor family member cnr14 homolog	0.0015	0.0066	0.0013
Schistosoma mansoni	nuclear hormone receptor	0.0015	0.0066	0.0193
Echinococcus multilocularis	FAD linked sulfhydryl oxidase ALR	0.0036	0.0553	0.0663
Echinococcus granulosus	COUP TF:Svp nuclear hormone receptor	0.0015	0.0066	0.0051
Loa Loa (eye worm)	hypothetical protein	0.0015	0.0066	0.0066
Echinococcus multilocularis	Basic leucine zipper (bZIP) transcription	0.0035	0.055	0.0659
Brugia malayi	Steroid receptor seven-up type 2	0.0015	0.0066	0.0066
Mycobacterium ulcerans	integral membrane transport protein	0.0014	0.0053	0.2112
Trypanosoma cruzi	mitogen-activated protein kinase 11, putative	0.0052	0.0944	1
Echinococcus granulosus	glutamyl tRNA synthetase cytoplasmic	0.0031	0.0438	0.0518
Leishmania major	mitogen activated protein kinase 4, putative;with=GeneDB:LmxM19.1440	0.0052	0.0944	1
Loa Loa (eye worm)	hepatopoietin HPO2	0.0036	0.0553	0.0553
Echinococcus granulosus	solute carrier family 22	0.0014	0.0053	0.0035
Echinococcus multilocularis	COUP TF:Svp nuclear hormone receptor	0.0015	0.0066	0.0051
Schistosoma mansoni	lysyl-tRNA synthetase	0.0023	0.0252	0.1079
Brugia malayi	Bromodomain containing protein	0.0078	0.1548	0.1548
Trypanosoma cruzi	Present in the outer mitochondrial membrane proteome 4	0.0036	0.0553	0.5862
Trichomonas vaginalis	prolyl-tRNA synthetase, putative	0.0031	0.0438	0.0705
Schistosoma mansoni	serine/threonine protein kinase	0.0032	0.0463	0.2083
Loa Loa (eye worm)	hypothetical protein	0.0015	0.0066	0.0066
Echinococcus granulosus	zinc finger protein	0.002	0.0193	0.021
Schistosoma mansoni	Tr4/Tr2 (homologue)	0.0015	0.0066	0.0193
Trypanosoma cruzi	prolyl-tRNA synthetase, putative	0.0036	0.0557	0.5907
Schistosoma mansoni	bromodomain containing protein	0.0065	0.1262	0.5888
Trypanosoma cruzi	hexose transporter	0.0032	0.0462	0.4895
Echinococcus multilocularis	chromobox protein 1	0.0068	0.1332	0.1643
Leishmania major	hypothetical protein, conserved	0.0014	0.0053	0.0565
Brugia malayi	Sugar transporter family protein	0.0102	0.2125	0.2125
Loa Loa (eye worm)	hypothetical protein	0.0073	0.1444	0.1444
Leishmania major	glucose transporter/membrane transporter D2, putative	0.0032	0.0462	0.4895
Trypanosoma brucei	glucose transporter 1E	0.0032	0.0462	0.4895
Onchocerca volvulus		0.0051	0.0924	0.0875
Giardia lamblia	Lysyl-tRNA synthetase	0.0023	0.0252	0.2236
Plasmodium vivax	calcium-dependent protein kinase 1, putative	0.0032	0.0464	0.0414
Plasmodium vivax	calcium-dependent protein kinase 4, putative	0.0032	0.0464	0.0414
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-41	0.0015	0.0066	0.0066
Schistosoma mansoni	hypothetical protein	0.0016	0.0088	0.0298
Mycobacterium leprae	Probable prolyl tRNA synthetase ProS	0.0031	0.0438	1
Schistosoma mansoni	methyl-cpg binding protein mbd	0.0018	0.0131	0.0503
Trichomonas vaginalis	chromobox protein, putative	0.0068	0.1332	0.2345
Trypanosoma cruzi	hexose transporter, putative	0.0017	0.0123	0.1304
Plasmodium falciparum	calcium-dependent protein kinase 5	0.0032	0.0464	0.0414
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-49	0.0015	0.0066	0.0066
Loa Loa (eye worm)	bromodomain containing protein	0.0018	0.0146	0.0146
Schistosoma mansoni	hypothetical protein	0.0035	0.055	0.2496
Schistosoma mansoni	histone-lysine n-methyltransferase setb1	0.0031	0.0444	0.1994
Echinococcus granulosus	ecdysone induced protein 78C	0.0015	0.0066	0.0051
Echinococcus multilocularis	FTZ F1 nuclear receptor protein	0.0015	0.0066	0.0051
Echinococcus multilocularis	nuclear receptor 2DBD gamma	0.0015	0.0066	0.0051
Trypanosoma cruzi	hexose transporter, putative	0.0032	0.0462	0.4895
Echinococcus granulosus	bromodomain adjacent to zinc finger domain	0.0062	0.1174	0.1444
Mycobacterium ulcerans	lysyl-tRNA synthetase	0.0023	0.0252	1
Schistosoma mansoni	zinc finger protein	0.0016	0.0088	0.0298
Brugia malayi	major facilitator superfamily protein	0.0014	0.0053	0.0053
Brugia malayi	chromobox protein homolog 3	0.0038	0.0621	0.0621
Brugia malayi	Major Facilitator Superfamily protein	0.0014	0.0053	0.0053
Echinococcus granulosus	tumor protein p63	0.035	0.7977	1
Schistosoma mansoni	chromobox protein	0.0068	0.1332	0.6223
Loa Loa (eye worm)	hypothetical protein	0.0015	0.0066	0.0066
Schistosoma mansoni	zinc finger protein	0.002	0.0193	0.0797
Loa Loa (eye worm)	calcium/calmodulin-dependent protein kinase ID	0.0032	0.0463	0.0463
Plasmodium falciparum	lysine--tRNA ligase	0.0023	0.0252	0.0201
Echinococcus multilocularis	Sugar transporter ERD6 protein	0.0014	0.0053	0.0035
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-14	0.0015	0.0066	0.0066
Leishmania major	glucose transporter, lmgt3	0.0032	0.0462	0.4895
Echinococcus granulosus	solute carrier family 22	0.0014	0.0053	0.0035
Schistosoma mansoni	sugar transporter	0.0014	0.0053	0.0131
Echinococcus granulosus	FAD linked sulfhydryl oxidase ALR	0.0036	0.0553	0.0663
Trypanosoma cruzi	prolyl-tRNA synthetase, putative	0.0036	0.0557	0.5907
Trypanosoma brucei	glucose transporter, putative	0.0032	0.0462	0.4895
Echinococcus granulosus	chromobox protein 1	0.0068	0.1332	0.1643
Trypanosoma cruzi	Present in the outer mitochondrial membrane proteome 4	0.0036	0.0553	0.5862
Brugia malayi	Nuclear hormone receptor family member nhr-14	0.0015	0.0066	0.0066
Brugia malayi	Nuclear hormone receptor family member nhr-40	0.0015	0.0066	0.0066
Loa Loa (eye worm)	hypothetical protein	0.0015	0.0066	0.0066
Brugia malayi	Nuclear hormone receptor family member nhr-3	0.0015	0.0066	0.0066
Echinococcus granulosus	solute carrier family 2 facilitated glucose	0.0102	0.2125	0.264
Brugia malayi	Nuclear hormone receptor family member nhr-19	0.0015	0.0066	0.0066
Loa Loa (eye worm)	hypothetical protein	0.0149	0.3223	0.3223
Onchocerca volvulus		0.0042	0.0709	0.0659
Schistosoma mansoni	glucose transporter	0.0014	0.0053	0.0131
Brugia malayi	hypothetical protein	0.0014	0.0053	0.0053
Loa Loa (eye worm)	hypothetical protein	0.0049	0.0861	0.0861
Brugia malayi	Nuclear hormone receptor family member nhr-31	0.0015	0.0066	0.0066
Loa Loa (eye worm)	CMGC/MAPK/ERK1 protein kinase	0.0052	0.0944	0.0944
Schistosoma mansoni	hypothetical protein	0.0102	0.2125	1
Echinococcus granulosus	synaptic vesicle 2 protein	0.0014	0.0053	0.0035
Trichomonas vaginalis	lysyl-tRNA synthetase, putative	0.0023	0.0252	0.0365
Plasmodium vivax	calcium-dependent protein kinase 3, putative	0.0032	0.0464	0.0414
Loa Loa (eye worm)	hypothetical protein	0.0014	0.0053	0.0053
Echinococcus multilocularis	calcium:calmodulin dependent protein kinase type	0.0032	0.0463	0.055
Loa Loa (eye worm)	hypothetical protein	0.0015	0.0066	0.0066
Echinococcus multilocularis	solute carrier family 2 facilitated glucose	0.0102	0.2125	0.264
Echinococcus granulosus	5'partial\|histone lysine N methyltransferase SETDB2	0.003	0.0417	0.0493
Loa Loa (eye worm)	hypothetical protein	0.0014	0.0053	0.0053
Brugia malayi	Nuclear hormone receptor family member nhr-19	0.0015	0.0066	0.0066
Echinococcus multilocularis	mitogen activated protein kinase 3	0.0052	0.0944	0.1154
Echinococcus multilocularis	solute carrier family 2, facilitated glucose	0.0102	0.2125	0.264
Toxoplasma gondii	Erv1 / Alr family protein	0.0036	0.0553	0.0771
Echinococcus granulosus	mitogen activated protein kinase 3	0.0052	0.0944	0.1154
Onchocerca volvulus	Heterochromatin protein 1 homolog	0.0038	0.0621	0.0571
Loa Loa (eye worm)	hypothetical protein	0.0038	0.0621	0.0621
Trichomonas vaginalis	conserved hypothetical protein	0.0038	0.0621	0.1041
Echinococcus granulosus	solute carrier family 22	0.0014	0.0053	0.0035
Brugia malayi	Augmenter of liver regeneration	0.0036	0.0553	0.0553
Echinococcus multilocularis	bromodomain adjacent to zinc finger domain	0.0062	0.1174	0.1444
Trichomonas vaginalis	chromobox protein, putative	0.0068	0.1332	0.2345
Brugia malayi	ecdysteroid receptor	0.0015	0.0066	0.0066
Loa Loa (eye worm)	hypothetical protein	0.0435	1	1
Plasmodium falciparum	protein kinase 7	0.0289	0.6536	0.6546
Schistosoma mansoni	chromobox protein	0.0068	0.1332	0.6223
Toxoplasma gondii	histone lysine methyltransferase SET/SUV39	0.0031	0.0444	0.0603
Loa Loa (eye worm)	hypothetical protein	0.0015	0.0066	0.0066
Plasmodium vivax	SET domain protein, putative	0.0031	0.0444	0.0395
Brugia malayi	Nuclear hormone receptor-like 1	0.0015	0.0066	0.0066
Echinococcus multilocularis	solute carrier family 2 facilitated glucose	0.0102	0.2125	0.264
Trypanosoma cruzi	ISWI complex protein	0.0016	0.0088	0.0938
Plasmodium falciparum	calcium-dependent protein kinase 3	0.0032	0.0464	0.0414
Echinococcus granulosus	General substrate transporter	0.0088	0.1786	0.2214
Brugia malayi	nuclear receptor NHR-88	0.0015	0.0066	0.0066
Toxoplasma gondii	CMGC kinase, MAPK family (ERK) MAPK-1	0.0052	0.0944	0.1373
Toxoplasma gondii	protein kinase, putative	0.0289	0.6536	1
Onchocerca volvulus		0.0149	0.3223	0.3187
Echinococcus multilocularis	solute carrier family 22	0.0014	0.0053	0.0035
Trypanosoma brucei	ISWI complex protein	0.0016	0.0088	0.0938
Brugia malayi	Major Facilitator Superfamily protein	0.0014	0.0053	0.0053
Echinococcus multilocularis	fetal alzheimer antigen, falz	0.0023	0.0266	0.0302
Echinococcus multilocularis	thyroid hormone receptor alpha	0.0015	0.0066	0.0051
Schistosoma mansoni	protein kinase	0.0032	0.0463	0.2083
Plasmodium falciparum	hexose transporter	0.0102	0.2125	0.2092
Loa Loa (eye worm)	hypothetical protein	0.0014	0.0053	0.0053
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-31	0.0015	0.0066	0.0066
Brugia malayi	Nuclear hormone receptor family member nhr-25	0.0015	0.0066	0.0066
Schistosoma mansoni	protein kinase	0.0032	0.0463	0.2083
Trypanosoma brucei	bifunctional aminoacyl-tRNA synthetase, putative	0.0036	0.0557	0.5907
Loa Loa (eye worm)	follicle stimulating hormone receptor	0.0228	0.5093	0.5093
Trypanosoma cruzi	sugar transporter, putative	0.0014	0.0053	0.0565
Schistosoma mansoni	serine/threonine protein kinase	0.0052	0.0944	0.4372
Mycobacterium tuberculosis	Lysyl-tRNA synthetase 2 LysX	0.0019	0.0171	1
Trypanosoma brucei	glucose transporter, putative	0.0032	0.0462	0.4895
Echinococcus granulosus	methyl CpG binding domain protein 2	0.0018	0.0131	0.0133
Echinococcus multilocularis	solute carrier family 22	0.0014	0.0053	0.0035
Trichomonas vaginalis	conserved hypothetical protein	0.0038	0.0621	0.1041
Trypanosoma brucei	sugar transporter, putative	0.0014	0.0053	0.0565
Leishmania major	mitogen activated protein kinase, putative,map kinase, putative	0.0052	0.0944	1
Entamoeba histolytica	hypothetical protein	0.0035	0.055	1
Trypanosoma cruzi	mitogen-activated protein kinase 11, putative	0.0052	0.0944	1
Trichomonas vaginalis	sugar transporter, putative	0.0032	0.0462	0.0749
Leishmania major	lysyl-tRNA synthetase, putative	0.0023	0.0252	0.2675
Loa Loa (eye worm)	major facilitator superfamily transporter	0.0014	0.0053	0.0053
Echinococcus granulosus	calcium:calmodulin dependent protein kinase type	0.0032	0.0463	0.055
Brugia malayi	Pre-SET motif family protein	0.0215	0.4804	0.4804
Trypanosoma cruzi	ERV/ALR sulfhydryl oxidase domain-containing protein	0.0036	0.0553	0.5862
Trypanosoma brucei	glucose transporter, putative	0.0032	0.0462	0.4895
Echinococcus multilocularis	lysyl tRNA synthetase	0.0023	0.0252	0.0285
Toxoplasma gondii	lysine-tRNA ligase	0.0023	0.0252	0.0307
Echinococcus multilocularis	calcium:calmodulin dependent protein kinase type	0.0032	0.0463	0.055
Onchocerca volvulus		0.003	0.0425	0.0374
Trichomonas vaginalis	CMGC family protein kinase	0.0052	0.0944	0.1633
Schistosoma mansoni	nuclear receptor 2DBD-gamma	0.0015	0.0066	0.0193
Schistosoma mansoni	retinoid-x-receptor (RXR)	0.0015	0.0066	0.0193
Trichomonas vaginalis	CMGC family protein kinase	0.0052	0.0944	0.1633
Loa Loa (eye worm)	pre-SET domain-containing protein family protein	0.0215	0.4804	0.4804
Trypanosoma brucei	mitogen activated protein kinase 4, putative	0.0052	0.0944	1

Activities

Activity type	Activity value	Assay description	Source	Reference
Log IC50 (functional)	= 7.7	Concentration required to block Ca+2-induced contraction of K+ depolarized rat aorta	ChEMBL.	2342074
pIC25 (functional)	= 6.1	Concentration required to depress contraction in the Langendorff-perfused guinea pig heart	ChEMBL.	2342074
Selectivity index (functional)	= 40	Ratio of pIC50 of rat aorta to pIC25 of guinea pig	ChEMBL.	2342074

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: CHEMBL300872

Bibliographic References

1 literature reference was collected for this gene.

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Detailed information for compound 79160