TDR Targets

Basic information

Technical information

TDR Targets ID: 1528679
Name: N-(2-fluorophenyl)-2-[[2-(2-methylpropyl)-5-o xo-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]me thylsulfanyl]acetamide
MW: 406.497 | Formula: C18H19FN4O2S2
H donors: 1 H acceptors: 2 LogP: 2.95 Rotable bonds: 8
Rule of 5 violations (Lipinski): 1
SMILES: CC(Cc1nn2c(s1)nc(cc2=O)CSCC(=O)Nc1ccccc1F)C
InChi: 1S/C18H19FN4O2S2/c1-11(2)7-16-22-23-17(25)8-12(20-18(23)27-16)9-26-10-15(24)21-14-6-4-3-5-13(14)19/h3-6,8,11H,7,9-10H2,1-2H3,(H,21,24)
InChiKey: UMDYBYGGWGJRJY-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

N-(2-fluorophenyl)-2-[(2-isobutyl-5-oxo-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methylsulfanyl]acetamide
N-(2-fluorophenyl)-2-[(2-isobutyl-5-oxo-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methylthio]acetamide
N-(2-fluorophenyl)-2-[(2-isobutyl-5-keto-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methylthio]acetamide
N-(2-fluorophenyl)-2-[[2-(2-methylpropyl)-5-oxo-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methylsulfanyl]ethanamide

Targets

Known targets for this compound

Species	Target name	Source	Bibliographic reference
Homo sapiens	APEX nuclease (multifunctional DNA repair enzyme) 1	Starlite/ChEMBL	No references
Homo sapiens	euchromatic histone-lysine N-methyltransferase 2	Starlite/ChEMBL	No references

Predicted pathogen targets for this compound

By orthology

Species	Potential target	Known druggable target/s	Ortholog Group
Schistosoma japonicum	ko:K10771 AP endonuclease 1, putative	Get druggable targets OG5_126768	All targets in OG5_126768
Trypanosoma cruzi	apurinic/apyrimidinic endonuclease	Get druggable targets OG5_126768	All targets in OG5_126768
Giardia lamblia	Endonuclease/Exonuclease/phosphatase	Get druggable targets OG5_126768	All targets in OG5_126768
Trichomonas vaginalis	ap endonuclease, putative	Get druggable targets OG5_126768	All targets in OG5_126768
Schistosoma mansoni	ap endonuclease	Get druggable targets OG5_126768	All targets in OG5_126768
Echinococcus granulosus	DNA apurinic or apyrimidinic site lyase	Get druggable targets OG5_126768	All targets in OG5_126768
Plasmodium vivax	AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative	Get druggable targets OG5_126768	All targets in OG5_126768
Leishmania donovani	apurinic/apyrimidinic endonuclease-redox protein	Get druggable targets OG5_126768	All targets in OG5_126768
Schistosoma japonicum	DNA-(apurinic or apyrimidinic site) lyase 2, putative	Get druggable targets OG5_126768	All targets in OG5_126768
Loa Loa (eye worm)	pre-SET domain-containing protein family protein	Get druggable targets OG5_131470	All targets in OG5_131470
Candida albicans	similar to S. cerevisiae APN2 (YBL019W) DNA repair apurinic/apyrimidinic endonuclease	Get druggable targets OG5_126768	All targets in OG5_126768
Leishmania major	apurinic/apyrimidinic endonuclease-redox protein	Get druggable targets OG5_126768	All targets in OG5_126768
Schistosoma japonicum	ko:K10772 AP endonuclease 2, putative	Get druggable targets OG5_126768	All targets in OG5_126768
Wolbachia endosymbiont of Brugia malayi	exonuclease III	Get druggable targets OG5_126768	All targets in OG5_126768
Toxoplasma gondii	exonuclease III APE	Get druggable targets OG5_126768	All targets in OG5_126768
Schistosoma mansoni	ap endonuclease	Get druggable targets OG5_126768	All targets in OG5_126768
Echinococcus multilocularis	DNA (apurinic or apyrimidinic site) lyase	Get druggable targets OG5_126768	All targets in OG5_126768
Trichomonas vaginalis	ap endonuclease, putative	Get druggable targets OG5_126768	All targets in OG5_126768
Treponema pallidum	exodeoxyribonuclease (exoA)	Get druggable targets OG5_126768	All targets in OG5_126768
Trypanosoma brucei gambiense	apurinic/apyrimidinic endonuclease, putative	Get druggable targets OG5_126768	All targets in OG5_126768
Trypanosoma congolense	apurinic/apyrimidinic endonuclease, putative	Get druggable targets OG5_126768	All targets in OG5_126768
Plasmodium yoelii	putative AP endonuclease-related	Get druggable targets OG5_126768	All targets in OG5_126768
Trichomonas vaginalis	set domain proteins, putative	Get druggable targets OG5_131470	All targets in OG5_131470
Plasmodium falciparum	AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative	Get druggable targets OG5_126768	All targets in OG5_126768
Neospora caninum	hypothetical protein	Get druggable targets OG5_126768	All targets in OG5_126768
Leishmania infantum	apurinic/apyrimidinic endonuclease-redox protein	Get druggable targets OG5_126768	All targets in OG5_126768
Schistosoma japonicum	DNA-(apurinic or apyrimidinic site) lyase 2, putative	Get druggable targets OG5_126768	All targets in OG5_126768
Plasmodium knowlesi	AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative	Get druggable targets OG5_126768	All targets in OG5_126768
Leishmania braziliensis	apurinic/apyrimidinic endonuclease-redox protein	Get druggable targets OG5_126768	All targets in OG5_126768
Trypanosoma cruzi	apurinic/apyrimidinic endonuclease, putative	Get druggable targets OG5_126768	All targets in OG5_126768
Cryptosporidium hominis	dna-(apurinic or apyrimidinic site) lyase	Get druggable targets OG5_126768	All targets in OG5_126768
Leishmania mexicana	apurinic/apyrimidinic endonuclease-redox protein,AP-endonuclease	Get druggable targets OG5_126768	All targets in OG5_126768
Candida albicans	similar to S. cerevisiae APN2 (YBL019W) DNA repair apurinic/apyrimidinic endonuclease	Get druggable targets OG5_126768	All targets in OG5_126768
Plasmodium berghei	AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative	Get druggable targets OG5_126768	All targets in OG5_126768
Entamoeba histolytica	exodeoxyribonuclease III, putative	Get druggable targets OG5_126768	All targets in OG5_126768
Theileria parva	hypothetical protein	Get druggable targets OG5_126768	All targets in OG5_126768
Brugia malayi	Pre-SET motif family protein	Get druggable targets OG5_131470	All targets in OG5_131470
Onchocerca volvulus		Get druggable targets OG5_131470	All targets in OG5_131470
Mycobacterium tuberculosis	Probable exodeoxyribonuclease III protein XthA (exonuclease III) (EXO III) (AP endonuclease VI)	Get druggable targets OG5_126768	All targets in OG5_126768
Trypanosoma brucei	apurinic/apyrimidinic endonuclease, putative	Get druggable targets OG5_126768	All targets in OG5_126768
Mycobacterium ulcerans	exodeoxyribonuclease III protein XthA	Get druggable targets OG5_126768	All targets in OG5_126768
Brugia malayi	exodeoxyribonuclease III family protein	Get druggable targets OG5_126768	All targets in OG5_126768
Loa Loa (eye worm)	exodeoxyribonuclease III family protein	Get druggable targets OG5_126768	All targets in OG5_126768
Cryptosporidium parvum	conserved hypothetical protein	Get druggable targets OG5_126768	All targets in OG5_126768

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
Trichomonas vaginalis	ABC transporter, putative	0.0098	0.0821	0.2846
Loa Loa (eye worm)	hypothetical protein	0.0031	0.0086	0.0343
Trichomonas vaginalis	lipid A export ATP-binding/permease protein msba, putative	0.0098	0.0821	0.2846
Toxoplasma gondii	ABC transporter transmembrane region domain-containing protein	0.0031	0.0086	0.1046
Loa Loa (eye worm)	hypothetical protein	0.0029	0.0074	0.0296
Echinococcus multilocularis		0.0031	0.0086	0.1046
Mycobacterium leprae	PROBABLE DRUGS-TRANSPORT TRANSMEMBRANE ATP-BINDING PROTEIN ABC TRANSPORTER	0.0031	0.0086	0.5
Leishmania major	ATP-binding cassette protein subfamily B, member 3, putative	0.0031	0.0086	0.0171
Trichomonas vaginalis	lipid A export ATP-binding/permease protein msba, putative	0.0098	0.0821	0.2846
Entamoeba histolytica	hypothetical protein	0.0051	0.0306	0.0306
Entamoeba histolytica	hypothetical protein	0.0031	0.0086	0.0086
Plasmodium falciparum	ABC transporter B family member 4, putative	0.0031	0.0086	0.1046
Mycobacterium tuberculosis	Probable transmembrane multidrug efflux pump	0.0098	0.0821	1
Echinococcus granulosus	5'partial\|ATP binding cassette sub family B	0.0097	0.0809	0.9858
Mycobacterium ulcerans	drugs-transport transmembrane ATP-binding protein ABC transporter	0.0031	0.0086	1
Leishmania major	phosphatidylcholine:ceramide cholinephosphotransferase 2	0.048	0.5011	1
Toxoplasma gondii	ABC transporter transmembrane region domain-containing protein	0.0031	0.0086	0.1046
Echinococcus granulosus	multidrug resistance associated protein 1	0.0031	0.0086	0.1046
Giardia lamblia	Multidrug resistance-associated protein 1	0.0031	0.0086	1
Plasmodium falciparum	multidrug resistance-associated protein 1	0.0031	0.0086	0.1046
Toxoplasma gondii	ABC transporter transmembrane region domain-containing protein	0.0031	0.0086	0.1046
Brugia malayi	Pre-SET motif family protein	0.0251	0.2504	1
Trichomonas vaginalis	lipid A export ATP-binding/permease protein msba, putative	0.0098	0.0821	0.2846
Leishmania major	ATP-binding cassette protein subfamily C, member 6, putative	0.0031	0.0086	0.0171
Loa Loa (eye worm)	ABC transporter	0.0031	0.0086	0.0343
Plasmodium falciparum	multidrug resistance-associated protein 2	0.0031	0.0086	0.1046
Echinococcus granulosus	ATP binding cassette subfamily B MDR:TAP	0.0098	0.0821	1
Trichomonas vaginalis	conserved hypothetical protein	0.0051	0.0306	0.1062
Echinococcus multilocularis	ATP binding cassette sub family B	0.0031	0.0086	0.1046
Echinococcus multilocularis	multidrug resistance associated protein 7	0.0031	0.0086	0.1046
Toxoplasma gondii	ATP-binding cassette sub-family B member 5	0.0031	0.0086	0.1046
Trypanosoma brucei	p-glycoprotein	0.0031	0.0086	0.0171
Treponema pallidum	exodeoxyribonuclease (exoA)	0.0023	0	0.5
Entamoeba histolytica	P-glycoprotein-1	0.0098	0.0821	0.0821
Brugia malayi	multidrug resistance protein 3	0.0098	0.0821	0.3278
Trichomonas vaginalis	ATP-binding cassette transporter, putative	0.0098	0.0821	0.2846
Brugia malayi	Phosphatidylcholine:ceramide cholinephosphotransferase 3	0.0051	0.0306	0.1223
Brugia malayi	Phosphatidylcholine:ceramide cholinephosphotransferase 1	0.0051	0.0306	0.1223
Trichomonas vaginalis	ABC transporter, half transporter, putative	0.0098	0.0821	0.2846
Entamoeba histolytica	hypothetical protein	0.0051	0.0306	0.0306
Entamoeba histolytica	P-glycoprotein-2	0.0098	0.0821	0.0821
Schistosoma mansoni	smdr1	0.0031	0.0086	0.1046
Schistosoma mansoni	multidrug resistance protein	0.0029	0.0074	0.0904
Entamoeba histolytica	P-glycoprotein-5	0.0098	0.0821	0.0821
Echinococcus multilocularis	ATP binding cassette subfamily B (MDR:TAP)	0.0098	0.0821	1
Mycobacterium ulcerans	transmembrane ABC transporter ATP-binding protein	0.0031	0.0086	1
Echinococcus multilocularis	multidrug resistance associated protein 1	0.0031	0.0086	0.1046
Mycobacterium ulcerans	component linked with the assembly of cytochrome transport transmembrane ATP-binding protein ABC transporter CydD	0.0031	0.0086	1
Trichomonas vaginalis	lipid A export ATP-binding/permease protein msba, putative	0.0031	0.0086	0.0298
Loa Loa (eye worm)	hypothetical protein	0.0029	0.0074	0.0296
Trichomonas vaginalis	lipid A export ATP-binding/permease protein msba, putative	0.0098	0.0821	0.2846
Mycobacterium ulcerans	transmembrane ABC transporter ATP-binding protein	0.0031	0.0086	1
Entamoeba histolytica	hypothetical protein	0.0051	0.0306	0.0306
Plasmodium falciparum	sphingomyelin synthase 2, putative	0.0051	0.0306	0.3731
Echinococcus granulosus	ATP binding cassette sub family B	0.0031	0.0086	0.1046
Entamoeba histolytica	P-glycoprotein-2, putative	0.0029	0.0074	0.0074
Plasmodium vivax	ABC transporter B family member 4, putative	0.0031	0.0086	0.1046
Echinococcus multilocularis	histone lysine N methyltransferase SETMAR	0.0036	0.0146	0.178
Schistosoma mansoni	multidrug resistance protein	0.0098	0.0821	1
Loa Loa (eye worm)	hypothetical protein	0.0031	0.0086	0.0343
Mycobacterium leprae	PROBABLE DRUGS-TRANSPORT TRANSMEMBRANE ATP-BINDING PROTEIN ABC TRANSPORTER	0.0031	0.0086	0.5
Echinococcus granulosus	multidrug resistance protein 1	0.0098	0.0821	1
Schistosoma mansoni	multidrug resistance protein	0.0031	0.0086	0.1046
Trypanosoma cruzi	ABC transporter of the mitochondrion, putative	0.0031	0.0086	0.0171
Mycobacterium ulcerans	transmembrane ABC transporter ATP-binding protein	0.0031	0.0086	1
Trichomonas vaginalis	ABC transporter, half transporter, putative	0.0098	0.0821	0.2846
Entamoeba histolytica	ATP-binding cassette protein, putative	0.0031	0.0086	0.0086
Echinococcus multilocularis	ATP binding cassette subfamily B (MDR:TAP)	0.0098	0.0821	1
Loa Loa (eye worm)	pre-SET domain-containing protein family protein	0.0251	0.2504	1
Trypanosoma brucei	sphingomyelin/ceramide phosphorylethanolamine synthase, bifunctional	0.048	0.5011	1
Echinococcus granulosus	ATP binding cassette sub family B	0.0031	0.0086	0.1046
Schistosoma mansoni	histone-lysine n-methyltransferase suv9	0.0036	0.0146	0.178
Brugia malayi	Phosphatidylcholine:ceramide cholinephosphotransferase 1	0.0051	0.0306	0.1223
Trichomonas vaginalis	lipid A export ATP-binding/permease protein msba, putative	0.0098	0.0821	0.2846
Entamoeba histolytica	ATP-binding cassette protein, putative	0.0031	0.0086	0.0086
Plasmodium falciparum	ABC transporter B family member 6, putative	0.0031	0.0086	0.1046
Entamoeba histolytica	P-glycoprotein-2	0.0098	0.0821	0.0821
Entamoeba histolytica	P-glycoprotein 5, putative	0.0098	0.0821	0.0821
Echinococcus granulosus	sphingomyelin synthase protein 1	0.0051	0.0306	0.3731
Plasmodium falciparum	ABC transporter B family member 5, putative	0.0031	0.0086	0.1046
Loa Loa (eye worm)	ABC transporter	0.0031	0.0086	0.0343
Plasmodium vivax	multidrug resistance protein 2, putative	0.0031	0.0086	0.1046
Giardia lamblia	MRP-like ABC transporter	0.0031	0.0086	1
Loa Loa (eye worm)	hypothetical protein	0.0098	0.0821	0.3278
Mycobacterium tuberculosis	Iron-regulated transporter IrtA	0.0031	0.0086	0.1046
Trichomonas vaginalis	abcb9, putative	0.0098	0.0821	0.2846
Schistosoma mansoni	ATP-binding cassette sub-family B member 6 mitochondrial precursor (abc6)	0.0029	0.0074	0.0904
Brugia malayi	multidrug resistance related protein 1	0.0031	0.0086	0.0343
Trichomonas vaginalis	multidrug resistance protein 1, 2, putative	0.0098	0.0821	0.2846
Echinococcus multilocularis	ATP binding cassette sub family B	0.0031	0.0086	0.1046
Plasmodium falciparum	sphingomyelin synthase 1, putative	0.0051	0.0306	0.3731
Toxoplasma gondii	ABC transporter transmembrane region domain-containing protein	0.0098	0.0821	1
Trichomonas vaginalis	sphingomyelin synthetase, putative	0.0051	0.0306	0.1062
Trichomonas vaginalis	abcb9, putative	0.0098	0.0821	0.2846
Plasmodium vivax	ABC transporter B family member 6, putative	0.0031	0.0086	0.1046
Schistosoma mansoni	multidrug resistance protein	0.0031	0.0086	0.1046
Plasmodium vivax	sphingomyelin synthase 2, putative	0.0051	0.0306	0.3731
Toxoplasma gondii	ABC transporter transmembrane region domain-containing protein	0.0031	0.0086	0.1046
Onchocerca volvulus		0.0098	0.0821	0.2464
Trypanosoma brucei	sphingomyelin/ceramide phosphorylethanolamine synthase, bifunctional	0.048	0.5011	1
Loa Loa (eye worm)	hypothetical protein	0.0051	0.0306	0.1223
Toxoplasma gondii	ABC transporter family protein	0.0031	0.0086	0.1046
Plasmodium falciparum	sphingomyelin synthase 1, putative	0.0051	0.0306	0.3731
Entamoeba histolytica	hypothetical membrane-spanning protein	0.0051	0.0306	0.0306
Trichomonas vaginalis	conserved hypothetical protein	0.0029	0.0074	0.0257
Giardia lamblia	Multidrug resistance-associated protein 1	0.0031	0.0086	1
Schistosoma mansoni	histone-lysine n-methyltransferase setb1	0.0036	0.0146	0.178
Leishmania major	ATP-binding cassette protein subfamily C, member 5, putative	0.0031	0.0086	0.0171
Leishmania major	pentamidine resistance protein 1	0.0031	0.0086	0.0171
Schistosoma mansoni	histone-lysine n-methyltransferase setb1	0.0036	0.0146	0.178
Brugia malayi	Pre-SET motif family protein	0.0036	0.0146	0.0583
Trichomonas vaginalis	lipid A export ATP-binding/permease protein msba, putative	0.0098	0.0821	0.2846
Trichomonas vaginalis	sphingomyelin synthetase, putative	0.0051	0.0306	0.1062
Trypanosoma brucei	multidrug resistance protein E	0.0031	0.0086	0.0171
Plasmodium vivax	multidrug resistance protein 1, putative	0.0098	0.0821	1
Brugia malayi	ABC transporter	0.0031	0.0086	0.0343
Trichomonas vaginalis	multidrug resistance protein 1, 2, putative	0.0098	0.0821	0.2846
Wolbachia endosymbiont of Brugia malayi	ABC-type protease secretion system, ATPase and permease component, AprD	0.0031	0.0086	1
Echinococcus granulosus	ATP binding cassette subfamily B MDR:TAP	0.0098	0.0821	1
Echinococcus granulosus	multidrug resistance protein 1	0.0098	0.0821	1
Loa Loa (eye worm)	hypothetical protein	0.0098	0.0821	0.3278
Echinococcus multilocularis	ATP binding cassette sub family B	0.0031	0.0086	0.1046
Plasmodium falciparum	multidrug resistance protein 2	0.0031	0.0086	0.1046
Brugia malayi	hypothetical protein	0.0031	0.0086	0.0343
Brugia malayi	ABC transporter family protein	0.0098	0.0821	0.3278
Trichomonas vaginalis	ATP-binding cassette transporter, putative	0.0029	0.0074	0.0257
Echinococcus multilocularis	sphingomyelin synthase protein 1	0.0051	0.0306	0.3731
Leishmania major	ATP-binding cassette protein subfamily C, member 2, putative	0.0031	0.0086	0.0171
Trichomonas vaginalis	multidrug resistance protein 1, 2, putative	0.0098	0.0821	0.2846
Loa Loa (eye worm)	hypothetical protein	0.0051	0.0306	0.1223
Trichomonas vaginalis	sphingomyelin synthetase, putative	0.0051	0.0306	0.1062
Trypanosoma brucei	ceramide phosphorylethanolamine synthase	0.0051	0.0306	0.0611
Loa Loa (eye worm)	hypothetical protein	0.0051	0.0306	0.1223
Echinococcus multilocularis	multidrug resistance protein 1	0.0098	0.0821	1
Loa Loa (eye worm)	hypothetical protein	0.0031	0.0086	0.0343
Entamoeba histolytica	ATP-binding cassette protein, putative	0.0031	0.0086	0.0086
Trypanosoma cruzi	multidrug resistance-associated protein, putative	0.0031	0.0086	0.0171
Trichomonas vaginalis	sphingomyelin synthetase, putative	0.0051	0.0306	0.1062
Echinococcus granulosus	ATP binding cassette subfamily B MDR:TAP	0.0098	0.0821	1
Entamoeba histolytica	P-glycoprotein-2, putative	0.0098	0.0821	0.0821
Toxoplasma gondii	ABC transporter, putative	0.0031	0.0086	0.1046
Loa Loa (eye worm)	hypothetical protein	0.0051	0.0306	0.1223
Trichomonas vaginalis	lipid A export ATP-binding/permease protein msba, putative	0.0098	0.0821	0.2846
Plasmodium vivax	multidrug resistance-associated protein 2, putative	0.0031	0.0086	0.1046
Brugia malayi	Phosphatidylcholine:ceramide cholinephosphotransferase 2	0.0051	0.0306	0.1223
Entamoeba histolytica	hypothetical protein	0.0051	0.0306	0.0306
Brugia malayi	ABC transporter	0.0029	0.0074	0.0296
Plasmodium vivax	multidrug resistance-associated protein 1, putative	0.0031	0.0086	0.1046
Leishmania major	p-glycoprotein e	0.0031	0.0086	0.0171
Plasmodium falciparum	ABC transporter B family member 7, putative	0.0031	0.0086	0.1046
Brugia malayi	multidrug Resistance Protein family member (mrp-5), putative	0.0031	0.0086	0.0343
Echinococcus multilocularis	ATP binding cassette sub family B	0.0031	0.0086	0.1046
Trichomonas vaginalis	taga, putative	0.0098	0.0821	0.2846
Leishmania major	ATP-binding cassette protein subfamily B, member 2, putative	0.0098	0.0821	0.1638
Echinococcus multilocularis	ATP binding cassette subfamily B (MDR:TAP)	0.0098	0.0821	1
Trypanosoma brucei	multidrug resistance-associated protein, putative	0.0031	0.0086	0.0171
Leishmania major	ATP-binding cassette protein subfamily C, member 1, putative	0.0031	0.0086	0.0171
Trichomonas vaginalis	set domain proteins, putative	0.0286	0.2884	1
Leishmania major	ATP-binding cassette protein subfamily B, member 1, putative	0.0031	0.0086	0.0171
Giardia lamblia	Multidrug resistance-associated protein 1	0.0029	0.0074	0.8642
Leishmania major	p-glycoprotein	0.0098	0.0821	0.1638
Entamoeba histolytica	ABC transporter, putative	0.0031	0.0086	0.0086
Plasmodium vivax	SET domain protein, putative	0.0036	0.0146	0.178
Brugia malayi	ABC transporter transmembrane region family protein	0.0029	0.0074	0.0296
Plasmodium vivax	ABC transporter B family member 7, putative	0.0031	0.0086	0.1046
Trichomonas vaginalis	multidrug resistance protein 1, 2, putative	0.0098	0.0821	0.2846
Schistosoma mansoni	histone-lysine n-methyltransferase setb1	0.0036	0.0146	0.178
Trichomonas vaginalis	multidrug resistance protein 1, 2, putative	0.0098	0.0821	0.2846
Echinococcus multilocularis	histone lysine methyltransferase setb histone lysine methyltransferase eggless	0.0036	0.0146	0.178
Loa Loa (eye worm)	ABC transporter	0.0031	0.0086	0.0343
Entamoeba histolytica	P-glyco protein 6, putative	0.0098	0.0821	0.0821
Trichomonas vaginalis	ATP-binding cassette transporter, putative	0.0098	0.0821	0.2846
Entamoeba histolytica	P-glycoprotein 5, putative	0.0029	0.0074	0.0074
Entamoeba histolytica	hypothetical protein	0.0051	0.0306	0.0306
Toxoplasma gondii	ABC transporter transmembrane region domain-containing protein	0.0031	0.0086	0.1046
Loa Loa (eye worm)	hypothetical protein	0.0097	0.0809	0.3231
Wolbachia endosymbiont of Brugia malayi	ABC-type multidrug transport system, ATPase and permease component	0.0031	0.0086	1
Trichomonas vaginalis	hypothetical protein	0.0051	0.0306	0.1062
Trypanosoma brucei	ABC transporter, mitochondrial, putative	0.0031	0.0086	0.0171
Trichomonas vaginalis	multidrug resistance protein 1, 2, putative	0.0098	0.0821	0.2846
Echinococcus multilocularis	multidrug resistance protein 1	0.0068	0.0498	0.6065
Loa Loa (eye worm)	ATP-binding cassette sub-family B member 2	0.0098	0.0821	0.3278
Trichomonas vaginalis	ABC transporter, putative	0.0098	0.0821	0.2846
Plasmodium vivax	sphingomyelin synthase 1, putative	0.0051	0.0306	0.3731
Trypanosoma cruzi	multidrug resistance-associated protein, putative	0.0031	0.0086	0.0171
Schistosoma mansoni	multidrug resistance protein	0.0098	0.0821	1
Schistosoma mansoni	multidrug resistance protein	0.0031	0.0086	0.1046
Trichomonas vaginalis	ATP-binding cassette transporter, putative	0.0098	0.0821	0.2846
Loa Loa (eye worm)	multidrug resistance protein 3	0.0098	0.0821	0.3278
Echinococcus granulosus	multidrug resistance protein 1	0.0068	0.0498	0.6065
Echinococcus granulosus	histone lysine methyltransferase setb	0.0036	0.0146	0.178
Onchocerca volvulus		0.0286	0.2884	1
Trichomonas vaginalis	lipid A export ATP-binding/permease protein msba, putative	0.0098	0.0821	0.2846
Echinococcus granulosus	ATP binding cassette sub family B	0.0029	0.0074	0.0904
Brugia malayi	ABC transporter family protein	0.0031	0.0086	0.0343
Toxoplasma gondii	ATP-binding cassette transporter ABC.B1	0.0098	0.0821	1
Trypanosoma brucei	multidrug resistance-associated protein, putative	0.0031	0.0086	0.0171
Toxoplasma gondii	hypothetical protein	0.0051	0.0306	0.3731
Plasmodium falciparum	multidrug resistance protein 1	0.0098	0.0821	1
Brugia malayi	ABC transporter transmembrane region family protein	0.0031	0.0086	0.0343
Echinococcus multilocularis	ATP binding cassette subfamily B (MDR:TAP)	0.0098	0.0821	1
Entamoeba histolytica	multidrug resistance protein, putative	0.0031	0.0086	0.0086
Chlamydia trachomatis	ABC transporter ATP binding protein/permease	0.0098	0.0821	0.5
Echinococcus multilocularis	ATP binding cassette subfamily B (MDR:TAP)	0.0098	0.0821	1
Trichomonas vaginalis	ABC transporter, putative	0.0098	0.0821	0.2846
Trichomonas vaginalis	ABC transporter, putative	0.0098	0.0821	0.2846
Entamoeba histolytica	P-glycoprotein 6, putative	0.0031	0.0086	0.0086
Trichomonas vaginalis	ATP-binding cassette transporter, putative	0.0098	0.0821	0.2846
Trypanosoma cruzi	sphingomyelin/ceramide phosphorylethanolamine synthase, bifunctional	0.048	0.5011	1
Giardia lamblia	ABC transporter, putative	0.0031	0.0086	1
Trypanosoma cruzi	ABC transporter, mitochondrial, putative	0.0031	0.0086	0.0171
Schistosoma mansoni	ATP-binding cassette sub-family B member 7 mitochondrial precursor (abc7)	0.0031	0.0086	0.1046
Trichomonas vaginalis	ATP-binding cassette transporter, putative	0.0029	0.0074	0.0257
Echinococcus multilocularis	multidrug resistance protein 1	0.0098	0.0821	1
Brugia malayi	ABC transporter transmembrane region family protein	0.0031	0.0086	0.0343
Giardia lamblia	Hypothetical protein	0.0029	0.0074	0.8642
Loa Loa (eye worm)	hypothetical protein	0.0036	0.0146	0.0583
Entamoeba histolytica	P-glycoprotein 6, putative	0.0031	0.0086	0.0086
Trichomonas vaginalis	abcb9, putative	0.0098	0.0821	0.2846
Schistosoma mansoni	spingomyelin synthetase-related	0.0051	0.0306	0.3731
Schistosoma mansoni	multidrug resistance protein	0.0098	0.0821	1
Brugia malayi	P-glycoprotein-like protein	0.0031	0.0086	0.0343
Schistosoma mansoni	smdr2	0.0098	0.0821	1
Brugia malayi	Phosphatidylcholine:ceramide cholinephosphotransferase 2	0.0051	0.0306	0.1223
Trypanosoma cruzi	multidrug resistance protein E, putative	0.0031	0.0086	0.0171
Echinococcus granulosus	multidrug resistance associated protein 7	0.0031	0.0086	0.1046
Toxoplasma gondii	ABC transporter transmembrane region domain-containing protein	0.0031	0.0086	0.1046
Leishmania major	ABC-thiol transporter	0.0031	0.0086	0.0171
Trichomonas vaginalis	ATP-binding cassette transporter, putative	0.0098	0.0821	0.2846
Toxoplasma gondii	histone lysine methyltransferase SET/SUV39	0.0036	0.0146	0.178
Echinococcus granulosus	multidrug resistance protein 1	0.0068	0.0498	0.6065
Trypanosoma brucei	inositol phosphorylceramide synthase	0.0051	0.0306	0.0611
Giardia lamblia	Multidrug resistance-associated protein Mrp2	0.0029	0.0074	0.8642
Entamoeba histolytica	ATP-binding cassette protein, putative	0.0031	0.0086	0.0086
Brugia malayi	Sphingomyelin synthase-related 1	0.0051	0.0306	0.1223
Loa Loa (eye worm)	ABC transporter transmembrane region family protein	0.0031	0.0086	0.0343
Plasmodium vivax	ABC transporter B family member 3, putative	0.0031	0.0086	0.1046
Trichomonas vaginalis	ATP-binding cassette transporter, putative	0.0068	0.0498	0.1726
Plasmodium vivax	ABC transporter B family member 5, putative	0.0031	0.0086	0.1046
Trypanosoma cruzi	sphingomyelin/ceramide phosphorylethanolamine synthase, bifunctional	0.048	0.5011	1
Brugia malayi	ABC transporter family protein	0.0031	0.0086	0.0343
Loa Loa (eye worm)	hypothetical protein	0.0051	0.0306	0.1223
Echinococcus granulosus	ATP binding cassette subfamily B MDR:TAP	0.0098	0.0821	1
Loa Loa (eye worm)	hypothetical protein	0.0051	0.0306	0.1223
Schistosoma mansoni	multidrug resistance protein	0.0031	0.0086	0.1046
Echinococcus granulosus	multidrug resistance protein 1	0.0098	0.0821	1
Trichomonas vaginalis	multidrug resistance protein 1, 2, putative	0.0098	0.0821	0.2846
Echinococcus multilocularis	ATP binding cassette sub family B	0.0097	0.0809	0.9858
Schistosoma mansoni	multidrug resistance protein	0.0031	0.0086	0.1046
Plasmodium falciparum	ABC transporter B family member 3, putative	0.0031	0.0086	0.1046
Trichomonas vaginalis	multidrug resistance protein 1, 2, putative	0.0029	0.0074	0.0257
Echinococcus granulosus	5'partial\|histone lysine N methyltransferase SETDB2	0.0035	0.0132	0.1603
Trypanosoma brucei	ABC transporter of the mitochondrion, putative	0.0031	0.0086	0.0171
Mycobacterium tuberculosis	Probable drugs-transport transmembrane ATP-binding protein ABC transporter	0.0031	0.0086	0.1046
Leishmania major	ATP-binding cassette protein subfamily C, member 8, putative	0.0031	0.0086	0.0171
Brugia malayi	ABC transporter family protein	0.0031	0.0086	0.0343

Activities

Activity type	Activity value	Assay description	Source	Reference
Potency (functional)	0.1889 uM	PubChem BioAssay. qHTS Assay for Inhibitors of the Human Apurinic/apyrimidinic Endonuclease 1 (APE1). (Class of assay: confirmatory)	ChEMBL.	No reference
Potency (functional)	0.5012 uM	PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Histone Lysine Methyltransferase G9a. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID504404]	ChEMBL.	No reference
Potency (functional)	89.1251 uM	PUBCHEM_BIOASSAY: qHTS for Inhibitors of Polymerase Iota. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID588623]	ChEMBL.	No reference
Potency (functional)	100 uM	PUBCHEM_BIOASSAY: HTS for Inhibitors of HP1-beta Chromodomain Interactions with Methylated Histone Tails. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488962]	ChEMBL.	No reference

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: CHEMBL1711958

Bibliographic References

No literature references available for this target.

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Detailed information for compound 1528679