TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 288.262 | Formula: C12H12N6O3
H donors: 3 H acceptors: 2 LogP: -0.76 Rotable bonds: 3
Rule of 5 violations (Lipinski): 1
SMILES: NC1=NC(OCc2cnc3c(c2)OCO3)c2c(N1)nc[nH]2
InChi: 1S/C12H12N6O3/c13-12-17-9-8(15-4-16-9)11(18-12)19-3-6-1-7-10(14-2-6)21-5-20-7/h1-2,4,11H,3,5H2,(H,15,16)(H3,13,17,18)
InChiKey: WFASDJRBKRXSFE-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	O-6-methylguanine-DNA methyltransferase	Starlite/ChEMBL	References

Predicted pathogen targets for this compound

By orthology

Species	Potential target	Known druggable target/s	Ortholog Group
Chlamydia trachomatis	methylated-DNA protein-cysteine methyltransferase	Get druggable targets OG5_127355	All targets in OG5_127355
Mycobacterium tuberculosis	Methylated-DNA--protein-cysteine methyltransferase Ogt (6-O-methylguanine-DNA methyltransferase) (O-6-methylguanine-DNA-alkyltra	Get druggable targets OG5_127355	All targets in OG5_127355
Leishmania donovani	methylated-DNA-[protein]-cysteine S-methyltransferase, putative	Get druggable targets OG5_127355	All targets in OG5_127355
Mycobacterium leprae	PROBABLE METHYLATED-DNA--PROTEIN-CYSTEINE METHYLTRANSFERASE OGT (6-O-methylguanine-DNA methyltransferase) (O-6-methylguanine-DNA	Get druggable targets OG5_127355	All targets in OG5_127355
Treponema pallidum	methylated-DNA-protein-cysteine S-methyltransferase (dat)	Get druggable targets OG5_127355	All targets in OG5_127355
Candida albicans	6-O-methylguanine-DNA methylase	Get druggable targets OG5_127355	All targets in OG5_127355
Leishmania mexicana	hypothetical protein, conserved	Get druggable targets OG5_127355	All targets in OG5_127355
Leishmania braziliensis	hypothetical protein, conserved	Get druggable targets OG5_127355	All targets in OG5_127355
Candida albicans	similar to bacterial Ada regulatory protein	Get druggable targets OG5_127355	All targets in OG5_127355
Leishmania infantum	hypothetical protein, conserved	Get druggable targets OG5_127355	All targets in OG5_127355
Trichomonas vaginalis	methylated-DNA--protein-cysteine methyltransferase, putative	Get druggable targets OG5_127355	All targets in OG5_127355
Mycobacterium ulcerans	methylated-DNA--protein-cysteine methyltransferase Ogt	Get druggable targets OG5_127355	All targets in OG5_127355
Trypanosoma cruzi	O-6 methyl-guanine alkyl transferase, putative	Get druggable targets OG5_127355	All targets in OG5_127355
Candida albicans	similar to bacterial Ada regulatory protein	Get druggable targets OG5_127355	All targets in OG5_127355
Trypanosoma cruzi	O-6 methyl-guanine alkyl transferase, putative	Get druggable targets OG5_127355	All targets in OG5_127355
Leishmania major	hypothetical protein, conserved	Get druggable targets OG5_127355	All targets in OG5_127355
Candida albicans	6-O-methylguanine-DNA methylase	Get druggable targets OG5_127355	All targets in OG5_127355

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	endophilin A3	0.0089	0.0068	0.0068
Loa Loa (eye worm)	variant SH3 domain-containing protein	0.0091	0.0194	0.0194
Brugia malayi	Variant SH3 domain containing protein	0.018	0.5131	0.5098
Echinococcus granulosus	nostrin	0.0089	0.0068	0.0068
Brugia malayi	protein-tyrosine kinase	0.0179	0.5063	0.5029
Trichomonas vaginalis	conserved hypothetical protein	0.0089	0.0068	0.5
Echinococcus multilocularis	tyrosine protein kinase Abl	0.0206	0.6553	0.6553
Echinococcus granulosus	SH2 motif	0.0091	0.0194	0.0194
Echinococcus multilocularis	tyrosine protein kinase lyn tyrosine protein kinase blk	0.0268	1	1
Loa Loa (eye worm)	TK/FER protein kinase	0.0117	0.1615	0.1615
Brugia malayi	SH2 domain containing protein	0.0091	0.0194	0.0127
Echinococcus multilocularis	arf GAP with SH3 domain, ANK repeat and PH	0.0089	0.0068	0.0068
Loa Loa (eye worm)	TK/FER protein kinase	0.0117	0.1615	0.1615
Echinococcus granulosus	suppressor of cytokine signaling 6	0.0091	0.0194	0.0194
Echinococcus granulosus	Spectrin alpha actinin	0.0089	0.0068	0.0068
Brugia malayi	Protein kinase domain containing protein	0.0117	0.1615	0.1558
Echinococcus granulosus	suppressor of cytokine signaling 7	0.0091	0.0194	0.0194
Schistosoma mansoni	tensin-related	0.0091	0.0194	0.0127
Loa Loa (eye worm)	TK protein kinase	0.0179	0.5063	0.5063
Echinococcus multilocularis	expressed protein	0.0089	0.0068	0.0068
Schistosoma mansoni	tyrosine kinase	0.0268	1	1
Mycobacterium leprae	PROBABLE METHYLATED-DNA--PROTEIN-CYSTEINE METHYLTRANSFERASE OGT (6-O-methylguanine-DNA methyltransferase) (O-6-methylguanine-DNA	0.0233	0.8063	0.5
Echinococcus multilocularis	tyrosine protein kinase Fyn	0.0179	0.5063	0.5063
Echinococcus multilocularis	Spectrin alpha actinin	0.0089	0.0068	0.0068
Loa Loa (eye worm)	hypothetical protein	0.0117	0.1615	0.1615
Schistosoma mansoni	GTPase activating protein	0.0091	0.0194	0.0127
Echinococcus multilocularis	nostrin	0.0089	0.0068	0.0068
Loa Loa (eye worm)	hypothetical protein	0.0091	0.0194	0.0194
Echinococcus multilocularis	tyrosine protein kinase Fyn	0.0268	1	1
Loa Loa (eye worm)	hypothetical protein	0.0091	0.0194	0.0194
Echinococcus multilocularis	SH2 domain containing protein 7	0.0091	0.0194	0.0194
Trichomonas vaginalis	conserved hypothetical protein	0.0089	0.0068	0.5
Echinococcus granulosus	N chimaerin	0.0091	0.0194	0.0194
Echinococcus granulosus	SHC transforming protein 3	0.0091	0.0194	0.0194
Loa Loa (eye worm)	TK/FER protein kinase	0.0117	0.1615	0.1615
Echinococcus granulosus	arf GAP with SH3 domain ANK repeat and PH	0.0089	0.0068	0.0068
Echinococcus granulosus	tyrosine protein phosphatase non receptor type	0.0091	0.0194	0.0194
Onchocerca volvulus		0.0117	0.1615	1
Schistosoma mansoni	vav2	0.0091	0.0194	0.0127
Schistosoma mansoni	tensin	0.0091	0.0194	0.0127
Echinococcus multilocularis	fch and double sh3 domains protein 2	0.0089	0.0068	0.0068
Brugia malayi	SH2 domain containing protein	0.0091	0.0194	0.0127
Brugia malayi	Protein kinase domain containing protein	0.0117	0.1615	0.1558
Onchocerca volvulus		0.0091	0.0194	0.0812
Schistosoma mansoni	tensin	0.0091	0.0194	0.0127
Loa Loa (eye worm)	hypothetical protein	0.0089	0.0068	0.0068
Echinococcus multilocularis	growth factor receptor bound protein 2	0.018	0.5131	0.5131
Echinococcus multilocularis	tyrosine protein kinase Fps85D	0.0117	0.1615	0.1615
Loa Loa (eye worm)	hypothetical protein	0.0089	0.0068	0.0068
Loa Loa (eye worm)	SH2 domain-containing protein	0.0091	0.0194	0.0194
Schistosoma mansoni	nck2/grb4	0.018	0.5131	0.5098
Onchocerca volvulus		0.0117	0.1615	1
Trichomonas vaginalis	conserved hypothetical protein	0.0089	0.0068	0.5
Echinococcus granulosus	tyrosine protein kinase Lyn	0.0268	1	1
Echinococcus multilocularis	intersectin 2	0.0089	0.0068	0.0068
Echinococcus granulosus	tyrosine protein kinase ABL1	0.0117	0.1615	0.1615
Loa Loa (eye worm)	sex muscle abnormal protein 5	0.018	0.5131	0.5131
Loa Loa (eye worm)	hypothetical protein	0.0089	0.0068	0.0068
Schistosoma mansoni	serine/threonine protein kinase	0.0115	0.149	0.1431
Onchocerca volvulus		0.0117	0.1615	1
Entamoeba histolytica	BAR/SH3 domain containing protein	0.0089	0.0068	0.0423
Entamoeba histolytica	hypothetical protein	0.0089	0.0068	0.0423
Echinococcus multilocularis	tyrosine protein kinase Srms	0.0179	0.5063	0.5063
Schistosoma mansoni	proto-oncogene tyrosine-protein kinase src	0.0206	0.6553	0.6529
Echinococcus multilocularis	suppressor of cytokine signaling 6	0.0091	0.0194	0.0194
Loa Loa (eye worm)	hypothetical protein	0.0091	0.0194	0.0194
Echinococcus multilocularis	N chimaerin	0.0091	0.0194	0.0194
Schistosoma mansoni	tyrosine kinase	0.0206	0.6553	0.6529
Brugia malayi	Protein kinase domain containing protein	0.0117	0.1615	0.1558
Brugia malayi	Protein kinase domain containing protein	0.0117	0.1615	0.1558
Echinococcus multilocularis	tyrosine protein kinase ABL1	0.0117	0.1615	0.1615
Echinococcus multilocularis	SH2 motif	0.0091	0.0194	0.0194
Brugia malayi	hypothetical protein	0.0117	0.1615	0.1558
Trichomonas vaginalis	neutrophil cytosolic factor 2, neutrophil NADPH oxidase factor, putative	0.0089	0.0068	0.5
Entamoeba histolytica	hypothetical protein	0.0089	0.0068	0.0423
Onchocerca volvulus	Suppressor of cytokine signaling 7 homolog	0.0091	0.0194	0.0812
Schistosoma mansoni	growth factor receptor-bound protein	0.018	0.5131	0.5098
Echinococcus multilocularis	signal transduction protein lnk realted	0.0091	0.0194	0.0194
Schistosoma mansoni	proto-oncogene tyrosine-protein kinase abl1	0.018	0.5131	0.5098
Echinococcus granulosus	tyrosine protein kinase Fyn	0.0268	1	1
Schistosoma mansoni	signal transduction protein lnk-related	0.0091	0.0194	0.0127
Echinococcus multilocularis	tensin	0.0091	0.0194	0.0194
Schistosoma mansoni	tensin-related	0.0091	0.0194	0.0127
Entamoeba histolytica	SH2-protein kinase domain containing protein	0.0091	0.0194	0.1201
Echinococcus granulosus	tyrosine kinase	0.0117	0.1615	0.1615
Echinococcus multilocularis	tyrosine kinase	0.0117	0.1615	0.1615
Brugia malayi	SH2 domain containing protein	0.0091	0.0194	0.0127
Echinococcus granulosus	SH2 domain containing protein 7	0.0091	0.0194	0.0194
Brugia malayi	SH2 domain containing protein	0.0091	0.0194	0.0127
Brugia malayi	Tensin	0.0091	0.0194	0.0127
Trypanosoma cruzi	hypothetical protein, conserved	0.0089	0.0068	0.5
Echinococcus granulosus	tyrosine protein kinase Blk	0.0179	0.5063	0.5063
Loa Loa (eye worm)	hypothetical protein	0.0091	0.0194	0.0194
Brugia malayi	Variant SH3 domain containing protein	0.0091	0.0194	0.0127
Echinococcus multilocularis	tyrosine protein kinase Fgr	0.0268	1	1
Echinococcus granulosus	tyrosine protein kinase shark	0.0117	0.1615	0.1615
Entamoeba histolytica	hypothetical protein	0.0089	0.0068	0.0423
Brugia malayi	SH2 domain containing protein	0.0091	0.0194	0.0127
Echinococcus granulosus	tyrosine protein kinase Fyn	0.0268	1	1
Echinococcus multilocularis	tyrosine protein kinase lyn lyn a protein tyrosine kinase lymphocyte specific protein tyrosine kinase	0.0268	1	1
Echinococcus multilocularis	c src tyrosine kinase	0.0206	0.6553	0.6553
Brugia malayi	SH2 domain containing protein	0.0117	0.1615	0.1558
Schistosoma mansoni	SH2A	0.0091	0.0194	0.0127
Schistosoma mansoni	shc transforming protein	0.0091	0.0194	0.0127
Schistosoma mansoni	chimerin-related rho-gtpase-activating protein	0.0091	0.0194	0.0127
Entamoeba histolytica	hypothetical protein	0.0089	0.0068	0.0423
Mycobacterium tuberculosis	Methylated-DNA--protein-cysteine methyltransferase Ogt (6-O-methylguanine-DNA methyltransferase) (O-6-methylguanine-DNA-alkyltra	0.0233	0.8063	0.5
Loa Loa (eye worm)	hypothetical protein	0.0089	0.0068	0.0068
Echinococcus granulosus	expressed conserved protein	0.0091	0.0194	0.0194
Schistosoma mansoni	suppressor of cytokine signaling	0.0091	0.0194	0.0127
Loa Loa (eye worm)	hypothetical protein	0.0091	0.0194	0.0194
Echinococcus granulosus	tyrosine protein kinase Srms	0.0117	0.1615	0.1615
Loa Loa (eye worm)	RhoGAP domain-containing protein	0.0091	0.0194	0.0194
Entamoeba histolytica	protein kinase, putative	0.0089	0.0068	0.0423
Trichomonas vaginalis	conserved hypothetical protein	0.0089	0.0068	0.5
Loa Loa (eye worm)	SRC-1	0.0268	1	1
Entamoeba histolytica	protein kinase, putative	0.0091	0.0194	0.1201
Onchocerca volvulus		0.0091	0.0194	0.0812
Brugia malayi	Tyrosine-protein kinase abl-1	0.0206	0.6553	0.6529
Onchocerca volvulus		0.0091	0.0194	0.0812
Echinococcus multilocularis	suppressor of cytokine signaling 7	0.0091	0.0194	0.0194
Loa Loa (eye worm)	hypothetical protein	0.0089	0.0068	0.0068
Echinococcus multilocularis	tyrosine protein kinase Src64B	0.0268	1	1
Echinococcus granulosus	tyrosine protein kinase Src64B	0.0268	1	1
Echinococcus granulosus	hematopoietic lineage cell specific protein	0.0089	0.0068	0.0068
Echinococcus multilocularis	transfer RNA-Ala	0.0089	0.0068	0.0068
Loa Loa (eye worm)	hypothetical protein	0.0091	0.0194	0.0194
Entamoeba histolytica	hypothetical protein	0.0089	0.0068	0.0423
Loa Loa (eye worm)	thyroid receptor interactor	0.0089	0.0068	0.0068
Loa Loa (eye worm)	SH2 domain-containing protein	0.0091	0.0194	0.0194
Onchocerca volvulus		0.0091	0.0194	0.0812
Brugia malayi	SH2 domain containing protein	0.0091	0.0194	0.0127
Loa Loa (eye worm)	STAT protein	0.0091	0.0194	0.0194
Echinococcus multilocularis	SH2 motif	0.0091	0.0194	0.0194
Echinococcus multilocularis	NCK adaptor protein	0.018	0.5131	0.5131
Loa Loa (eye worm)	hypothetical protein	0.0091	0.0194	0.0194
Echinococcus multilocularis	tyrosine protein kinase Btk29A	0.0206	0.6553	0.6553
Echinococcus granulosus	intersectin 2	0.0089	0.0068	0.0068
Entamoeba histolytica	SH2 domain containing protein	0.0091	0.0194	0.1201
Brugia malayi	Protein-tyrosine phosphatase containing protein	0.0091	0.0194	0.0127
Echinococcus granulosus	src region	0.0089	0.0068	0.0068
Entamoeba histolytica	unconventional myosin IB	0.0089	0.0068	0.0423
Entamoeba histolytica	SH2-protein kinase domain containing protein	0.0117	0.1615	1
Loa Loa (eye worm)	TK/FER protein kinase	0.0117	0.1615	0.1615
Echinococcus multilocularis	SH2 motif	0.0091	0.0194	0.0194
Echinococcus granulosus	SH2 domain containing adapter protein F	0.0091	0.0194	0.0194
Echinococcus granulosus	fch and double sh3 domains protein 2	0.0089	0.0068	0.0068
Onchocerca volvulus		0.0091	0.0194	0.0812
Echinococcus multilocularis	breast cancer anti estrogen resistance protein	0.0089	0.0068	0.0068
Entamoeba histolytica	hypothetical protein	0.0089	0.0068	0.0423
Echinococcus granulosus	guanine nucleotide exchange factor VAV2	0.0091	0.0194	0.0194
Loa Loa (eye worm)	hypothetical protein	0.0089	0.0068	0.0068
Schistosoma mansoni	tyrosine kinase	0.0206	0.6553	0.6529
Trichomonas vaginalis	conserved hypothetical protein	0.0089	0.0068	0.5
Echinococcus granulosus	tyrosine protein kinase Fps85D	0.0117	0.1615	0.1615
Schistosoma mansoni	adapter molecule crk	0.018	0.5131	0.5098
Loa Loa (eye worm)	hypothetical protein	0.0091	0.0194	0.0194
Echinococcus multilocularis	proto oncogene tyrosine protein kinase LCK	0.0268	1	1
Trypanosoma cruzi	hypothetical protein, conserved	0.0089	0.0068	0.5
Loa Loa (eye worm)	hypothetical protein	0.0091	0.0194	0.0194
Echinococcus multilocularis	SHC transforming protein 3	0.0091	0.0194	0.0194
Mycobacterium ulcerans	methylated-DNA--protein-cysteine methyltransferase Ogt	0.0233	0.8063	0.5
Schistosoma mansoni	tyrosine kinase	0.0117	0.1615	0.1558
Echinococcus multilocularis	epidermal growth factor receptor kinase	0.0089	0.0068	0.0068
Loa Loa (eye worm)	TK/FER protein kinase	0.0117	0.1615	0.1615
Echinococcus granulosus	tyrosine protein kinase Src42A	0.0268	1	1
Loa Loa (eye worm)	variant SH3 domain-containing protein	0.0089	0.0068	0.0068
Schistosoma mansoni	tyrosine kinase	0.0117	0.1615	0.1558
Echinococcus multilocularis	tyrosine protein kinase Fyn	0.0268	1	1
Loa Loa (eye worm)	hypothetical protein	0.0089	0.0068	0.0068
Trypanosoma cruzi	hypothetical protein, conserved	0.0089	0.0068	0.5
Echinococcus multilocularis	phosphatidylinositol 3 kinase regulatory subunit	0.0091	0.0194	0.0194
Brugia malayi	RhoGAP domain containing protein	0.0091	0.0194	0.0127
Loa Loa (eye worm)	TK/FER protein kinase	0.0117	0.1615	0.1615
Loa Loa (eye worm)	hypothetical protein	0.018	0.5131	0.5131
Onchocerca volvulus		0.0117	0.1615	1
Loa Loa (eye worm)	guanylate kinase	0.0089	0.0068	0.0068
Loa Loa (eye worm)	hypothetical protein	0.0091	0.0194	0.0194
Loa Loa (eye worm)	cytokine inducible SH2-containing protein 5	0.0091	0.0194	0.0194
Entamoeba histolytica	hypothetical protein, conserved	0.0089	0.0068	0.0423
Echinococcus multilocularis		0.0091	0.0194	0.0194
Echinococcus multilocularis	tensin	0.0091	0.0194	0.0194
Echinococcus multilocularis	rho guanine nucleotide exchange factor 7	0.0089	0.0068	0.0068
Echinococcus multilocularis	tyrosine protein phosphatase non receptor type	0.0091	0.0194	0.0194
Echinococcus granulosus	signal transduction protein lnk realted	0.0091	0.0194	0.0194
Echinococcus granulosus	tyrosine protein kinase Src42A	0.0153	0.3641	0.3641
Echinococcus multilocularis	tyrosine protein kinase Blk	0.0179	0.5063	0.5063
Onchocerca volvulus		0.0117	0.1615	1
Echinococcus multilocularis	SH2 domain containing adapter protein F	0.0091	0.0194	0.0194
Echinococcus granulosus	NCK adaptor protein	0.018	0.5131	0.5131
Echinococcus granulosus	tyrosine protein kinase Fyn	0.0268	1	1
Echinococcus granulosus	expressed protein	0.0089	0.0068	0.0068
Entamoeba histolytica	hypothetical protein	0.0089	0.0068	0.0423
Echinococcus granulosus	epidermal growth factor receptor kinase	0.0089	0.0068	0.0068
Entamoeba histolytica	BAR/SH3 domain containing protein	0.0089	0.0068	0.0423
Brugia malayi	Sex muscle abnormal protein 5	0.018	0.5131	0.5098
Loa Loa (eye worm)	TK/FER protein kinase	0.0117	0.1615	0.1615
Onchocerca volvulus		0.0117	0.1615	1
Loa Loa (eye worm)	protein-tyrosine phosphatase	0.0091	0.0194	0.0194
Brugia malayi	hypothetical protein	0.0091	0.0194	0.0127
Echinococcus granulosus	SH2 motif	0.0091	0.0194	0.0194
Brugia malayi	tRNA modification GTPase TrmE family protein	0.0091	0.0194	0.0127
Trypanosoma cruzi	paraflagellar rod protein 5, putative	0.0089	0.0068	0.5
Schistosoma mansoni	tensin	0.0091	0.0194	0.0127
Echinococcus granulosus	tyrosine protein phosphatase non receptor type	0.0091	0.0194	0.0194
Schistosoma mansoni	tyrosine kinase	0.0268	1	1
Echinococcus multilocularis	tyrosine protein kinase shark	0.0117	0.1615	0.1615
Echinococcus granulosus	hypothetical protein	0.0091	0.0194	0.0194
Loa Loa (eye worm)	hypothetical protein	0.0091	0.0194	0.0194
Loa Loa (eye worm)	protein-tyrosine kinase	0.0089	0.0068	0.0068
Loa Loa (eye worm)	TK/ABL protein kinase	0.0117	0.1615	0.1615
Echinococcus multilocularis	slit robo rho gtpase activating protein 1	0.0089	0.0068	0.0068
Leishmania major	hypothetical protein, conserved	0.0089	0.0068	0.5
Loa Loa (eye worm)	variant SH3 domain-containing protein	0.018	0.5131	0.5131
Echinococcus granulosus	proto oncogene tyrosine protein kinase LCK	0.0268	1	1
Schistosoma mansoni	tyrosine-protein kinase zap-70	0.0091	0.0194	0.0127
Schistosoma mansoni	suppressor of cytokine signaling	0.0091	0.0194	0.0127
Echinococcus multilocularis	tyrosine protein kinase Src42A	0.0268	1	1
Echinococcus granulosus	3'partial\|tyrosine protein kinase Fgr	0.0268	1	1
Loa Loa (eye worm)	TK/FER protein kinase	0.0117	0.1615	0.1615
Loa Loa (eye worm)	protein kinase C and casein kinase substrate in neurons protein 2	0.0089	0.0068	0.0068
Schistosoma mansoni	chimerin-related rho-gtpase-activating protein	0.0091	0.0194	0.0127
Echinococcus multilocularis	tyrosine protein kinase Src42A	0.0153	0.3641	0.3641
Onchocerca volvulus		0.0091	0.0194	0.0812
Echinococcus granulosus	phosphatidylinositol 3 kinase regulatory subunit	0.0091	0.0194	0.0194
Echinococcus multilocularis	tyrosine protein kinase Fyn	0.0268	1	1
Brugia malayi	Variant SH3 domain containing protein	0.018	0.5131	0.5098
Echinococcus granulosus	tyrosine kinase\|tyrosine protein kinase Fyn	0.0179	0.5063	0.5063
Echinococcus multilocularis	hematopoietic lineage cell specific protein	0.0089	0.0068	0.0068
Brugia malayi	SH2 domain containing protein	0.0117	0.1615	0.1558
Loa Loa (eye worm)	hypothetical protein	0.0089	0.0068	0.0068
Schistosoma mansoni	hypothetical protein	0.0091	0.0194	0.0127
Trichomonas vaginalis	conserved hypothetical protein	0.0089	0.0068	0.5
Loa Loa (eye worm)	hypothetical protein	0.0091	0.0194	0.0194
Echinococcus granulosus	tensin	0.0091	0.0194	0.0194
Echinococcus granulosus	tyrosine protein kinase Btk29A	0.0206	0.6553	0.6553
Echinococcus granulosus	c src tyrosine kinase	0.0206	0.6553	0.6553
Brugia malayi	STAT protein, DNA binding domain containing protein	0.0091	0.0194	0.0127
Brugia malayi	cytokine inducible SH2-containing protein 5	0.0091	0.0194	0.0127
Echinococcus granulosus	rho guanine nucleotide exchange factor 7	0.0089	0.0068	0.0068
Echinococcus granulosus	slit robo rho gtpase activating protein 1	0.0089	0.0068	0.0068
Echinococcus granulosus	tensin C1 domain containing phosphatase	0.0091	0.0194	0.0194
Echinococcus granulosus	breast cancer anti estrogen resistance protein	0.0089	0.0068	0.0068
Echinococcus granulosus	endophilin A3	0.0089	0.0068	0.0068
Echinococcus granulosus	growth factor receptor bound protein 2	0.018	0.5131	0.5131
Brugia malayi	SH2 domain containing protein	0.0091	0.0194	0.0127
Schistosoma mansoni	protein tyrosine phosphatase n11 (shp2)	0.0091	0.0194	0.0127
Loa Loa (eye worm)	p53BP2	0.0089	0.0068	0.0068
Schistosoma mansoni	growth factor receptor-bound protein	0.018	0.5131	0.5098
Loa Loa (eye worm)	hypothetical protein	0.0089	0.0068	0.0068
Echinococcus multilocularis	tyrosine protein phosphatase non receptor type	0.0091	0.0194	0.0194
Loa Loa (eye worm)	SH2 domain-containing protein	0.0091	0.0194	0.0194
Echinococcus multilocularis	guanine nucleotide exchange factor VAV2	0.0091	0.0194	0.0194
Entamoeba histolytica	hypothetical protein, conserved	0.0089	0.0068	0.0423
Echinococcus granulosus	tyrosine kinase	0.0179	0.5063	0.5063
Trichomonas vaginalis	conserved hypothetical protein	0.0089	0.0068	0.5
Loa Loa (eye worm)	hypothetical protein	0.0091	0.0194	0.0194
Brugia malayi	Protein kinase domain containing protein	0.0117	0.1615	0.1558
Loa Loa (eye worm)	TK/FER protein kinase	0.0117	0.1615	0.1615
Loa Loa (eye worm)	TK/FER protein kinase	0.0117	0.1615	0.1615
Trypanosoma brucei	conserved protein	0.0089	0.0068	0.5
Onchocerca volvulus	Suppressor of cytokine signaling at 36E homolog	0.0091	0.0194	0.0812
Entamoeba histolytica	hypothetical protein	0.0089	0.0068	0.0423
Echinococcus multilocularis	suppressor of cytokine signaling 7	0.0091	0.0194	0.0194
Schistosoma mansoni	hypothetical protein	0.0091	0.0194	0.0127
Loa Loa (eye worm)	hypothetical protein	0.0091	0.0194	0.0194
Brugia malayi	Variant SH3 domain containing protein	0.0091	0.0194	0.0127
Trichomonas vaginalis	p67phox protein, putative	0.0089	0.0068	0.5

Activities

Activity type	Activity value	Assay description	Source	Reference
IC50 (binding)	= 0.09 uM	O6-Alkylguanine-DNA Alkyltransferase-Inactivating Activity in Raji cells (Concentration of inactivator required to produce 50% reduction in ATPase activity)	ChEMBL.	9857094
IC50 (binding)	= 0.09 uM	O6-Alkylguanine-DNA Alkyltransferase-Inactivating Activity in Raji cells (Concentration of inactivator required to produce 50% reduction in ATPase activity)	ChEMBL.	9857094
IC50 (binding)	= 0.23 uM	O6-Alkylguanine-DNA Alkyltransferase-Inactivating Activity (Concentration of inactivator required to produce 50% reduction in ATPase activity)	ChEMBL.	9857094
IC50 (binding)	= 0.23 uM	O6-Alkylguanine-DNA Alkyltransferase-Inactivating Activity (Concentration of inactivator required to produce 50% reduction in ATPase activity)	ChEMBL.	9857094
T1/2 (ADMET)	> 48 hr	In vitro half-life of the compound at 37 degree centigrade in phosphate-buffered saline(PBS; pH =7-7.2)	ChEMBL.	9857094

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: CHEMBL150918

Bibliographic References

1 literature reference was collected for this gene.

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Detailed information for compound 258052