TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 303.186 | Formula: C16H12Cl2N2
H donors: 0 H acceptors: 1 LogP: 4.75 Rotable bonds: 3
Rule of 5 violations (Lipinski): 1
SMILES: Clc1c(Cl)cccc1c1ccnn1Cc1ccccc1
InChi: 1S/C16H12Cl2N2/c17-14-8-4-7-13(16(14)18)15-9-10-19-20(15)11-12-5-2-1-3-6-12/h1-10H,11H2
InChiKey: JLXNQPOHHXWBCA-UHFFFAOYSA-N

Network

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Target Layer

Model Organisms

Species	Viewmode
Arabidopsis thaliana
Caenorhabditis elegans
Dictyostelium discoideum
Drosophila melanogaster
Escherichia coli
Homo sapiens
Mus musculus
Oryza sativa
Saccharomyces cerevisiae
Schmidtea mediterranea
Other organisms

TDR Pathogens:

Species	Viewmode
Brugia malayi
Chlamydia trachomatis
Echinococcus granulosus
Entamoeba histolytica
Echinococcus multilocularis
Giardia lamblia
Leishmania major
Loa Loa (eye worm)
Mycobacterium leprae
Mycobacterium tuberculosis
Mycobacterium ulcerans
Onchocerca volvulus
Plasmodium falciparum
Plasmodium vivax
Schistosoma mansoni
Trypanosoma brucei
Trypanosoma cruzi
Toxoplasma gondii
Treponema pallidum
Trichomonas vaginalis
Wolbachia endosymbiont of Brugia malayi

Other Pathogens:

Species	Viewmode
Babesia bovis
Candida albicans
Cryptosporidium hominis
Cryptosporidium parvum
Leishmania braziliensis
Leishmania donovani
Leishmania infantum
Leishmania mexicana
Neospora caninum
Plasmodium berghei
Plasmodium knowlesi
Plasmodium yoelii
Schistosoma japonicum
Trypanosoma brucei gambiense
Trypanosoma congolense
Theileria parva

Compound Layer

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Clustering layers

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Synonyms

No synonyms found for this compound

Targets

Known targets for this compound

Species	Target name	Source	Bibliographic reference
Homo sapiens	purinergic receptor P2X, ligand-gated ion channel, 7	Starlite/ChEMBL	References

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	p2X purinoceptor 4	0.0082	0.1188	0.2923
Schistosoma mansoni	P2X receptor subunit	0.0082	0.1188	0.1188
Echinococcus multilocularis	serine:threonine protein kinase PAK 4	0.0191	0.3191	0.7849
Schistosoma mansoni	tyrosine kinase	0.0019	0.0039	0.0039
Entamoeba histolytica	cell division protein kinase 2, putative	0.0053	0.0659	0.3549
Schistosoma mansoni	serine/threonine protein kinase	0.0068	0.093	0.093
Trichomonas vaginalis	AGC family protein kinase	0.0021	0.0073	0.0387
Trypanosoma cruzi	cdc2-related kinase 3	0.0053	0.0659	0.5365
Leishmania major	protein kinase, putative	0.0068	0.093	1
Plasmodium falciparum	RAC-beta serine/threonine protein kinase	0.0036	0.0346	0.0603
Echinococcus granulosus	NDR protein kinase	0.0021	0.0073	0.0179
Echinococcus multilocularis	serine:threonine protein kinase PAK 3	0.0023	0.0107	0.0262
Trichomonas vaginalis	CMGC family protein kinase	0.0053	0.0659	0.3503
Trichomonas vaginalis	AGC family protein kinase	0.0052	0.063	0.335
Loa Loa (eye worm)	AGC/PKN protein kinase	0.0021	0.0073	0.0073
Trypanosoma cruzi	casein kinase, putative	0.0048	0.0556	0.3602
Trypanosoma cruzi	casein kinase, putative	0.0048	0.0556	0.3602
Giardia lamblia	Kinase, NEK	0.012	0.1881	1
Echinococcus multilocularis	casein kinase I alpha	0.0048	0.0556	0.1368
Brugia malayi	serine/threonine protein kinase 6	0.0068	0.093	0.093
Echinococcus multilocularis	serine:threonine protein kinase PAK 3	0.0023	0.0107	0.0262
Entamoeba histolytica	protein kinase, putative	0.0023	0.0107	0.0574
Trypanosoma cruzi	aurora B kinase, putative	0.0068	0.093	1
Echinococcus granulosus	ribosomal protein S6 kinase alpha 3	0.0021	0.0073	0.0179
Toxoplasma gondii	AGC kinase	0.0052	0.063	0.2343
Loa Loa (eye worm)	calcium/calmodulin-dependent protein kinase ID	0.0031	0.0247	0.0247
Echinococcus granulosus	protein kinase c iota type	0.0021	0.0073	0.0179
Entamoeba histolytica	protein kinase, putative	0.0052	0.063	0.3393
Loa Loa (eye worm)	CK1/CK1/CK1-A protein kinase	0.0048	0.0556	0.0556
Trypanosoma brucei	cdc2-related kinase 3	0.0053	0.0659	0.6034
Echinococcus granulosus	serine:threonine protein kinase PAK 3	0.0023	0.0107	0.0262
Loa Loa (eye worm)	hypothetical protein	0.0031	0.0247	0.0247
Trichomonas vaginalis	AGC family protein kinase	0.0068	0.093	0.4941
Schistosoma mansoni	serine/threonine protein kinase	0.0021	0.0073	0.0073
Giardia lamblia	Kinase, AGC PKA	0.0036	0.0346	0.1348
Trypanosoma cruzi	cdc2-related kinase 1	0.0053	0.0659	0.5365
Trichomonas vaginalis	STE family protein kinase	0.012	0.1881	1
Trichomonas vaginalis	STE family protein kinase	0.0023	0.0107	0.0566
Echinococcus multilocularis	cyclin dependent kinase 1	0.0053	0.0659	0.1621
Trichomonas vaginalis	STE family protein kinase	0.0118	0.1857	0.9872
Echinococcus multilocularis	tyrosine protein kinase Abl	0.0104	0.1602	0.3941
Echinococcus granulosus	casein kinase I delta	0.0048	0.0556	0.1368
Echinococcus granulosus	p21 activated protein kinase 1 Dpak1	0.0023	0.0107	0.0262
Toxoplasma gondii	cell-cycle-associated protein kinase CDK, putative	0.0053	0.0659	0.2519
Entamoeba histolytica	serine/threonine- protein kinase 6, putative	0.0068	0.093	0.5006
Schistosoma mansoni	tyrosine kinase	0.0231	0.3927	0.3927
Loa Loa (eye worm)	CMGC/CDK/CDK5 protein kinase	0.0053	0.0659	0.0659
Echinococcus multilocularis	cyclin dependent kinase 1	0.0053	0.0659	0.1621
Loa Loa (eye worm)	AGC/PKC/ETA protein kinase	0.0021	0.0073	0.0073
Plasmodium vivax	casein kinase 1, putative	0.0048	0.0556	0.189
Echinococcus multilocularis	serine:threonine protein kinase N2	0.0021	0.0073	0.0179
Brugia malayi	serine/threonine kinase 12	0.0068	0.093	0.093
Echinococcus multilocularis	PAK box P21 Rho binding	0.0023	0.0107	0.0262
Toxoplasma gondii	NIMA-related protein kinase NIMA1	0.012	0.1881	1
Trichomonas vaginalis	CAMK family protein kinase	0.0031	0.0247	0.1315
Brugia malayi	Protein kinase domain containing protein	0.0021	0.0073	0.0073
Echinococcus granulosus	5'partial\|cyclin dependent kinase 1	0.0053	0.0659	0.1621
Brugia malayi	cell division control protein 2 homolog	0.0053	0.0659	0.0659
Echinococcus multilocularis	serine threonine protein kinase	0.0021	0.0073	0.0179
Echinococcus granulosus	aurora kinase A	0.0068	0.093	0.2287
Plasmodium vivax	rac-beta serine/threonine protein kinase, putative	0.0036	0.0346	0.0603
Schistosoma mansoni	serine/threonine protein kinase	0.0053	0.0659	0.0659
Loa Loa (eye worm)	STE/STE20/PAKB protein kinase	0.0208	0.3509	0.3509
Trichomonas vaginalis	CK1 family protein kinase	0.0048	0.0556	0.2956
Trypanosoma cruzi	casein kinase, delta isoform, putative	0.0042	0.045	0.1777
Trichomonas vaginalis	AGC family protein kinase	0.0068	0.093	0.4941
Echinococcus multilocularis	protein kinase c iota type	0.0021	0.0073	0.0179
Entamoeba histolytica	p21-activated kinase	0.0023	0.0107	0.0574
Echinococcus granulosus	serine:threonine protein kinase PAK 4	0.0191	0.3191	0.7849
Loa Loa (eye worm)	CAMK/CAMK2 protein kinase	0.0031	0.0247	0.0247
Echinococcus multilocularis	ribosomal protein s6 kinase beta 1	0.0021	0.0073	0.0179
Echinococcus multilocularis	calcium:calmodulin dependent protein kinase type	0.0031	0.0247	0.0609
Echinococcus multilocularis	serine threonine protein kinase nrc serine threonine protein kinase gad	0.0036	0.0346	0.0851
Brugia malayi	Protein kinase domain containing protein	0.0021	0.0073	0.0073
Trichomonas vaginalis	AGC family protein kinase	0.0052	0.063	0.335
Echinococcus multilocularis	serine:threonine protein kinase 12 B	0.0068	0.093	0.2287
Schistosoma mansoni	serine/threonine protein kinase	0.0021	0.0073	0.0073
Toxoplasma gondii	casein kinase I	0.0048	0.0556	0.189
Echinococcus granulosus	serine threonine protein kinase	0.0118	0.1857	0.4568
Echinococcus multilocularis	casein kinase I alpha	0.0048	0.0556	0.1368
Schistosoma mansoni	protein kinase	0.0068	0.093	0.093
Trypanosoma cruzi	casein kinase, putative	0.0048	0.0556	0.3602
Echinococcus granulosus	protein kinase C gamma type	0.0021	0.0073	0.0179
Brugia malayi	serine/threonine-protein kinase PAK 7	0.0208	0.3509	0.3509
Schistosoma mansoni	protein kinase	0.0031	0.0247	0.0247
Giardia lamblia	Aurora kinase	0.0068	0.093	0.4638
Schistosoma mansoni	P2X receptor subunit	0.0082	0.1188	0.1188
Giardia lamblia	Kinase, NEK	0.012	0.1881	1
Loa Loa (eye worm)	AUR protein kinase	0.0068	0.093	0.093
Entamoeba histolytica	protein kinase, putative	0.0052	0.063	0.3393
Echinococcus multilocularis	Glutaredoxin protein 5	0.003	0.0239	0.0589
Brugia malayi	protein kinase C II.	0.0021	0.0073	0.0073
Echinococcus granulosus	p2X purinoceptor 4	0.0082	0.1188	0.2923
Trichomonas vaginalis	AGC family protein kinase	0.0052	0.063	0.335
Schistosoma mansoni	protein kinase	0.0031	0.0247	0.0247
Trichomonas vaginalis	STE family protein kinase	0.0023	0.0107	0.0566
Entamoeba histolytica	casein kinase 1, putative	0.0048	0.0556	0.2995
Onchocerca volvulus		0.0048	0.0556	1
Schistosoma mansoni	protein kinase	0.0023	0.0107	0.0107
Schistosoma mansoni	protein kinase	0.0023	0.0107	0.0107
Schistosoma mansoni	serine/threonine protein kinase	0.0021	0.0073	0.0073
Echinococcus granulosus	cyclin dependent kinase 1	0.0053	0.0659	0.1621
Echinococcus granulosus	serine threonine protein kinase nrc	0.0036	0.0346	0.0851
Echinococcus multilocularis	rac serine:threonine kinase	0.0036	0.0346	0.0851
Brugia malayi	serine/threonine-protein kinase 6	0.0068	0.093	0.093
Trichomonas vaginalis	STE family protein kinase	0.0023	0.0107	0.0566
Plasmodium vivax	protein kinase Crk2	0.0053	0.0659	0.2519
Echinococcus granulosus	cyclin dependent kinase 5	0.0053	0.0659	0.1621
Entamoeba histolytica	protein kinase domain containing protein	0.0068	0.093	0.5006
Trypanosoma cruzi	cdc2-related kinase 1	0.0053	0.0659	0.5365
Echinococcus multilocularis	cyclin dependent kinase	0.0053	0.0659	0.1621
Echinococcus granulosus	p2X purinoceptor 4	0.0082	0.1188	0.2923
Plasmodium falciparum	serine/threonine protein kinase, putative	0.0068	0.093	0.4175
Echinococcus multilocularis	calcium:calmodulin dependent protein kinase type	0.0031	0.0247	0.0609
Echinococcus multilocularis	Protein kinase C, brain isozyme	0.0021	0.0073	0.0179
Echinococcus granulosus	p2X purinoceptor 4	0.0082	0.1188	0.2923
Giardia lamblia	Kinase, CMGC CDK	0.0053	0.0659	0.3113
Echinococcus granulosus	Glutaredoxin protein 5	0.003	0.0239	0.0589
Trichomonas vaginalis	AGC family protein kinase	0.0021	0.0073	0.0387
Trichomonas vaginalis	STE family protein kinase	0.0023	0.0107	0.0566
Brugia malayi	Tyrosine-protein kinase abl-1	0.0104	0.1602	0.1602
Brugia malayi	Calcium/calmodulin-dependent protein kinase type II alpha chain	0.0031	0.0247	0.0247
Loa Loa (eye worm)	AUR protein kinase	0.0068	0.093	0.093
Schistosoma mansoni	serine/threonine kinase	0.0021	0.0073	0.0073
Entamoeba histolytica	protein kinase, putative	0.0021	0.0073	0.0392
Brugia malayi	Protein kinase domain containing protein	0.0053	0.0659	0.0659
Echinococcus granulosus	Ribosomal protein S6 kinase beta 2	0.0021	0.0073	0.0179
Trichomonas vaginalis	CMGC family protein kinase	0.0053	0.0659	0.3503
Brugia malayi	Protein kinase domain containing protein	0.0052	0.063	0.063
Echinococcus multilocularis	casein kinase i	0.0048	0.0556	0.1368
Entamoeba histolytica	protein kinase, putative	0.0023	0.0107	0.0574
Trichomonas vaginalis	CMGC family protein kinase	0.0053	0.0659	0.3503
Entamoeba histolytica	protein kinase, putative	0.0068	0.093	0.5006
Entamoeba histolytica	protein kinase, putative	0.0023	0.0107	0.0574
Echinococcus multilocularis	serine threonine protein kinase	0.0118	0.1857	0.4568
Brugia malayi	Protein kinase domain	0.0023	0.0107	0.0107
Entamoeba histolytica	casein kinase, putative	0.0048	0.0556	0.2995
Echinococcus granulosus	casein kinase I alpha	0.0048	0.0556	0.1368
Plasmodium falciparum	casein kinase 1	0.0048	0.0556	0.189
Echinococcus granulosus	nervana 2	0.003	0.0239	0.0589
Plasmodium falciparum	NIMA related kinase 1	0.012	0.1881	1
Echinococcus granulosus	casein kinase I delta	0.0048	0.0556	0.1368
Trichomonas vaginalis	AGC family protein kinase	0.0021	0.0073	0.0387
Schistosoma mansoni	protein kinase	0.0048	0.0556	0.0556
Giardia lamblia	Kinase, CK1 Casein kinase	0.0048	0.0556	0.2533
Trichomonas vaginalis	AGC family protein kinase	0.0021	0.0073	0.0387
Trypanosoma cruzi	casein kinase, putative	0.0048	0.0556	0.3602
Echinococcus granulosus	serine/threonine protein kinase	0.0036	0.0346	0.0851
Echinococcus granulosus	serine:threonine protein kinase N2	0.0021	0.0073	0.0179
Entamoeba histolytica	protein kinase 2, putative	0.0036	0.0346	0.1862
Schistosoma mansoni	protein kinase	0.0031	0.0247	0.0247
Entamoeba histolytica	protein kinase, putative	0.0023	0.0107	0.0574
Echinococcus granulosus	cyclin dependent kinase	0.0053	0.0659	0.1621
Schistosoma mansoni	serine/threonine protein kinase	0.0561	1	1
Trypanosoma brucei	cdc2-related kinase 1	0.0053	0.0659	0.6034
Loa Loa (eye worm)	CAMK/CAMKL/CHK1 protein kinase	0.0561	1	1
Echinococcus granulosus	casein kinase I alpha	0.0048	0.0556	0.1368
Brugia malayi	casein kinase 1, delta	0.0048	0.0556	0.0556
Entamoeba histolytica	cell division protein kinase 2, putative	0.0053	0.0659	0.3549
Echinococcus multilocularis	p21 activated protein kinase 1 Dpak1	0.0023	0.0107	0.0262
Plasmodium vivax	serine/threonine protein kinase 6, putative	0.0068	0.093	0.4175
Brugia malayi	Tyrosine-protein kinase abl-1	0.0141	0.228	0.228
Leishmania major	cell division protein kinase 2,cdc2-related kinase	0.0053	0.0659	0.6034
Loa Loa (eye worm)	AGC/NDR protein kinase	0.0021	0.0073	0.0073
Echinococcus multilocularis	casein kinase I delta	0.0048	0.0556	0.1368
Schistosoma mansoni	serine/threonine protein kinase	0.0118	0.1857	0.1857
Loa Loa (eye worm)	hypothetical protein	0.0021	0.0073	0.0073
Entamoeba histolytica	serine/threonine protein kinase 6, putative	0.0068	0.093	0.5006
Loa Loa (eye worm)	AGC/AKT protein kinase	0.0052	0.063	0.063
Trichomonas vaginalis	AGC family protein kinase	0.0068	0.093	0.4941
Plasmodium vivax	serine/threonine-specific protein kinase, putative	0.0118	0.1857	0.9852
Echinococcus granulosus	Protein kinase C brain isozyme	0.0021	0.0073	0.0179
Trypanosoma cruzi	casein kinase, delta isoform, putative	0.0048	0.0556	0.3602
Trichomonas vaginalis	STE family protein kinase	0.0023	0.0107	0.0566
Schistosoma mansoni	serine/threonine protein kinase	0.0031	0.0247	0.0247
Echinococcus granulosus	casein kinase I alpha	0.0048	0.0556	0.1368
Trichomonas vaginalis	AGC family protein kinase	0.012	0.1881	1
Echinococcus multilocularis	cyclin dependent kinase 5	0.0053	0.0659	0.1621
Brugia malayi	p70 ribosomal S6 kinase beta	0.0052	0.063	0.063
Echinococcus multilocularis	protein kinase c epsilon type	0.0021	0.0073	0.0179
Loa Loa (eye worm)	CK1/CK1/CK1-A protein kinase	0.0048	0.0556	0.0556
Trypanosoma cruzi	casein kinase, putative	0.0048	0.0556	0.3602
Echinococcus granulosus	calcium:calmodulin dependent protein kinase	0.0036	0.0346	0.0851
Trichomonas vaginalis	AGC family protein kinase	0.0052	0.063	0.335
Entamoeba histolytica	PH domain containing protein kinase, putative	0.0036	0.0346	0.1862
Echinococcus granulosus	calcium:calmodulin dependent protein kinase type	0.0031	0.0247	0.0609
Echinococcus multilocularis	serine:threonine protein kinase N2	0.0021	0.0073	0.0179
Echinococcus multilocularis	nervana 2	0.003	0.0239	0.0589
Echinococcus multilocularis	calcium:calmodulin dependent protein kinase type	0.0031	0.0247	0.0609
Echinococcus multilocularis	nervana 2	0.003	0.0239	0.0589
Brugia malayi	Hr1 repeat family protein	0.0021	0.0073	0.0073
Schistosoma mansoni	serine/threonine protein kinase	0.0021	0.0073	0.0073
Schistosoma mansoni	serine/threonine protein kinase	0.0027	0.0174	0.0174
Loa Loa (eye worm)	AGC/DMPK/GEK protein kinase	0.0021	0.0073	0.0073
Echinococcus granulosus	nervana 2	0.003	0.0239	0.0589
Trypanosoma brucei	rac serine-threonine kinase, putative	0.0052	0.063	0.5611
Echinococcus multilocularis	aurora kinase A	0.0068	0.093	0.2287
Loa Loa (eye worm)	AGC/RSK/P70 protein kinase	0.0052	0.063	0.063
Entamoeba histolytica	protein kinase , putative	0.0068	0.093	0.5006
Loa Loa (eye worm)	CK1/CK1/CK1-D protein kinase	0.0048	0.0556	0.0556
Schistosoma mansoni	serine/threonine protein kinase	0.0021	0.0073	0.0073
Echinococcus granulosus	serine:threonine protein kinase 12 B	0.0068	0.093	0.2287
Echinococcus multilocularis	sodium:potassium dependent atpase beta subunit	0.003	0.0239	0.0589
Loa Loa (eye worm)	TK/ABL protein kinase	0.0239	0.4065	0.4065
Brugia malayi	casein kinase I	0.0048	0.0556	0.0556
Loa Loa (eye worm)	CMGC/CDK/CDC2 protein kinase	0.0053	0.0659	0.0659
Schistosoma mansoni	serine/threonine protein kinase	0.0021	0.0073	0.0073
Schistosoma mansoni	P2X receptor subunit	0.0082	0.1188	0.1188
Plasmodium falciparum	protein kinase 5	0.0053	0.0659	0.2519
Echinococcus granulosus	protein kinase c epsilon type	0.0021	0.0073	0.0179
Loa Loa (eye worm)	hypothetical protein	0.009	0.1329	0.1329
Trypanosoma brucei	aurora B kinase	0.0068	0.093	1
Loa Loa (eye worm)	AGC/RSK/MSK protein kinase	0.0021	0.0073	0.0073
Brugia malayi	Cam kinase protein 1	0.0031	0.0247	0.0247
Entamoeba histolytica	serine/threonine- protein kinase 6 , putative	0.0068	0.093	0.5006
Echinococcus granulosus	tyrosine protein kinase Lyn	0.0023	0.01	0.0246
Trichomonas vaginalis	AGC family protein kinase	0.0052	0.063	0.335
Trichomonas vaginalis	AGC family protein kinase	0.0068	0.093	0.4941
Plasmodium vivax	NIMA-related protein kinase (Pfnek-1), putative	0.012	0.1881	1
Entamoeba histolytica	protein kinase, putative	0.0031	0.0247	0.1332
Loa Loa (eye worm)	AGC/RSK/RSK protein kinase	0.0021	0.0073	0.0073
Schistosoma mansoni	serine/threonine-protein kinase	0.0036	0.0346	0.0346
Echinococcus granulosus	sodium:potassium dependent atpase beta subunit	0.003	0.0239	0.0589
Entamoeba histolytica	protein kinase, putative	0.0031	0.0247	0.1332
Echinococcus granulosus	calcium dependent protein kinase	0.0025	0.0141	0.0346
Echinococcus granulosus	casein kinase i	0.0048	0.0556	0.1368
Loa Loa (eye worm)	hypothetical protein	0.0047	0.0552	0.0552
Schistosoma mansoni	serine/threonine protein kinase	0.0053	0.0659	0.0659
Echinococcus multilocularis	calcium dependent protein kinase	0.0025	0.0141	0.0346
Echinococcus multilocularis	casein kinase I delta	0.0048	0.0556	0.1368
Plasmodium falciparum	protein kinase, putative	0.0118	0.1857	0.9852
Echinococcus multilocularis	p2X purinoceptor 4	0.0082	0.1188	0.2923
Echinococcus multilocularis	ribosomal protein S6 kinase alpha 3	0.0021	0.0073	0.0179
Echinococcus granulosus	ribosomal protein s6 kinase beta 1	0.0021	0.0073	0.0179
Entamoeba histolytica	protein kinase, putative	0.0052	0.063	0.3393
Schistosoma mansoni	serine/threonine protein kinase	0.0021	0.0073	0.0073
Giardia lamblia	Kinase, CMGC CDK	0.0053	0.0659	0.3113
Leishmania major	casein kinase, putative	0.0048	0.0556	0.4526
Schistosoma mansoni	serine/threonine-protein kinase	0.0036	0.0346	0.0346
Schistosoma mansoni	P2X receptor subunit	0.0082	0.1188	0.1188
Echinococcus multilocularis	Ribosomal protein S6 kinase beta 2	0.0021	0.0073	0.0179
Entamoeba histolytica	PH domain containing protein kinase, putative	0.0036	0.0346	0.1862
Trypanosoma cruzi	cdc2-related kinase 3	0.0053	0.0659	0.5365
Loa Loa (eye worm)	AUR protein kinase	0.0068	0.093	0.093
Echinococcus granulosus	calcium:calmodulin dependent protein kinase type 1	0.0031	0.0247	0.0609
Toxoplasma gondii	aurora kinase	0.0068	0.093	0.4175
Echinococcus multilocularis	calcium:calmodulin dependent protein kinase type	0.0031	0.0247	0.0609
Leishmania major	cell division related protein kinase 2,cdc2-related kinase	0.0053	0.0659	0.6034
Trypanosoma brucei	casein kinase I, isoform 2	0.0048	0.0556	0.4526
Trichomonas vaginalis	CK1 family protein kinase	0.0048	0.0556	0.2956
Schistosoma mansoni	atypical protein kinase C	0.0021	0.0073	0.0073
Echinococcus multilocularis	tyrosine protein kinase ABL1	0.0239	0.4065	1
Echinococcus multilocularis	casein kinase I alpha	0.0048	0.0556	0.1368
Echinococcus granulosus	tyrosine protein kinase ABL1	0.0239	0.4065	1
Entamoeba histolytica	protein kinase, putative	0.0068	0.093	0.5006
Loa Loa (eye worm)	CMGC/CDK/CDC2 protein kinase	0.0053	0.0659	0.0659
Entamoeba histolytica	protein kinase, putative	0.0118	0.1857	1
Echinococcus multilocularis	p2X purinoceptor 4	0.0082	0.1188	0.2923
Trichomonas vaginalis	AGC family protein kinase	0.0052	0.063	0.335
Echinococcus granulosus	calcium:calmodulin dependent protein kinase type	0.0031	0.0247	0.0609
Loa Loa (eye worm)	STE/STE20/YSK protein kinase	0.0118	0.1857	0.1857
Trichomonas vaginalis	AGC family protein kinase	0.0052	0.063	0.335
Giardia lamblia	Kinase, NEK	0.012	0.1881	1
Echinococcus granulosus	serine:threonine protein kinase PAK 3	0.0023	0.0107	0.0262
Trichomonas vaginalis	CK1 family protein kinase	0.0048	0.0556	0.2956
Echinococcus multilocularis	serine:threonine protein kinase 38	0.0021	0.0073	0.0179
Schistosoma mansoni	serine/threonine protein kinase	0.0048	0.0556	0.0556
Echinococcus granulosus	calcium:calmodulin dependent protein kinase type	0.0031	0.0247	0.0609
Trichomonas vaginalis	STE family protein kinase	0.0118	0.1857	0.9872
Schistosoma mansoni	protein kinase	0.0023	0.0107	0.0107

Activities

Activity type	Activity value	Assay description	Source	Reference
IC50 (functional)	= -5.22	Antagonist activity at human recombinant P2X7 receptor	ChEMBL.	17482819
IC50 (binding)	= 5.22	Antagonist activity at P2X7 receptor (unknown origin)	ChEMBL.	24314880
Log IC50 (functional)	= 5.22	Antagonist activity at human recombinant P2X7 receptor	ChEMBL.	17482819

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: CHEMBL393684

Bibliographic References

2 literature references were collected for this gene.

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Detailed information for compound 456257