TDR Targets

Basic information

Technical information

TDR Targets ID: 1838498
Name: ethyl 2-(2-ethoxy-2-oxoethyl)sulfanyl-4-methy l-6-phenyl-3,6-dihydropyrimidine-5-carboxylat e
MW: 362.443 | Formula: C18H22N2O4S
H donors: 1 H acceptors: 2 LogP: 2.86 Rotable bonds: 9
Rule of 5 violations (Lipinski): 1
SMILES: CCOC(=O)CSC1=NC(C(=C(N1)C)C(=O)OCC)c1ccccc1
InChi: 1S/C18H22N2O4S/c1-4-23-14(21)11-25-18-19-12(3)15(17(22)24-5-2)16(20-18)13-9-7-6-8-10-13/h6-10,16H,4-5,11H2,1-3H3,(H,19,20)
InChiKey: CSFLTOKYCLUEIU-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

ethyl 2-(2-ethoxy-2-oxo-ethyl)sulfanyl-4-methyl-6-phenyl-3,6-dihydropyrimidine-5-carboxylate
2-[(2-ethoxy-2-oxoethyl)thio]-4-methyl-6-phenyl-3,6-dihydropyrimidine-5-carboxylic acid ethyl ester
2-[(2-ethoxy-2-keto-ethyl)thio]-4-methyl-6-phenyl-3,6-dihydropyrimidine-5-carboxylic acid ethyl ester

Targets

Known targets for this compound

Species	Target name	Source	Bibliographic reference
Homo sapiens	dihydrofolate reductase	Starlite/ChEMBL	No references
Cryptosporidium parvum	dihydrofolate reductase-thymidylate synthase	Starlite/ChEMBL	No references

Predicted pathogen targets for this compound

By orthology

Species	Potential target	Known druggable target/s	Ortholog Group
Leishmania mexicana	dihydrofolate reductase-thymidylate synthase	Get druggable targets OG5_127385	All targets in OG5_127385
Onchocerca volvulus		Get druggable targets OG5_127385	All targets in OG5_127385
Echinococcus granulosus	dihydrofolate reductase	Get druggable targets OG5_128410	All targets in OG5_128410
Mycobacterium tuberculosis	Probable thymidylate synthase ThyA (ts) (TSASE)	Get druggable targets OG5_127385	All targets in OG5_127385
Brugia malayi	Dihydrofolate reductase	Get druggable targets OG5_128410	All targets in OG5_128410
Mycobacterium tuberculosis	Dihydrofolate reductase DfrA (DHFR) (tetrahydrofolate dehydrogenase)	Get druggable targets OG5_128410	All targets in OG5_128410
Neospora caninum	Bifunctional dihydrofolate reductase-thymidylate synthase, related	Get druggable targets OG5_127385	All targets in OG5_127385
Loa Loa (eye worm)	dihydrofolate reductase	Get druggable targets OG5_128410	All targets in OG5_128410
Plasmodium vivax	bifunctional dihydrofolate reductase-thymidylate synthase, putative	Get druggable targets OG5_127385	All targets in OG5_127385
Candida albicans	dihydrofolate reductase	Get druggable targets OG5_128410	All targets in OG5_128410
Schistosoma mansoni	dihydrofolate reductase	Get druggable targets OG5_128410	All targets in OG5_128410
Theileria parva	dihydrofolate reductase-thymidylate synthase, putative	Get druggable targets OG5_127385	All targets in OG5_127385
Mycobacterium leprae	DIHYDROFOLATE REDUCTASE DFRA (DHFR) (TETRAHYDROFOLATE DEHYDROGENASE)	Get druggable targets OG5_128410	All targets in OG5_128410
Echinococcus granulosus	thymidylate synthase	Get druggable targets OG5_127385	All targets in OG5_127385
Cryptosporidium parvum	dihydrofolate reductase-thymidylate synthase	Get druggable targets OG5_127385	All targets in OG5_127385
Plasmodium knowlesi	bifunctional dihydrofolate reductase-thymidylate synthase, putative	Get druggable targets OG5_127385	All targets in OG5_127385
Mycobacterium ulcerans	thymidylate synthase	Get druggable targets OG5_127385	All targets in OG5_127385
Mycobacterium leprae	PROBABLE THYMIDYLATE SYNTHASE THYA (TS) (TSASE)	Get druggable targets OG5_127385	All targets in OG5_127385
Trypanosoma cruzi	dihydrofolate reductase-thymidylate synthase	Get druggable targets OG5_127385	All targets in OG5_127385
Echinococcus multilocularis	dihydrofolate reductase	Get druggable targets OG5_128410	All targets in OG5_128410
Candida albicans	Thymidylate synthase capable of functional substitution for S. cerevisiae CDC21 (YOR074C)	Get druggable targets OG5_127385	All targets in OG5_127385
Leishmania infantum	dihydrofolate reductase-thymidylate synthase	Get druggable targets OG5_127385	All targets in OG5_127385
Schistosoma mansoni	bifunctional dihydrofolate reductase-thymidylate synthase	Get druggable targets OG5_127385	All targets in OG5_127385
Mycobacterium ulcerans	dihydrofolate reductase DfrA	Get druggable targets OG5_128410	All targets in OG5_128410
Schistosoma japonicum	hypothetical protein	Get druggable targets OG5_127385	All targets in OG5_127385
Trypanosoma brucei	dihydrofolate reductase-thymidylate synthase	Get druggable targets OG5_127385	All targets in OG5_127385
Chlamydia trachomatis	dihydrofolate reductase	Get druggable targets OG5_128410	All targets in OG5_128410
Trypanosoma brucei gambiense	dihydrofolate reductase-thymidylate synthase	Get druggable targets OG5_127385	All targets in OG5_127385
Leishmania braziliensis	dihydrofolate reductase-thymidylate synthase	Get druggable targets OG5_127385	All targets in OG5_127385
Leishmania major	dihydrofolate reductase-thymidylate synthase	Get druggable targets OG5_127385	All targets in OG5_127385
Plasmodium yoelii	thymidylate synthase, putative	Get druggable targets OG5_127385	All targets in OG5_127385
Schistosoma japonicum	ko:K00560 thymidylate synthase [EC2.1.1.45], putative	Get druggable targets OG5_127385	All targets in OG5_127385
Toxoplasma gondii	bifunctional dihydrofolate reductase-thymidylate synthase	Get druggable targets OG5_127385	All targets in OG5_127385
Cryptosporidium hominis	chain A, crystal structure of Dhfr	Get druggable targets OG5_127385	All targets in OG5_127385
Echinococcus multilocularis	thymidylate synthase	Get druggable targets OG5_127385	All targets in OG5_127385
Candida albicans	Thymidylate synthase capable of functional substitution for S. cerevisiae CDC21 (YOR074C)	Get druggable targets OG5_127385	All targets in OG5_127385
Plasmodium falciparum	bifunctional dihydrofolate reductase-thymidylate synthase	Get druggable targets OG5_127385	All targets in OG5_127385
Schistosoma japonicum	ko:K00287 dihydrofolate reductase [EC1.5.1.3], putative	Get druggable targets OG5_128410	All targets in OG5_128410
Loa Loa (eye worm)	thymidylate synthase	Get druggable targets OG5_127385	All targets in OG5_127385
Brugia malayi	thymidylate synthase	Get druggable targets OG5_127385	All targets in OG5_127385
Plasmodium berghei	bifunctional dihydrofolate reductase-thymidylate synthase, putative	Get druggable targets OG5_127385	All targets in OG5_127385
Candida albicans	hypothetical protein	Get druggable targets OG5_128410	All targets in OG5_128410
Brugia malayi	dihydrofolate reductase family protein	Get druggable targets OG5_128410	All targets in OG5_128410
Leishmania donovani	dihydrofolate reductase-thymidylate synthase	Get druggable targets OG5_127385	All targets in OG5_127385
Babesia bovis	dihydrofolate reductase/thymidilate synthase	Get druggable targets OG5_127385	All targets in OG5_127385
Candida albicans	dihydrofolate reductase	Get druggable targets OG5_128410	All targets in OG5_128410

By sequence similarity to non orthologous known druggable targets

Species	Potential target	Known druggable target	Length	Alignment span	Identity
Plasmodium falciparum	bifunctional dihydrofolate reductase-thymidylate synthase	dihydrofolate reductase	187 aa	202 aa	29.7 %

Ranking Plot

Putative Targets List

Species	Potential target	Raw	Global	Species
Trichomonas vaginalis	conserved hypothetical protein	0.0013	0.0102	0.0348
Trichomonas vaginalis	chromodomain helicase DNA binding protein, putative	0.0007	0.0039	0.0129
Echinococcus granulosus	cpg binding protein	0.0035	0.0334	0.0824
Loa Loa (eye worm)	hypothetical protein	0.0033	0.0315	0.0773
Schistosoma mansoni	hypothetical protein	0.0041	0.0404	0.1071
Trypanosoma cruzi	polo-like protein kinase, putative	0.011	0.1144	0.3891
Plasmodium falciparum	bifunctional dihydrofolate reductase-thymidylate synthase	0.0262	0.2779	1
Loa Loa (eye worm)	mbt repeat family protein	0.0055	0.0549	0.1397
Brugia malayi	latrophilin 2 splice variant baaae	0.0039	0.038	0.1318
Loa Loa (eye worm)	pre-SET domain-containing protein family protein	0.024	0.2543	0.6723
Trichomonas vaginalis	conserved hypothetical protein	0.0062	0.0623	0.2144
Schistosoma mansoni	importin beta-1	0.0033	0.0315	0.0837
Schistosoma mansoni	hypothetical protein	0.0109	0.1131	0.3
Loa Loa (eye worm)	pigment dispersing factor receptor c	0.0057	0.0576	0.1468
Schistosoma mansoni	histone-lysine n-methyltransferase setb1	0.0035	0.0336	0.0891
Loa Loa (eye worm)	MBCTL1	0.0062	0.0631	0.1616
Trichomonas vaginalis	conserved hypothetical protein	0.0007	0.0039	0.0129
Onchocerca volvulus	Serine\/threonine kinase homolog	0.011	0.1144	0.3944
Mycobacterium tuberculosis	Probable thymidylate synthase ThyA (ts) (TSASE)	0.013	0.1355	0.3423
Schistosoma mansoni	hypothetical protein	0.0039	0.038	0.1009
Echinococcus granulosus	kelch ECH associated protein 1 like	0.0109	0.1128	0.2943
Trichomonas vaginalis	CAMK family protein kinase	0.011	0.1144	0.3941
Trichomonas vaginalis	ran, putative	0.0024	0.0221	0.0758
Brugia malayi	mbt repeat family protein	0.0055	0.0549	0.1902
Schistosoma mansoni	hypothetical protein	0.0018	0.0154	0.0408
Echinococcus granulosus	dihydrofolate reductase	0.026	0.2762	0.7307
Echinococcus multilocularis	polycomb protein SCMH1	0.0055	0.0549	0.0525
Trichomonas vaginalis	conserved hypothetical protein	0.0007	0.0039	0.0129
Trichomonas vaginalis	CAMK family protein kinase	0.011	0.1144	0.3941
Echinococcus granulosus	kelch ECH associated protein 1	0.0109	0.1128	0.2943
Echinococcus granulosus	5'partial\|histone lysine N methyltransferase SETDB2	0.0033	0.0314	0.0771
Echinococcus granulosus	thymidylate synthase	0.013	0.1355	0.3549
Loa Loa (eye worm)	hypothetical protein	0.0272	0.2887	0.764
Trichomonas vaginalis	conserved hypothetical protein	0.0013	0.0102	0.0348
Toxoplasma gondii	HEAT repeat-containing protein	0.0033	0.0315	0.1052
Loa Loa (eye worm)	hypothetical protein	0.0035	0.0336	0.0828
Trichomonas vaginalis	CAMK family protein kinase	0.0055	0.0553	0.1903
Trypanosoma cruzi	Vps23 core domain containing protein, putative	0.0026	0.0234	0.0491
Echinococcus granulosus	serine:threonine protein kinase PLK1	0.011	0.1144	0.2985
Entamoeba histolytica	hypothetical protein	0.0013	0.0102	0.0893
Trypanosoma brucei	Vps23 core domain containing protein, putative	0.0026	0.0234	0.0755
Echinococcus granulosus	kelch ECH associated protein 1 like	0.0109	0.1128	0.2943
Trichomonas vaginalis	CAMK family protein kinase	0.011	0.1144	0.3941
Plasmodium vivax	importin-beta 2, putative	0.0033	0.0315	0.1052
Brugia malayi	Latrophilin receptor protein 2	0.0018	0.0154	0.0532
Schistosoma mansoni	cpg binding protein	0.0033	0.0314	0.0833
Trichomonas vaginalis	hypothetical protein	0.0006	0.0026	0.0084
Loa Loa (eye worm)	hypothetical protein	0.0018	0.0154	0.0341
Echinococcus multilocularis	survival motor neuron protein 1	0.0272	0.2887	0.2868
Brugia malayi	calcium-independent alpha-latrotoxin receptor 2, putative	0.0018	0.0154	0.0532
Schistosoma mansoni	mixed-lineage leukemia protein mll	0.0071	0.0726	0.1926
Schistosoma mansoni	tsg101-related	0.0067	0.0675	0.1792
Trypanosoma cruzi	importin beta-1 subunit, putative	0.0027	0.0248	0.0544
Echinococcus granulosus	snurportin 1	0.0354	0.377	1
Echinococcus multilocularis	dihydrofolate reductase	0.026	0.2762	0.2743
Loa Loa (eye worm)	hypothetical protein	0.0039	0.038	0.0947
Brugia malayi	hypothetical protein	0.008	0.082	0.2839
Echinococcus granulosus	endonuclease exonuclease phosphatase	0.0216	0.2286	0.6036
Entamoeba histolytica	Ran family GTPase	0.0024	0.0221	0.1931
Echinococcus multilocularis	tumor susceptibility gene 101 protein	0.008	0.082	0.0796
Echinococcus granulosus	cadherin EGF LAG seven pass G type receptor	0.0018	0.0154	0.0341
Brugia malayi	thymidylate synthase	0.013	0.1355	0.4694
Schistosoma mansoni	serine/threonine protein kinase	0.011	0.1144	0.3033
Trichomonas vaginalis	set domain proteins, putative	0.0273	0.2899	1
Toxoplasma gondii	histone lysine methyltransferase SET/SUV39	0.0035	0.0336	0.1126
Brugia malayi	Calcitonin receptor-like protein seb-1	0.0057	0.0576	0.1994
Schistosoma mansoni	bifunctional dihydrofolate reductase-thymidylate synthase	0.013	0.1355	0.3594
Trichomonas vaginalis	hypothetical protein	0.0039	0.0378	0.1298
Trichomonas vaginalis	chromodomain-helicase-DNA-binding protein, putative	0.0007	0.0039	0.0129
Echinococcus granulosus	tumor susceptibility gene 101 protein	0.008	0.082	0.212
Echinococcus granulosus	GTP binding nuclear protein Ran	0.0024	0.0221	0.0521
Loa Loa (eye worm)	dihydrofolate reductase	0.026	0.2762	0.7307
Brugia malayi	Corticotropin releasing factor receptor 2 precursor, putative	0.0234	0.2475	0.8573
Echinococcus multilocularis	Kelch repeat type 1	0.0109	0.1131	0.1108
Schistosoma mansoni	sex comb on midleg homolog	0.0055	0.0549	0.1456
Mycobacterium ulcerans	dihydrofolate reductase DfrA	0.026	0.2762	1
Leishmania major	GTP-binding protein, putative	0.0024	0.0221	0.0709
Leishmania major	protein kinase, putative,polo-like protein kinase, putative	0.011	0.1144	0.4061
Brugia malayi	hypothetical protein	0.0062	0.0623	0.2157
Schistosoma mansoni	cpg binding protein	0.0035	0.0334	0.0887
Trypanosoma cruzi	dihydrofolate reductase-thymidylate synthase, putative	0.0062	0.0623	0.1944
Schistosoma mansoni	ran	0.0024	0.0221	0.0587
Brugia malayi	dihydrofolate reductase family protein	0.026	0.2762	0.9568
Schistosoma mansoni	scm-relatedprotein containing 4 mbt domains (sfmbt)	0.0055	0.0549	0.1456
Echinococcus multilocularis	diuretic hormone 44 receptor GPRdih2	0.0195	0.2053	0.2032
Leishmania major	hypothetical protein, conserved	0.0026	0.0234	0.0755
Echinococcus multilocularis	importin subunit beta 1	0.0033	0.0315	0.029
Entamoeba histolytica	hypothetical protein	0.0041	0.0404	0.353
Trypanosoma cruzi	dihydrofolate reductase-thymidylate synthase	0.0262	0.2779	1
Echinococcus granulosus	GPCR family 2	0.0018	0.0154	0.0341
Brugia malayi	Iron-sulfur cluster assembly accessory protein	0.0055	0.0556	0.1925
Echinococcus granulosus	histone lysine methyltransferase setb	0.0035	0.0336	0.0828
Entamoeba histolytica	tumor susceptibility gene 101 protein, putative	0.0054	0.0544	0.4756
Brugia malayi	serine/threonine-protein kinase plk-2	0.011	0.1144	0.3962
Echinococcus granulosus	polycomb protein SCMH1	0.0055	0.0549	0.1397
Schistosoma mansoni	histone-lysine n-methyltransferase setb1	0.0035	0.0336	0.0891
Trichomonas vaginalis	conserved hypothetical protein	0.0007	0.0039	0.0129
Trichomonas vaginalis	conserved hypothetical protein	0.0007	0.0039	0.0129
Schistosoma mansoni	mixed-lineage leukemia protein mll	0.0009	0.006	0.016
Echinococcus granulosus	SAM and MBT domain containing protein	0.0055	0.0549	0.1397
Echinococcus multilocularis	thymidylate synthase	0.013	0.1355	0.1332
Brugia malayi	hypothetical protein	0.0041	0.0404	0.1399
Schistosoma mansoni	ran	0.0024	0.0221	0.0587
Trichomonas vaginalis	CAMK family protein kinase	0.011	0.1144	0.3941
Schistosoma mansoni	hypothetical protein	0.0018	0.0154	0.0408
Trichomonas vaginalis	conserved hypothetical protein	0.0007	0.0039	0.0129
Schistosoma mansoni	cpg binding protein	0.0035	0.0334	0.0887
Trichomonas vaginalis	conserved hypothetical protein	0.0007	0.0039	0.0129
Onchocerca volvulus		0.0273	0.2899	1
Trichomonas vaginalis	chromodomain helicase DNA binding protein, putative	0.0007	0.0039	0.0129
Echinococcus multilocularis	histone acetyltransferase MYST2	0.0062	0.0631	0.0606
Entamoeba histolytica	hypothetical protein	0.0027	0.0248	0.2165
Brugia malayi	Pre-SET motif family protein	0.0035	0.0336	0.1163
Toxoplasma gondii	GTP-binding nuclear protein ran/tc4	0.0024	0.0221	0.0709
Echinococcus granulosus	suppression of tumorigenicity 18 protein	0.0062	0.0631	0.1616
Echinococcus granulosus	diuretic hormone 44 receptor GPRdih2	0.0195	0.2053	0.5413
Trypanosoma cruzi	polo-like protein kinase, putative	0.011	0.1144	0.3891
Schistosoma mansoni	hypothetical protein	0.0018	0.0154	0.0408
Trypanosoma brucei	importin beta-1 subunit, putative	0.0033	0.0315	0.1052
Schistosoma mansoni	mixed-lineage leukemia protein mll	0.0006	0.0023	0.0061
Echinococcus multilocularis	histone lysine N methyltransferase MLL3	0.0011	0.0082	0.0056
Echinococcus multilocularis	GTP binding nuclear protein Ran	0.0024	0.0221	0.0196
Loa Loa (eye worm)	hypothetical protein	0.0234	0.2475	0.654
Onchocerca volvulus	Polycomb protein Sfmbt homolog	0.0055	0.0549	0.1894
Plasmodium falciparum	importin beta, putative	0.0033	0.0315	0.1134
Echinococcus granulosus	mixed lineage leukemia protein mll	0.0009	0.006	0.0092
Entamoeba histolytica	hypothetical protein	0.0041	0.0404	0.353
Plasmodium falciparum	transportin	0.0006	0.0026	0.0092
Plasmodium vivax	GTP-binding nuclear protein RAN/TC4, putative	0.0024	0.0221	0.0709
Schistosoma mansoni	hypothetical protein	0.0334	0.3549	0.9414
Brugia malayi	GTP-binding nuclear protein RAN/TC4	0.0024	0.0221	0.0766
Echinococcus granulosus	Basic leucine zipper bZIP transcription	0.0041	0.0404	0.1009
Entamoeba histolytica	serine/threonine protein kinase, putative	0.011	0.1144	1
Trichomonas vaginalis	conserved hypothetical protein	0.0007	0.0039	0.0129
Entamoeba histolytica	hypothetical protein	0.0041	0.0404	0.353
Leishmania major	dihydrofolate reductase-thymidylate synthase	0.0262	0.2779	1
Schistosoma mansoni	myelin transcription factor 1 myt1	0.0062	0.0631	0.1673
Giardia lamblia	Kinase, PLK	0.011	0.1144	1
Schistosoma mansoni	importin-beta 2	0.0006	0.0026	0.0069
Brugia malayi	kap beta 3 protein	0.0006	0.0026	0.009
Echinococcus multilocularis	GPCR, family 2	0.0018	0.0154	0.0128
Schistosoma mansoni	histone-lysine n-methyltransferase suv9	0.0035	0.0336	0.0891
Trichomonas vaginalis	Importin beta-1 subunit, putative	0.0027	0.0248	0.085
Echinococcus multilocularis	kelch ECH associated protein 1	0.0109	0.1128	0.1105
Trypanosoma brucei	polo-like protein kinase	0.011	0.1144	0.4061
Loa Loa (eye worm)	hypothetical protein	0.0055	0.0549	0.1397
Brugia malayi	RNA, U transporter 1	0.0094	0.0974	0.3373
Schistosoma mansoni	tsg101-related	0.0054	0.0544	0.1443
Echinococcus multilocularis	endonuclease exonuclease phosphatase	0.0216	0.2286	0.2266
Toxoplasma gondii	bifunctional dihydrofolate reductase-thymidylate synthase	0.0262	0.2779	1
Schistosoma mansoni	hypothetical protein	0.0018	0.0154	0.0408
Loa Loa (eye worm)	hypothetical protein	0.008	0.082	0.212
Echinococcus multilocularis	histone lysine N methyltransferase MLL3	0.0009	0.006	0.0035
Trichomonas vaginalis	conserved hypothetical protein	0.0007	0.0039	0.0129
Trichomonas vaginalis	chromodomain helicase DNA binding protein, putative	0.0007	0.0039	0.0129
Brugia malayi	hypothetical protein	0.0272	0.2887	1
Entamoeba histolytica	hypothetical protein	0.0013	0.0102	0.0893
Brugia malayi	Importin beta-1 subunit	0.0033	0.0315	0.1093
Echinococcus multilocularis	histone lysine methyltransferase setb histone lysine methyltransferase eggless	0.0035	0.0336	0.0311
Loa Loa (eye worm)	PLK/PLK1 protein kinase	0.011	0.1144	0.2985
Schistosoma mansoni	tsg101-related	0.0067	0.0675	0.1792
Brugia malayi	Dihydrofolate reductase	0.026	0.2762	0.9568
Trypanosoma brucei	GTP-binding nuclear protein rtb2, putative	0.0024	0.0221	0.0709
Trichomonas vaginalis	Importin beta-1 subunit, putative	0.0027	0.0248	0.085
Echinococcus granulosus	histone acetyltransferase MYST2	0.0062	0.0631	0.1616
Echinococcus multilocularis	Basic leucine zipper (bZIP) transcription	0.0041	0.0404	0.0379
Schistosoma mansoni	sex comb on midleg homolog	0.0055	0.0549	0.1456
Toxoplasma gondii	histone lysine methyltransferase SET1	0.0064	0.0646	0.2252
Trypanosoma brucei	importin beta-1 subunit, putative	0.0033	0.0315	0.1052
Brugia malayi	C2-HC type zinc finger protein C.e-MyT1	0.0062	0.0631	0.2185
Schistosoma mansoni	dihydrofolate reductase	0.026	0.2762	0.7326
Trypanosoma cruzi	GTP-binding nuclear protein rtb2, putative	0.0024	0.0221	0.0444
Loa Loa (eye worm)	nucleolar RNA-associated protein alpha	0.0354	0.377	1
Echinococcus multilocularis	serine:threonine protein kinase PLK1	0.011	0.1144	0.1121
Entamoeba histolytica	hypothetical protein	0.0013	0.0102	0.0893
Schistosoma mansoni	survival motor neuron protein	0.0055	0.0556	0.1474
Schistosoma mansoni	kinase	0.0057	0.0568	0.1508
Brugia malayi	mbt repeat family protein	0.0055	0.0549	0.1902
Trypanosoma cruzi	GTP-binding nuclear protein rtb2, putative	0.0024	0.0221	0.0444
Leishmania major	importin beta-1 subunit, putative	0.0027	0.0248	0.0806
Schistosoma mansoni	histone-lysine n-methyltransferase setb1	0.0035	0.0336	0.0891
Chlamydia trachomatis	dihydrofolate reductase	0.026	0.2762	0.5
Trypanosoma brucei	ULK family serine/threonine-protein kinase, putative	0.0008	0.0045	0.007
Schistosoma mansoni	hypothetical protein	0.0055	0.0556	0.1474
Trichomonas vaginalis	chromodomain helicase DNA binding protein, putative	0.0007	0.0039	0.0129
Trichomonas vaginalis	conserved hypothetical protein	0.0007	0.0039	0.0129
Loa Loa (eye worm)	CXXC zinc finger family protein	0.0033	0.0314	0.0769
Trichomonas vaginalis	chromodomain-helicase-DNA-binding protein, putative	0.0007	0.0039	0.0129
Loa Loa (eye worm)	histone methyltransferase	0.0011	0.0082	0.015
Echinococcus granulosus	histone lysine N methyltransferase MLL3	0.0009	0.006	0.0092
Entamoeba histolytica	HEAT repeat domain containing protein	0.0006	0.0026	0.0224
Echinococcus granulosus	importin subunit beta 1	0.0033	0.0315	0.0773
Trichomonas vaginalis	helicase, putative	0.0007	0.0039	0.0129
Trichomonas vaginalis	CAMK family protein kinase	0.011	0.1144	0.3941
Loa Loa (eye worm)	GTP-binding nuclear protein RAN/TC4	0.0024	0.0221	0.0521
Brugia malayi	Pre-SET motif family protein	0.024	0.2543	0.8811
Mycobacterium tuberculosis	Dihydrofolate reductase DfrA (DHFR) (tetrahydrofolate dehydrogenase)	0.026	0.2762	1
Brugia malayi	CXXC zinc finger family protein	0.0033	0.0314	0.1088
Onchocerca volvulus		0.013	0.1355	0.4673
Echinococcus multilocularis	cadherin EGF LAG seven pass G type receptor	0.0018	0.0154	0.0128
Brugia malayi	F/Y-rich N-terminus family protein	0.0011	0.0081	0.0279
Trypanosoma brucei	dihydrofolate reductase-thymidylate synthase	0.0262	0.2779	1
Echinococcus granulosus	histone lysine N methyltransferase MLL3	0.0011	0.0082	0.015
Onchocerca volvulus		0.0055	0.0556	0.1916
Onchocerca volvulus		0.0035	0.0336	0.1158
Loa Loa (eye worm)	latrophilin receptor protein 2	0.0018	0.0154	0.0341
Trichomonas vaginalis	chromodomain helicase DNA binding protein, putative	0.0007	0.0039	0.0129
Echinococcus multilocularis	kelch ECH associated protein 1	0.0109	0.1128	0.1105
Trichomonas vaginalis	importin beta-1, putative	0.0027	0.0248	0.085
Echinococcus multilocularis	suppression of tumorigenicity 18 protein	0.0062	0.0631	0.0606
Loa Loa (eye worm)	hypothetical protein	0.0062	0.0631	0.1616
Loa Loa (eye worm)	thymidylate synthase	0.013	0.1355	0.3549
Echinococcus granulosus	survival motor neuron protein 1	0.0272	0.2887	0.764
Plasmodium vivax	bifunctional dihydrofolate reductase-thymidylate synthase, putative	0.0262	0.2779	1
Onchocerca volvulus		0.0055	0.0549	0.1894
Mycobacterium leprae	DIHYDROFOLATE REDUCTASE DFRA (DHFR) (TETRAHYDROFOLATE DEHYDROGENASE)	0.026	0.2762	1
Trypanosoma brucei	UEV domain/Zinc finger, C3HC4 type (RING finger), putative	0.0013	0.0102	0.0278
Echinococcus multilocularis	cpg binding protein	0.0035	0.0334	0.0309
Echinococcus multilocularis	mixed lineage leukemia protein mll	0.0009	0.006	0.0035
Trichomonas vaginalis	CAMK family protein kinase	0.011	0.1144	0.3941
Onchocerca volvulus		0.0033	0.0314	0.1083
Schistosoma mansoni	hypothetical protein	0.0354	0.377	1
Plasmodium falciparum	GTP-binding nuclear protein RAN/TC4	0.0024	0.0221	0.0795
Echinococcus multilocularis	SAM and MBT domain containing protein	0.0055	0.0549	0.0525
Entamoeba histolytica	hypothetical protein	0.0041	0.0404	0.353
Schistosoma mansoni	peptidase	0.0005	0.0015	0.0039
Echinococcus multilocularis	snurportin 1	0.0354	0.377	0.3754
Schistosoma mansoni	transcription factor LCR-F1	0.0041	0.0404	0.1071
Trichomonas vaginalis	CAMK family protein kinase	0.011	0.1144	0.3941
Trichomonas vaginalis	CAMK family protein kinase	0.0055	0.0553	0.1903
Entamoeba histolytica	hypothetical protein	0.0013	0.0102	0.0893
Echinococcus multilocularis	histone lysine N methyltransferase SETMAR	0.0035	0.0336	0.0311
Trichomonas vaginalis	chromodomain helicase DNA binding protein, putative	0.0007	0.0039	0.0129
Plasmodium vivax	SET domain protein, putative	0.0035	0.0336	0.1126

Activities

Activity type	Activity value	Assay description	Source	Reference
Activity (functional)		Antiparasitic activity Toxoplasma gondii RH infected Swiss albino mouse assessed as clear lymphocytes in host liver focal granuloma at 0.25 mg, po administered 48 hr post-infection measured after 3 days by haematoxylin and eosin staining relative to control	ChEMBL.	No reference
Activity (functional)		Antiparasitic activity against Toxoplasma gondii RH infected Swiss albino mouse assessed as decrease in tachozyte count in liver at 0.25 mg, po administered 48 hr post-infection measured after 3 days by Geimsa staining relative to control	ChEMBL.	No reference
Activity (functional)		Antiparasitic activity Toxoplasma gondii RH infected Swiss albino mouse assessed as decrease in host spleen white pulp at 0.25 mg, po administered 48 hr post-infection measured after 3 days by haematoxylin and eosin staining relative to control	ChEMBL.	No reference
Activity (functional)		Antiparasitic activity Toxoplasma gondii RH infected Swiss albino mouse assessed as decrease in interstitial pneumonia at 0.25 mg, po administered 48 hr post-infection measured after 3 days by haematoxylin and eosin staining relative to control	ChEMBL.	No reference
Activity (functional)		Antiparasitic activity Toxoplasma gondii RH infected Swiss albino mouse assessed as decrease in host liver necrosis at 0.25 mg, po administered 48 hr post-infection measured after 3 days by haematoxylin and eosin staining relative to control	ChEMBL.	No reference
Activity (functional)		Antiparasitic activity Toxoplasma gondii RH infected Swiss albino mouse assessed as decrease in host lung congestion at 0.25 mg, po administered 48 hr post-infection measured after 3 days by haematoxylin and eosin staining relative to control	ChEMBL.	No reference
Activity (functional)		Antiparasitic activity Toxoplasma gondii RH infected Swiss albino mouse assessed as decrease in Toxoplasma antigen in host serum at 0.25 mg, po administered 48 hr post-infection measured after 3 days by Co-A test relative to control	ChEMBL.	No reference
Activity (functional)		Antiparasitic activity Toxoplasma gondii RH infected Swiss albino mouse assessed as epethelioid granuloma in host spleen at 0.25 mg, po administered 48 hr post-infection measured after 3 days by haematoxylin and eosin staining relative to control	ChEMBL.	No reference
Activity (functional)		Antiparasitic activity Toxoplasma gondii RH infected Swiss albino mouse assessed as decreased parasite movement in host peritoneal exudate at 0.25 mg, po administered 48 hr post-infection measured after 3 days by light microscopic analysis	ChEMBL.	No reference
Activity (functional)		Antiparasitic activity against Toxoplasma gondii RH infected Swiss albino mouse assessed as decrease in tachozyte count in spleen at 0.25 mg, po administered 48 hr post-infection measured after 3 days by Geimsa staining relative to control	ChEMBL.	No reference
Activity (functional)		Antiparasitic activity Toxoplasma gondii RH infected Swiss albino mouse assessed as decrease in host spleen necrosis at 0.25 mg, po administered 48 hr post-infection measured after 3 days by haematoxylin and eosin staining relative to control	ChEMBL.	No reference
Activity (functional)		Antiparasitic activity Toxoplasma gondii RH infected Swiss albino mouse assessed as clear mononuclear cells in host liver focal granuloma at 0.25 mg, po administered 48 hr post-infection measured after 3 days by haematoxylin and eosin staining relative to control	ChEMBL.	No reference
Activity (functional)		Antiparasitic activity Toxoplasma gondii RH infected Swiss albino mouse assessed as increase in host spleen red pulp at 0.25 mg, po administered 48 hr post-infection measured after 3 days by haematoxylin and eosin staining relative to control	ChEMBL.	No reference
Activity (functional)		Antiparasitic activity Toxoplasma gondii RH infected Swiss albino mouse assessed as extramedullary hematopoiesis in host spleen at 0.25 mg, po administered 48 hr post-infection measured after 3 days by haematoxylin and eosin staining relative to control	ChEMBL.	No reference
Activity (functional)		Antiparasitic activity Toxoplasma gondii RH infected Swiss albino mouse assessed as parasite deformity in host peritoneal exudate at 0.25 mg, po administered 48 hr post-infection measured after 3 days by light microscopic analysis	ChEMBL.	No reference
Activity (functional)		Antiparasitic activity Toxoplasma gondii RH infected Swiss albino mouse assessed as megakaryocytes in host spleen at 0.25 mg, po administered 48 hr post-infection measured after 3 days by haematoxylin and eosin staining relative to control	ChEMBL.	No reference
IC50 (binding)	= 0.83 uM	Inhibition of Homo sapiens (human) dihydrofolate reductase using dihydrofolate as substrate incubated for 5 min prior to substrate addition by spectrophotometric assay	ChEMBL.	No reference
IC50 (binding)	= 3.2 uM	Inhibition of Cryptosporidium parvum recombinant DHFR using dihydrofolate as substrate incubated for 5 min prior to substrate addition by spectrophotometric assay	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: CHEMBL2261694

Bibliographic References

No literature references available for this target.

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Detailed information for compound 1838498