TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 443.498 | Formula: C25H25N5O3
H donors: 2 H acceptors: 3 LogP: 3.18 Rotable bonds: 7
Rule of 5 violations (Lipinski): 1
SMILES: O=C1N[C@H](CNc2c1nn(c2)CCc1ccccc1)COC(=O)c1cn(c2c1cccc2)C
InChi: 1S/C25H25N5O3/c1-29-14-20(19-9-5-6-10-22(19)29)25(32)33-16-18-13-26-21-15-30(28-23(21)24(31)27-18)12-11-17-7-3-2-4-8-17/h2-10,14-15,18,26H,11-13,16H2,1H3,(H,27,31)/t18-/m1/s1
InChiKey: QFKXCBWWQQIGKD-GOSISDBHSA-N

Network

Hover on a compound node to display the structore

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

This is a work in progress. Come back soon to try this features!

Clustering layers

This is a work in progress. Come back soon to try this features!

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
Schistosoma mansoni	glucose transporter	0.0016	0.0136	0.0102
Plasmodium vivax	ataxin-2 like protein, putative	0.003	0.0415	0.0283
Plasmodium falciparum	calcium-dependent protein kinase 1	0.0036	0.0545	0.0414
Loa Loa (eye worm)	CYP4Cod1	0.0021	0.0244	0.0689
Plasmodium falciparum	protein kinase 7	0.0327	0.6593	0.6546
Brugia malayi	RNA binding protein	0.0069	0.1232	0.3479
Trichomonas vaginalis	sugar transporter, putative	0.0016	0.0136	0.0135
Trichomonas vaginalis	D-aminoacylase, putative	0.0041	0.0643	0.2557
Echinococcus granulosus	solute carrier family 22	0.0016	0.0136	0.0145
Echinococcus granulosus	lysyl tRNA synthetase	0.0026	0.0335	0.0361
Echinococcus multilocularis	solute carrier family 22	0.0016	0.0136	0.0145
Schistosoma mansoni	alpha-glucosidase	0.0155	0.3021	0.3253
Leishmania major	hypothetical protein, conserved	0.0016	0.0136	0.1034
Brugia malayi	MH2 domain containing protein	0.013	0.2501	0.7061
Brugia malayi	hypothetical protein	0.0016	0.0136	0.0384
Mycobacterium ulcerans	cytochrome P450 185A4 Cyp185A4	0.0021	0.0244	0.3353
Mycobacterium tuberculosis	Probable dicarboxylic acid transport integral membrane protein KgtP (dicarboxylate transporter)	0.0016	0.0136	0.0182
Toxoplasma gondii	prolyl-tRNA synthetase (ProRS)	0.004	0.0638	0.091
Brugia malayi	TAR-binding protein	0.0069	0.1232	0.3479
Mycobacterium ulcerans	fusion of enoyl-CoA hydratase, EchA21 and lipase, LipE	0.0041	0.0643	1
Trichomonas vaginalis	D-aminoacylase, putative	0.0041	0.0643	0.2557
Echinococcus granulosus	beta LACTamase domain containing family member	0.0041	0.0643	0.0696
Echinococcus granulosus	solute carrier family 22	0.0016	0.0136	0.0145
Chlamydia trachomatis	lysine--tRNA ligase	0.0026	0.0335	1
Trichomonas vaginalis	sugar transporter, putative	0.0016	0.0136	0.0135
Onchocerca volvulus		0.0016	0.0136	0.0152
Trypanosoma brucei	glucose transporter, putative	0.0036	0.0543	0.5527
Loa Loa (eye worm)	cytochrome P450 family protein	0.0033	0.0481	0.1358
Brugia malayi	Glycosyl hydrolases family 31 protein	0.0015	0.0108	0.0304
Leishmania major	cytochrome p450-like protein	0.0021	0.0244	0.2222
Brugia malayi	Major Facilitator Superfamily protein	0.0016	0.0136	0.0384
Echinococcus granulosus	solute carrier family 2 facilitated glucose	0.0116	0.22	0.239
Schistosoma mansoni	protein kinase	0.0036	0.0545	0.0548
Entamoeba histolytica	glycosyl hydrolase, family 31 protein	0.004	0.0629	0.6201
Trichomonas vaginalis	sugar transporter, putative	0.0016	0.0136	0.0135
Echinococcus granulosus	cpg binding protein	0.0034	0.0496	0.0537
Trypanosoma brucei	glucose transporter, putative	0.0036	0.0543	0.5527
Wolbachia endosymbiont of Brugia malayi	major facilitator superfamily permease	0.0016	0.0136	0.5
Entamoeba histolytica	protein kinase domain containing protein	0.0055	0.0949	1
Toxoplasma gondii	facilitative glucose transporter GT1	0.0116	0.22	0.3293
Trichomonas vaginalis	sugar transporter, putative	0.0016	0.0136	0.0135
Toxoplasma gondii	sugar transporter ST3	0.0016	0.0136	0.0143
Trichomonas vaginalis	sugar transporter, putative	0.0016	0.0136	0.0135
Loa Loa (eye worm)	hypothetical protein	0.0041	0.0643	0.1815
Loa Loa (eye worm)	hypothetical protein	0.0041	0.0643	0.1815
Trichomonas vaginalis	sugar transporter, putative	0.0016	0.0136	0.0135
Echinococcus multilocularis	synaptic vesicle 2 protein	0.0016	0.0136	0.0145
Trichomonas vaginalis	esterase, putative	0.0041	0.0643	0.2557
Echinococcus granulosus	Sugar transporter ERD6 protein	0.0016	0.0136	0.0145
Echinococcus multilocularis	beta LACTamase domain containing family member	0.0041	0.0643	0.0696
Mycobacterium tuberculosis	Probable lipase LipD	0.0041	0.0643	0.1166
Mycobacterium ulcerans	lipase LipD	0.0041	0.0643	1
Trypanosoma cruzi	glycogen synthase kinase 3, putative	0.0055	0.0949	1
Trichomonas vaginalis	D-aminoacylase, putative	0.0041	0.0643	0.2557
Giardia lamblia	Kinase, CMGC GSK	0.0055	0.0949	1
Schistosoma mansoni	glucose transport protein	0.0116	0.22	0.2357
Onchocerca volvulus		0.0016	0.0136	0.0152
Plasmodium vivax	lysine--tRNA ligase, putative	0.0026	0.0335	0.0201
Onchocerca volvulus		0.0016	0.0136	0.0152
Trichomonas vaginalis	sugar transporter, putative	0.0016	0.0136	0.0135
Onchocerca volvulus		0.0104	0.1964	1
Entamoeba histolytica	protein kinase, putative	0.0055	0.0949	1
Onchocerca volvulus		0.0016	0.0136	0.0152
Mycobacterium tuberculosis	Possible penicillin-binding protein	0.026	0.5193	1
Loa Loa (eye worm)	MH2 domain-containing protein	0.013	0.2501	0.7061
Onchocerca volvulus		0.0016	0.0136	0.0152
Trypanosoma cruzi	hexose transporter, putative	0.0036	0.0543	0.5527
Echinococcus granulosus	solute carrier family 2 facilitated glucose	0.0116	0.22	0.239
Schistosoma mansoni	lysyl-tRNA synthetase	0.0026	0.0335	0.0319
Plasmodium falciparum	calcium-dependent protein kinase 4	0.0036	0.0545	0.0414
Mycobacterium ulcerans	fusion protein of transposase for IS2606 and sialic acid-transport integral membrane protein NanT	0.0016	0.0136	0.1561
Plasmodium vivax	calcium-dependent protein kinase 3, putative	0.0036	0.0545	0.0414
Toxoplasma gondii	protein kinase, putative	0.0327	0.6593	1
Schistosoma mansoni	hypothetical protein	0.0452	0.9196	1
Brugia malayi	RNA recognition motif domain containing protein	0.0069	0.1232	0.3479
Echinococcus multilocularis	Ataxin 2, N terminal,domain containing protein	0.0013	0.0075	0.0079
Schistosoma mansoni	tar DNA-binding protein	0.0069	0.1232	0.13
Mycobacterium ulcerans	integral membrane transport protein	0.0016	0.0136	0.1561
Loa Loa (eye worm)	TAR-binding protein	0.0069	0.1232	0.348
Toxoplasma gondii	transporter, major facilitator family protein	0.0016	0.0136	0.0143
Trypanosoma cruzi	PAB1-binding protein , putative	0.003	0.0415	0.4116
Echinococcus granulosus	protein kinase shaggy	0.0055	0.0949	0.1029
Trichomonas vaginalis	sugar transporter, putative	0.0016	0.0136	0.0135
Onchocerca volvulus		0.0041	0.0643	0.2883
Loa Loa (eye worm)	glycosyl hydrolase family 31 protein	0.018	0.3542	1
Onchocerca volvulus		0.0016	0.0136	0.0152
Trypanosoma cruzi	lysyl-tRNA synthetase, putative	0.0026	0.0335	0.3223
Leishmania major	glucose transporter, lmgt1	0.0036	0.0543	0.5527
Echinococcus granulosus	neutral alpha glucosidase AB	0.004	0.0629	0.0681
Trichomonas vaginalis	glucose transporter, putative	0.0016	0.0136	0.0135
Echinococcus multilocularis	solute carrier family 2 facilitated glucose	0.0116	0.22	0.239
Mycobacterium leprae	Probable prolyl tRNA synthetase ProS	0.0035	0.0519	0.7936
Trichomonas vaginalis	lysyl-tRNA synthetase, putative	0.0023	0.0269	0.0767
Echinococcus granulosus	lysosomal alpha glucosidase	0.018	0.3542	0.385
Trypanosoma brucei	glycosyl hydrolase-like protein	0.0015	0.0108	0.0722
Entamoeba histolytica	glycosyl hydrolase, family 31 protein	0.004	0.0629	0.6201
Loa Loa (eye worm)	hypothetical protein	0.0016	0.0136	0.0385
Trichomonas vaginalis	alpha-glucosidase, putative	0.004	0.0629	0.2492
Plasmodium vivax	calcium-dependent protein kinase 4, putative	0.0036	0.0545	0.0414
Loa Loa (eye worm)	hypothetical protein	0.0035	0.0519	0.1465
Toxoplasma gondii	cell-cycle-associated protein kinase GSK, putative	0.0055	0.0949	0.1383
Trichomonas vaginalis	sugar transporter, putative	0.0016	0.0136	0.0135
Trichomonas vaginalis	CMGC family protein kinase	0.0055	0.0949	0.4018
Mycobacterium tuberculosis	Probable esterase/lipase LipP	0.0041	0.0643	0.1166
Echinococcus granulosus	cytochrome P450 2K1	0.0012	0.0043	0.0043
Schistosoma mansoni	sugar transporter	0.0016	0.0136	0.0102
Loa Loa (eye worm)	hypothetical protein	0.003	0.0415	0.1173
Loa Loa (eye worm)	hypothetical protein	0.0016	0.0136	0.0385
Trichomonas vaginalis	alpha-glucosidase, putative	0.004	0.0629	0.2492
Echinococcus granulosus	glycogen synthase kinase 3 beta	0.0055	0.0949	0.1029
Plasmodium vivax	glycogen synthase kinase 3, putative	0.0055	0.0949	0.0824
Echinococcus multilocularis	lysosomal alpha glucosidase	0.018	0.3542	0.385
Onchocerca volvulus		0.0016	0.0136	0.0152
Schistosoma mansoni	nuclear transcription factor X-box binding 1 (nfx1)	0.0016	0.0136	0.0102
Trypanosoma cruzi	cytochrome P450, putative	0.0021	0.0244	0.2222
Trypanosoma brucei	protein kinase, putative	0.0055	0.0949	1
Trypanosoma brucei	glucose transporter, putative	0.0036	0.0543	0.5527
Plasmodium vivax	proline--tRNA ligase, putative	0.004	0.0638	0.0509
Trichomonas vaginalis	sugar transporter, putative	0.0016	0.0136	0.0135
Leishmania major	alpha glucosidase II subunit, putative	0.004	0.0629	0.6476
Brugia malayi	Cytochrome P450 family protein	0.0033	0.0481	0.1357
Brugia malayi	Bifunctional aminoacyl-tRNA synthetase	0.0035	0.0519	0.1465
Mycobacterium ulcerans	beta-lactamase	0.0041	0.0643	1
Loa Loa (eye worm)	major facilitator superfamily transporter	0.0016	0.0136	0.0385
Brugia malayi	Cytochrome P450 family protein	0.0012	0.0043	0.012
Echinococcus multilocularis	solute carrier family 22	0.0016	0.0136	0.0145
Trichomonas vaginalis	sugar transporter, putative	0.0016	0.0136	0.0135
Mycobacterium tuberculosis	Probable lipase LipE	0.0041	0.0643	0.1166
Loa Loa (eye worm)	glycosyl hydrolase family 31 protein	0.004	0.0629	0.1777
Echinococcus granulosus	Ataxin 2 N terminaldomain containing protein	0.0013	0.0075	0.0079
Trichomonas vaginalis	neutral alpha-glucosidase ab precursor, putative	0.004	0.0629	0.2492
Onchocerca volvulus		0.0016	0.0136	0.0152
Schistosoma mansoni	hypothetical protein	0.0013	0.0075	0.0036
Loa Loa (eye worm)	hypothetical protein	0.0016	0.0136	0.0385
Brugia malayi	hypothetical protein	0.003	0.0415	0.1172
Loa Loa (eye worm)	hypothetical protein	0.0041	0.0643	0.1815
Schistosoma mansoni	glutamyl-tRNA synthetase cytoplasmic (glutamate--tRNA ligase) (glurs)	0.0035	0.0519	0.052
Toxoplasma gondii	ABC1 family protein	0.0041	0.0643	0.0917
Brugia malayi	Glycosyl hydrolases family 31 protein	0.004	0.0629	0.1776
Trichomonas vaginalis	sugar transporter, putative	0.0016	0.0136	0.0135
Trichomonas vaginalis	sugar transporter, putative	0.0036	0.0543	0.2081
Onchocerca volvulus		0.0041	0.0643	0.2883
Trichomonas vaginalis	conserved hypothetical protein	0.0016	0.0136	0.0135
Trypanosoma cruzi	hexose transporter, putative	0.002	0.0206	0.18
Mycobacterium tuberculosis	Probable esterase LipL	0.0041	0.0643	0.1166
Trichomonas vaginalis	sugar transporter, putative	0.0016	0.0136	0.0135
Trichomonas vaginalis	penicillin-binding protein, putative	0.0041	0.0643	0.2557
Onchocerca volvulus		0.0016	0.0136	0.0152
Toxoplasma gondii	calcium-dependent protein kinase CDPK2B	0.0036	0.0545	0.0767
Trichomonas vaginalis	sugar transporter, putative	0.0016	0.0136	0.0135
Echinococcus multilocularis	neutral alpha glucosidase AB	0.004	0.0629	0.0681
Trypanosoma cruzi	hypothetical protein, conserved	0.004	0.0629	0.6476
Brugia malayi	bifunctional aminoacyl-tRNA synthetase	0.0035	0.0519	0.1465
Brugia malayi	Cam kinase protein 1	0.0036	0.0545	0.1537
Echinococcus multilocularis	cpg binding protein	0.0034	0.0496	0.0537
Trypanosoma brucei	glucose transporter, putative	0.0036	0.0543	0.5527
Leishmania major	glycogen synthase kinase, putative;with=GeneDB:LinJ18_V3.0270	0.0055	0.0949	1
Mycobacterium tuberculosis	Conserved protein	0.0041	0.0643	0.1166
Echinococcus multilocularis	lysosomal alpha glucosidase	0.018	0.3542	0.385
Toxoplasma gondii	sugar transporter ST2	0.0016	0.0136	0.0143
Onchocerca volvulus		0.0016	0.0136	0.0152
Mycobacterium leprae	Possible lysyl-tRNA synthetase 2 LysX	0.0026	0.0335	0.4864
Entamoeba histolytica	protein kinase domain containing protein	0.0055	0.0949	1
Trichomonas vaginalis	sugar transporter, putative	0.0016	0.0136	0.0135
Onchocerca volvulus		0.0016	0.0136	0.0152
Echinococcus multilocularis	Sugar transporter ERD6 protein	0.0016	0.0136	0.0145
Trichomonas vaginalis	alpha-glucosidase, putative	0.004	0.0629	0.2492
Plasmodium falciparum	ataxin-2 like protein, putative	0.003	0.0415	0.0283
Trypanosoma brucei	glucose transporter 2A	0.0036	0.0543	0.5527
Loa Loa (eye worm)	RNA binding protein	0.0069	0.1232	0.348
Leishmania major	protein kinase, putative	0.0036	0.0545	0.554
Echinococcus multilocularis	calcium:calmodulin dependent protein kinase type	0.0036	0.0545	0.0589
Trichomonas vaginalis	sugar transporter, putative	0.0016	0.0136	0.0135
Loa Loa (eye worm)	major facilitator superfamily transporter	0.0016	0.0136	0.0385
Mycobacterium tuberculosis	Possible conserved lipoprotein LpqK	0.0041	0.0643	0.1166
Mycobacterium ulcerans	prolyl-tRNA synthetase	0.0012	0.0053	0.0175
Loa Loa (eye worm)	hypothetical protein	0.0026	0.0335	0.0945
Onchocerca volvulus		0.0016	0.0136	0.0152
Trichomonas vaginalis	sugar transporter, putative	0.0016	0.0136	0.0135
Loa Loa (eye worm)	hypothetical protein	0.0041	0.0643	0.1815
Brugia malayi	lysyl-tRNA synthetase	0.0026	0.0335	0.0944
Mycobacterium tuberculosis	Conserved protein	0.0041	0.0643	0.1166
Trypanosoma brucei	myo-inositol/proton symporter (MIT)	0.0016	0.0136	0.1034
Trypanosoma cruzi	hexose transporter, putative	0.0016	0.0136	0.1034
Schistosoma mansoni	lysyl-tRNA synthetase	0.0026	0.0335	0.0319
Plasmodium falciparum	hexose transporter	0.0116	0.22	0.2092
Loa Loa (eye worm)	hypothetical protein	0.0035	0.0519	0.1465
Onchocerca volvulus		0.0016	0.0136	0.0152
Trypanosoma brucei	PAB1-binding protein , putative	0.003	0.0415	0.4116
Echinococcus granulosus	General substrate transporter	0.0099	0.1862	0.2022
Mycobacterium ulcerans	hypothetical protein	0.0041	0.0643	1
Plasmodium vivax	calcium-dependent protein kinase 1, putative	0.0036	0.0545	0.0414
Brugia malayi	Calcium/calmodulin-dependent protein kinase type II alpha chain	0.0036	0.0545	0.1537
Echinococcus granulosus	calcium dependent protein kinase	0.0033	0.0488	0.0528
Mycobacterium tuberculosis	Lysyl-tRNA synthetase 2 LysX	0.0022	0.0254	0.041
Loa Loa (eye worm)	hypothetical protein	0.0016	0.0136	0.0385
Brugia malayi	beta-lactamase	0.0041	0.0643	0.1815
Schistosoma mansoni	cellular tumor antigen P53	0.0058	0.1009	0.1056
Trypanosoma cruzi	hexose transporter, putative	0.0036	0.0543	0.5527
Brugia malayi	intracellular kinase	0.0055	0.0949	0.2678
Trichomonas vaginalis	sugar transporter, putative	0.0036	0.0543	0.2081
Trichomonas vaginalis	CAMK family protein kinase	0.0036	0.0545	0.2087
Echinococcus granulosus	calcium:calmodulin dependent protein kinase type	0.0036	0.0545	0.0589
Mycobacterium ulcerans	sugar-transport integral membrane protein SugI	0.0016	0.0136	0.1561
Trichomonas vaginalis	lysyl-tRNA synthetase, putative	0.0026	0.0335	0.1083
Trichomonas vaginalis	alpha-glucosidase, putative	0.004	0.0629	0.2492
Trichomonas vaginalis	neutral alpha-glucosidase ab precursor, putative	0.004	0.0629	0.2492
Entamoeba histolytica	prolyl-tRNA synthetase, putative	0.0035	0.0519	0.4889
Echinococcus multilocularis	protein kinase shaggy	0.0055	0.0949	0.1029
Echinococcus multilocularis	General substrate transporter	0.0099	0.1862	0.2022
Trichomonas vaginalis	sugar transporter, putative	0.0016	0.0136	0.0135
Loa Loa (eye worm)	sugar transporter	0.0116	0.22	0.6211
Toxoplasma gondii	calcium-dependent protein kinase CDPK3	0.0036	0.0545	0.0767
Schistosoma mansoni	tar DNA-binding protein	0.0069	0.1232	0.13
Brugia malayi	hypothetical protein	0.0016	0.0136	0.0384
Brugia malayi	beta-lactamase family protein	0.0041	0.0643	0.1815
Schistosoma mansoni	tar DNA-binding protein	0.0069	0.1232	0.13
Entamoeba histolytica	protein kinase, putative	0.0036	0.0545	0.5193
Schistosoma mansoni	cpg binding protein	0.0034	0.0496	0.0495
Loa Loa (eye worm)	RNA recognition domain-containing protein domain-containing protein	0.0069	0.1232	0.348
Trypanosoma brucei	lysyl-tRNA synthetase, putative	0.0026	0.0335	0.3223
Trichomonas vaginalis	sugar transporter, putative	0.0016	0.0136	0.0135
Trypanosoma brucei	THT1 - hexose transporter, putative	0.0036	0.0543	0.5527
Loa Loa (eye worm)	sugar transporter	0.0016	0.0136	0.0385
Loa Loa (eye worm)	cytochrome P450 family protein	0.0021	0.0244	0.0689
Toxoplasma gondii	LsmAD domain-containing protein	0.003	0.0415	0.0569
Schistosoma mansoni	family S12 unassigned peptidase (S12 family)	0.0041	0.0643	0.0656
Plasmodium falciparum	calcium-dependent protein kinase 5	0.0036	0.0545	0.0414
Plasmodium falciparum	lysine--tRNA ligase	0.0026	0.0335	0.0201
Plasmodium falciparum	ataxin-2 like protein, putative	0.003	0.0415	0.0283
Schistosoma mansoni	tar DNA-binding protein	0.0069	0.1232	0.13
Loa Loa (eye worm)	hypothetical protein	0.0028	0.0384	0.1084
Brugia malayi	Cytochrome P450 family protein	0.0021	0.0244	0.0688
Brugia malayi	major facilitator superfamily protein	0.0016	0.0136	0.0384
Giardia lamblia	Lysyl-tRNA synthetase	0.0026	0.0335	0.2442
Trypanosoma brucei	glucose transporter, putative	0.0036	0.0543	0.5527
Onchocerca volvulus		0.0055	0.0949	0.453
Trichomonas vaginalis	sugar transporter, putative	0.0016	0.0136	0.0135
Mycobacterium leprae	Probable lysyl-tRNA synthase LysS (lysine--tRNA ligase 1) (LysRS 1) (lysine translase)	0.0022	0.0254	0.3518
Schistosoma mansoni	alpha-glucosidase	0.0155	0.3021	0.3253
Trichomonas vaginalis	conserved hypothetical protein	0.0016	0.0136	0.0135
Trypanosoma cruzi	prolyl-tRNA synthetase, putative	0.004	0.0638	0.6576
Mycobacterium tuberculosis	Probable conserved integral membrane transport protein	0.0016	0.0136	0.0182
Echinococcus multilocularis	dnaJ subfamily B	0.0452	0.9196	1
Mycobacterium tuberculosis	Probable hydrolase	0.0041	0.0643	0.1166
Trichomonas vaginalis	conserved hypothetical protein	0.0116	0.22	1
Echinococcus granulosus	tar DNA binding protein	0.0069	0.1232	0.1338
Echinococcus granulosus	calcium:calmodulin dependent protein kinase type	0.0036	0.0545	0.0589
Schistosoma mansoni	alpha glucosidase	0.004	0.0629	0.0641
Leishmania major	hypothetical protein, conserved	0.003	0.0415	0.4116
Echinococcus granulosus	solute carrier family 22	0.0016	0.0136	0.0145
Loa Loa (eye worm)	CMGC/GSK protein kinase	0.0055	0.0949	0.2678
Trichomonas vaginalis	sugar transporter, putative	0.0036	0.0543	0.2081
Trichomonas vaginalis	sugar transporter, putative	0.0016	0.0136	0.0135
Leishmania major	hypothetical protein, conserved	0.0041	0.0643	0.6627
Loa Loa (eye worm)	hypothetical protein	0.0016	0.0136	0.0385
Echinococcus multilocularis	lysyl tRNA synthetase	0.0026	0.0335	0.0361
Echinococcus granulosus	solute carrier family 2 facilitated glucose	0.0116	0.22	0.239
Loa Loa (eye worm)	cytochrome P450 family protein	0.0021	0.0244	0.0689
Trichomonas vaginalis	conserved hypothetical protein	0.0016	0.0136	0.0135
Trypanosoma brucei	glucose transporter 1E	0.0036	0.0543	0.5527
Trypanosoma brucei	glucose transporter, putative	0.0036	0.0543	0.5527
Echinococcus multilocularis		0.0012	0.0043	0.0043
Echinococcus granulosus	calcium:calmodulin dependent protein kinase type	0.0036	0.0545	0.0589
Echinococcus granulosus	solute carrier family 2 facilitated glucose	0.0116	0.22	0.239
Loa Loa (eye worm)	hypothetical protein	0.0058	0.1009	0.2848
Brugia malayi	hypothetical protein	0.0019	0.0197	0.0555
Trichomonas vaginalis	maltase-glucoamylase, putative	0.004	0.0629	0.2492
Schistosoma mansoni	hypothetical protein	0.0116	0.22	0.2357
Trichomonas vaginalis	sugar transporter, putative	0.0016	0.0136	0.0135
Loa Loa (eye worm)	hypothetical protein	0.0015	0.0108	0.0305
Brugia malayi	Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative	0.0041	0.0643	0.1815
Trypanosoma cruzi	hypothetical protein, conserved	0.0041	0.0643	0.6627
Onchocerca volvulus		0.0016	0.0136	0.0152
Leishmania major	prolyl-tRNA synthetase, putative,bifunctional aminoacyl-tRNA synthetase, putative	0.004	0.0638	0.6576
Brugia malayi	major facilitator superfamily protein	0.0016	0.0136	0.0384
Trypanosoma brucei	calcium/calmodulin-dependent protein kinase, putative	0.0036	0.0545	0.554
Schistosoma mansoni	glucose transport protein	0.0116	0.22	0.2357
Echinococcus multilocularis	calcium:calmodulin dependent protein kinase type	0.0036	0.0545	0.0589
Toxoplasma gondii	cell-cycle-associated protein kinase MAPK, putative	0.0187	0.3689	0.5567
Echinococcus granulosus	tumor protein p63	0.0398	0.8067	0.8772
Schistosoma mansoni	glycogen synthase kinase 3-related (gsk3) (cmgc group III)	0.0055	0.0949	0.099
Loa Loa (eye worm)	hypothetical protein	0.0016	0.0136	0.0385
Brugia malayi	Sugar transporter family protein	0.0116	0.22	0.6211
Mycobacterium tuberculosis	Conserved protein	0.0041	0.0643	0.1166
Mycobacterium ulcerans	lysyl-tRNA synthetase	0.0026	0.0335	0.4864
Leishmania major	glucose transporter, lmgt3	0.0036	0.0543	0.5527
Trichomonas vaginalis	sugar transporter, putative	0.0016	0.0136	0.0135
Trichomonas vaginalis	sucrase-isomaltase, putative	0.004	0.0629	0.2492
Trichomonas vaginalis	sugar transporter, putative	0.0016	0.0136	0.0135
Trichomonas vaginalis	sugar transporter, putative	0.0016	0.0136	0.0135
Loa Loa (eye worm)	transcription factor SMAD2	0.013	0.2501	0.7061
Trypanosoma brucei	THT1 - hexose transporter, putative	0.0036	0.0543	0.5527
Brugia malayi	Sugar transporter family protein	0.0016	0.0136	0.0384
Trichomonas vaginalis	sugar transporter, putative	0.0016	0.0136	0.0135
Schistosoma mansoni	serine/threonine protein kinase	0.0036	0.0545	0.0548
Loa Loa (eye worm)	hypothetical protein	0.0016	0.0136	0.0385
Trypanosoma cruzi	hypothetical protein, conserved	0.0041	0.0643	0.6627
Toxoplasma gondii	glycosyl hydrolase, family 31 protein	0.004	0.0629	0.0896
Loa Loa (eye worm)	hypothetical protein	0.0016	0.0136	0.0385
Onchocerca volvulus		0.0041	0.0643	0.2883
Schistosoma mansoni	protein kinase	0.0036	0.0545	0.0548
Loa Loa (eye worm)	hypothetical protein	0.0016	0.0136	0.0385
Leishmania major	glycosyl hydrolase-like protein	0.0015	0.0108	0.0722
Trichomonas vaginalis	sugar transporter, putative	0.0016	0.0136	0.0135
Leishmania major	lysyl-tRNA synthetase, putative	0.0026	0.0335	0.3223
Trichomonas vaginalis	glucose transporter, putative	0.0036	0.0543	0.2081
Loa Loa (eye worm)	CMGC/GSK protein kinase	0.0055	0.0949	0.2678
Mycobacterium ulcerans	sugar transporter	0.0016	0.0136	0.1561
Onchocerca volvulus		0.0016	0.0136	0.0152
Echinococcus granulosus	solute carrier family 22	0.0016	0.0136	0.0145
Echinococcus granulosus	dnaJ subfamily B	0.0452	0.9196	1
Trichomonas vaginalis	myo-inositol transporter, putative	0.0016	0.0136	0.0135
Trichomonas vaginalis	penicillin-binding protein, putative	0.0041	0.0643	0.2557
Onchocerca volvulus		0.0016	0.0136	0.0152
Echinococcus multilocularis	solute carrier family 2, facilitated glucose	0.0116	0.22	0.239
Trypanosoma cruzi	hypothetical protein, conserved	0.004	0.0629	0.6476
Loa Loa (eye worm)	cytochrome P450	0.0012	0.0043	0.012
Trypanosoma cruzi	PAB1-binding protein , putative	0.003	0.0415	0.4116
Leishmania major	glucose transporter, lmgt2	0.0036	0.0543	0.5527
Trypanosoma cruzi	glycosyl hydrolase-like protein, putative	0.0015	0.0108	0.0722
Echinococcus multilocularis	solute carrier family 2 facilitated glucose	0.0116	0.22	0.239
Trypanosoma brucei	bifunctional aminoacyl-tRNA synthetase, putative	0.004	0.0638	0.6576
Trypanosoma cruzi	glycosyl hydrolase-like protein, putative	0.0015	0.0108	0.0722
Brugia malayi	cytochrome P450	0.0012	0.0043	0.012
Trypanosoma brucei	THT1 - hexose transporter, putative	0.0036	0.0543	0.5527
Schistosoma mansoni	glucose transport protein	0.0116	0.22	0.2357
Brugia malayi	Cytochrome P450 family protein	0.0021	0.0244	0.0688
Trichomonas vaginalis	sugar transporter, putative	0.0016	0.0136	0.0135
Loa Loa (eye worm)	hypothetical protein	0.0041	0.0643	0.1815
Toxoplasma gondii	calcium-dependent protein kinase CDPK2A	0.0036	0.0545	0.0767
Trichomonas vaginalis	CMGC family protein kinase	0.0055	0.0949	0.4018
Loa Loa (eye worm)	CAMK/CAMK2 protein kinase	0.0036	0.0545	0.1537
Entamoeba histolytica	protein kinase, putative	0.0036	0.0545	0.5193
Entamoeba histolytica	hypothetical protein	0.0026	0.0335	0.2696
Schistosoma mansoni	cpg binding protein	0.0032	0.0459	0.0454
Plasmodium falciparum	calcium-dependent protein kinase 2	0.0036	0.0545	0.0414
Brugia malayi	Sugar transporter family protein	0.0016	0.0136	0.0384
Loa Loa (eye worm)	hypothetical protein	0.0016	0.0136	0.0385
Trypanosoma brucei	hypothetical protein, conserved	0.0041	0.0643	0.6627
Schistosoma mansoni	family S12 unassigned peptidase (S12 family)	0.0041	0.0643	0.0656
Mycobacterium tuberculosis	Probable conserved lipoprotein	0.0041	0.0643	0.1166
Plasmodium vivax	hypothetical protein, conserved	0.0041	0.0643	0.0514
Trypanosoma brucei	glucose transporter, putative	0.0036	0.0543	0.5527
Trichomonas vaginalis	sugar transporter, putative	0.0016	0.0136	0.0135
Giardia lamblia	Prolyl-tRNA synthetase	0.0035	0.0519	0.4712
Trichomonas vaginalis	glucose transporter, putative	0.0036	0.0543	0.2081
Trypanosoma cruzi	hexose transporter	0.0036	0.0543	0.5527
Mycobacterium leprae	conserved hypothetical protein	0.0041	0.0643	1
Treponema pallidum	prolyl-tRNA synthetase	0.0012	0.0053	0.5
Loa Loa (eye worm)	bifunctional aminoacyl-tRNA synthetase	0.0014	0.0094	0.0266
Giardia lamblia	Kinase, CMGC GSK	0.0055	0.0949	1
Mycobacterium leprae	Probable lipase LipE	0.0041	0.0643	1
Loa Loa (eye worm)	beta-LACTamase domain containing family member	0.0041	0.0643	0.1815
Loa Loa (eye worm)	hypothetical protein	0.0016	0.0136	0.0385
Trypanosoma cruzi	sugar transporter, putative	0.0016	0.0136	0.1034
Trypanosoma brucei	glucosidase, putative	0.004	0.0629	0.6476
Loa Loa (eye worm)	hypothetical protein	0.0016	0.0136	0.0385
Trichomonas vaginalis	sugar transporter, putative	0.0016	0.0136	0.0135
Trichomonas vaginalis	conserved hypothetical protein	0.0016	0.0136	0.0135
Onchocerca volvulus	Putative transporter	0.0016	0.0136	0.0152
Echinococcus multilocularis	calcium:calmodulin dependent protein kinase type	0.0036	0.0545	0.0589
Mycobacterium ulcerans	esterase/lipase LipP	0.0041	0.0643	1
Echinococcus granulosus	glutamyl tRNA synthetase cytoplasmic	0.0035	0.0519	0.0562
Schistosoma mansoni	sugar transporter	0.0016	0.0136	0.0102
Trichomonas vaginalis	sugar transporter, putative	0.0016	0.0136	0.0135
Plasmodium vivax	calcium-dependent protein kinase, putative	0.0036	0.0545	0.0414
Trypanosoma cruzi	prolyl-tRNA synthetase, putative	0.004	0.0638	0.6576
Onchocerca volvulus		0.0058	0.1009	0.4855
Echinococcus multilocularis	calcium:calmodulin dependent protein kinase type	0.0036	0.0545	0.0589
Trypanosoma cruzi	cytochrome P450, putative	0.0021	0.0244	0.2222
Echinococcus multilocularis	tar DNA binding protein	0.0069	0.1232	0.1338
Plasmodium falciparum	calcium-dependent protein kinase 3	0.0036	0.0545	0.0414
Brugia malayi	Major Facilitator Superfamily protein	0.0016	0.0136	0.0384
Schistosoma mansoni	tar DNA-binding protein	0.0069	0.1232	0.13
Brugia malayi	beta-lactamase family protein	0.0041	0.0643	0.1815
Loa Loa (eye worm)	hypothetical protein	0.0041	0.0643	0.1815
Brugia malayi	Major Facilitator Superfamily protein	0.0016	0.0136	0.0384
Brugia malayi	CXXC zinc finger family protein	0.0032	0.0459	0.1294
Trichomonas vaginalis	sugar transporter, putative	0.0016	0.0136	0.0135
Toxoplasma gondii	lysine-tRNA ligase	0.0026	0.0335	0.0446
Loa Loa (eye worm)	CXXC zinc finger family protein	0.0032	0.0459	0.1295
Mycobacterium ulcerans	lysyl-tRNA synthetase	0.0026	0.0335	0.4864
Trypanosoma brucei	glucose transporter, putative	0.0036	0.0543	0.5527
Echinococcus granulosus	synaptic vesicle 2 protein	0.0016	0.0136	0.0145
Trichomonas vaginalis	conserved hypothetical protein	0.0016	0.0136	0.0135
Plasmodium falciparum	mitogen-activated protein kinase 2	0.0187	0.3689	0.3602
Leishmania major	glucose transporter/membrane transporter D2, putative	0.0036	0.0543	0.5527
Schistosoma mansoni	sugar transporter	0.0016	0.0136	0.0102
Schistosoma mansoni	mixed-lineage leukemia protein mll	0.0067	0.1198	0.1263
Echinococcus multilocularis	solute carrier family 2 facilitated glucose	0.0116	0.22	0.239
Plasmodium vivax	hexose transporter	0.0116	0.22	0.2092
Loa Loa (eye worm)	hypothetical protein	0.0016	0.0136	0.0385
Schistosoma mansoni	protein kinase	0.0036	0.0545	0.0548
Loa Loa (eye worm)	hypothetical protein	0.0036	0.0545	0.1537
Echinococcus granulosus	calcium:calmodulin dependent protein kinase type 1	0.0036	0.0545	0.0589
Plasmodium vivax	CDK-related protein kinase 6, putative	0.0491	1	1
Trypanosoma brucei	cytochrome P450, putative	0.0021	0.0244	0.2222
Trichomonas vaginalis	prolyl-tRNA synthetase, putative	0.0035	0.0519	0.1965
Trypanosoma brucei	sugar transporter, putative	0.0016	0.0136	0.1034
Plasmodium vivax	mitogen-activated protein kinase 2, putative	0.0187	0.3689	0.3602
Echinococcus multilocularis	calcium dependent protein kinase	0.0033	0.0488	0.0528
Schistosoma mansoni	cpg binding protein	0.0034	0.0496	0.0495
Brugia malayi	hypothetical protein	0.0016	0.0136	0.0384
Trichomonas vaginalis	conserved hypothetical protein	0.0036	0.0543	0.2081
Brugia malayi	Glycosyl hydrolases family 31 protein	0.018	0.3542	1
Loa Loa (eye worm)	hypothetical protein	0.0016	0.0136	0.0385
Mycobacterium tuberculosis	Lysyl-tRNA synthetase 1 LysS (lysine--tRNA ligase 1) (LysRS 1) (lysine translase)	0.0022	0.0254	0.041
Loa Loa (eye worm)	beta-lactamase	0.0041	0.0643	0.1815
Trichomonas vaginalis	sugar transporter, putative	0.0016	0.0136	0.0135
Echinococcus multilocularis	glycogen synthase kinase 3 beta	0.0055	0.0949	0.1029
Toxoplasma gondii	sugar transporter ST1	0.0016	0.0136	0.0143
Trichomonas vaginalis	sugar transporter, putative	0.0016	0.0136	0.0135
Onchocerca volvulus		0.0032	0.0459	0.1889
Toxoplasma gondii	histone lysine methyltransferase SET1	0.006	0.1049	0.1536
Trichomonas vaginalis	conserved hypothetical protein	0.0036	0.0543	0.2081
Echinococcus multilocularis	solute carrier family 22	0.0016	0.0136	0.0145
Echinococcus multilocularis	solute carrier family 22	0.0016	0.0136	0.0145
Plasmodium falciparum	glycogen synthase kinase 3	0.0055	0.0949	0.0824
Trichomonas vaginalis	alpha-glucosidase, putative	0.004	0.0629	0.2492
Trichomonas vaginalis	sugar transporter, putative	0.0016	0.0136	0.0135
Echinococcus multilocularis	glutamyl tRNA synthetase cytoplasmic	0.0035	0.0519	0.0562
Echinococcus multilocularis	tumor protein p63	0.0398	0.8067	0.8772
Leishmania major	myo-inositol/proton symporter (MIT)	0.0016	0.0136	0.1034
Leishmania major	prolyl-tRNA synthetase, putative,bifunctional aminoacyl-tRNA synthetase, putative	0.004	0.0638	0.6576
Plasmodium falciparum	proline--tRNA ligase	0.004	0.0638	0.0509
Trypanosoma cruzi	hexose transporter, putative	0.0036	0.0543	0.5527
Loa Loa (eye worm)	histone methyltransferase	0.001	0.0003	0.0008
Schistosoma mansoni	glutamyl-tRNA synthetase cytoplasmic (glutamate--tRNA ligase) (glurs)	0.0035	0.0519	0.052
Loa Loa (eye worm)	hypothetical protein	0.0016	0.0136	0.0385
Schistosoma mansoni	sugar transporter	0.0016	0.0136	0.0102
Loa Loa (eye worm)	calcium/calmodulin-dependent protein kinase ID	0.0036	0.0545	0.1537
Trypanosoma cruzi	glucose transporter, putative	0.0016	0.0136	0.1034
Trichomonas vaginalis	sugar transport protein, putative	0.0016	0.0136	0.0135

Activities

Activity type	Activity value	Assay description	Source	Reference
Inhibition (functional)	= 43 %	Antagonist activity at human P2X7 receptor expressed in HEK293 cells assessed as inhibition of BzATP-induced fluorescent ethidium accumulation	ChEMBL.	19800793

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: CHEMBL584106

Bibliographic References

1 literature reference was collected for this gene.

If you have references for this compound, please enter them in a user comment (below) or Contact us.

Detailed information for compound 1088917