TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 315.365 | Formula: C16H14FN3OS
H donors: 1 H acceptors: 2 LogP: 3.74 Rotable bonds: 4
Rule of 5 violations (Lipinski): 1
SMILES: Cc1cc(F)c2c(c1)n(cn2)c1ccc(s1)C(=O)NC1CC1
InChi: 1S/C16H14FN3OS/c1-9-6-11(17)15-12(7-9)20(8-18-15)14-5-4-13(22-14)16(21)19-10-2-3-10/h4-8,10H,2-3H2,1H3,(H,19,21)
InChiKey: DWRKVSYIKPLTLO-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	dihydroorotate dehydrogenase (quinone)	Starlite/ChEMBL	References
Plasmodium falciparum	dihydroorotate dehydrogenase	Starlite/ChEMBL	References

Predicted pathogen targets for this compound

By orthology

Species	Potential target	Known druggable target/s	Ortholog Group
Plasmodium falciparum	dihydroorotate dehydrogenase	Get druggable targets OG5_127289	All targets in OG5_127289
Mycobacterium ulcerans	dihydroorotate dehydrogenase 2	Get druggable targets OG5_127289	All targets in OG5_127289
Plasmodium berghei	dihydroorotate dehydrogenase, putative	Get druggable targets OG5_127289	All targets in OG5_127289
Wolbachia endosymbiont of Brugia malayi	dihydroorotate dehydrogenase 2	Get druggable targets OG5_127289	All targets in OG5_127289
Theileria parva	dihydroorotate dehydrogenase, putative	Get druggable targets OG5_127289	All targets in OG5_127289
Leishmania infantum	dihydroorotate dehydrogenase;with=GeneDB:LmjF16.0530	Get druggable targets OG5_127289	All targets in OG5_127289
Brugia malayi	Dihydroorotate dehydrogenase, mitochondrial precursor, putative	Get druggable targets OG5_127289	All targets in OG5_127289
Leishmania major	dihydroorotate dehydrogenase	Get druggable targets OG5_127289	All targets in OG5_127289
Plasmodium yoelii	dihydroorotate dehydrogenase, putative	Get druggable targets OG5_127289	All targets in OG5_127289
Plasmodium knowlesi	dihydroorotate dehydrogenase, putative	Get druggable targets OG5_127289	All targets in OG5_127289
Babesia bovis	dihydroorotate dehydrogenase	Get druggable targets OG5_127289	All targets in OG5_127289
Trypanosoma cruzi	dihydroorotate dehydrogenase, putative	Get druggable targets OG5_127289	All targets in OG5_127289
Trypanosoma brucei	dihydroorotate dehydrogenase (fumarate)	Get druggable targets OG5_127289	All targets in OG5_127289
Schistosoma japonicum	ko:K00226 dihydroorotate oxidase [EC1.3.3.1], putative	Get druggable targets OG5_127289	All targets in OG5_127289
Trypanosoma cruzi	dihydroorotate dehydrogenase (fumarate), putative	Get druggable targets OG5_127289	All targets in OG5_127289
Mycobacterium leprae	Probable dihydroorotate dehydrogenase PyrD	Get druggable targets OG5_127289	All targets in OG5_127289
Trypanosoma congolense	dihydroorotate dehydrogenase, putative	Get druggable targets OG5_127289	All targets in OG5_127289
Schistosoma mansoni	dihydroorotate dehydrogenase	Get druggable targets OG5_127289	All targets in OG5_127289
Leishmania donovani	dihydroorotate dehydrogenase	Get druggable targets OG5_127289	All targets in OG5_127289
Trypanosoma brucei gambiense	dihydroorotate dehydrogenase, putative	Get druggable targets OG5_127289	All targets in OG5_127289
Plasmodium vivax	dihydroorotate dehydrogenase, mitochondrial precursor, putative	Get druggable targets OG5_127289	All targets in OG5_127289
Candida albicans	likely dihydroorotate oxidase similar to S. pombe ura3 (SPAC57A10.12c) and to S. cerevisiae URA1 (YKL216W) involved in pyrimidin	Get druggable targets OG5_127289	All targets in OG5_127289
Toxoplasma gondii	dihydroorotate dehydrogenase reveal, putative	Get druggable targets OG5_127289	All targets in OG5_127289
Mycobacterium tuberculosis	Probable dihydroorotate dehydrogenase PyrD	Get druggable targets OG5_127289	All targets in OG5_127289
Leishmania mexicana	dihydroorotate dehydrogenase, putative	Get druggable targets OG5_127289	All targets in OG5_127289
Leishmania braziliensis	dihydroorotate dehydrogenase	Get druggable targets OG5_127289	All targets in OG5_127289
Candida albicans	likely dihydroorotate oxidase similar to S. pombe ura3 (SPAC57A10.12c) and to S. cerevisiae URA1 (YKL216W) involved in pyrimidin	Get druggable targets OG5_127289	All targets in OG5_127289
Trypanosoma cruzi	dihydroorotate dehydrogenase, putative	Get druggable targets OG5_127289	All targets in OG5_127289
Neospora caninum	dihydroorotate dehydrogenase, putative	Get druggable targets OG5_127289	All targets in OG5_127289
Brugia malayi	Dihydroorotate dehydrogenase, mitochondrial precursor, putative	Get druggable targets OG5_127289	All targets in OG5_127289

By sequence similarity to non orthologous known druggable targets

Species	Potential target	Known druggable target	Length	Alignment span	Identity
Echinococcus granulosus	dihydropyrimidine dehydrogenase NADP	dihydroorotate dehydrogenase (quinone)	395 aa	361 aa	24.6 %

Ranking Plot

Putative Targets List

Species	Potential target	Raw	Global	Species
Schistosoma mansoni	hypothetical protein	0.005	0.0235	0.0395
Loa Loa (eye worm)	pyruvate kinase-PB	0.0023	0.0044	0.0068
Trypanosoma cruzi	dihydroorotate dehydrogenase (fumarate), putative	0.04	0.2768	1
Echinococcus multilocularis	neutral alpha glucosidase AB	0.0036	0.0136	0.0136
Echinococcus granulosus	geminin	0.0195	0.1283	0.1283
Echinococcus multilocularis	pyruvate kinase	0.0026	0.0066	0.0066
Echinococcus granulosus	Basic leucine zipper bZIP transcription	0.0114	0.0704	0.0704
Schistosoma mansoni	tar DNA-binding protein	0.0203	0.1347	0.2266
Trypanosoma cruzi	hypothetical protein, conserved	0.0036	0.0136	0.0483
Toxoplasma gondii	histone lysine methyltransferase SET/SUV39	0.0125	0.0777	0.2808
Trypanosoma brucei	unspecified product	0.0019	0.0016	0.005
Schistosoma mansoni	pyruvate kinase	0.0033	0.0117	0.0196
Echinococcus granulosus	cadherin EGF LAG seven pass G type receptor	0.005	0.0235	0.0235
Brugia malayi	Zinc finger, C2H2 type family protein	0.0156	0.1006	0.1632
Trypanosoma brucei	glucosidase, putative	0.0036	0.0136	0.0483
Leishmania major	target of rapamycin kinase (TOR) kinase 3	0.0041	0.0174	0.0621
Loa Loa (eye worm)	pigment dispersing factor receptor c	0.0156	0.1008	0.1635
Mycobacterium ulcerans	glutaminase	0.084	0.5945	1
Trypanosoma cruzi	PAB1-binding protein , putative	0.0025	0.0058	0.0204
Echinococcus granulosus	lysosomal alpha glucosidase	0.0161	0.1042	0.1042
Toxoplasma gondii	dihydroorotate dehydrogenase reveal, putative	0.04	0.2768	1
Trichomonas vaginalis	glutaminase, putative	0.084	0.5945	0.8468
Trypanosoma brucei	DNA polymerase kappa, putative	0.0019	0.0016	0.005
Trichomonas vaginalis	alpha-glucosidase, putative	0.0036	0.0136	0.019
Schistosoma mansoni	hypothetical protein	0.0195	0.1283	0.2158
Leishmania major	target of rapamycin (TOR) kinase 2, putative	0.0052	0.025	0.0896
Echinococcus granulosus	GPCR family 2	0.005	0.0235	0.0235
Trichomonas vaginalis	ap endonuclease, putative	0.0022	0.0033	0.0044
Giardia lamblia	GTOR	0.0052	0.025	1
Toxoplasma gondii	pyruvate kinase PyK1	0.0033	0.0117	0.0421
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0041	0.0174	0.0244
Echinococcus multilocularis	survival motor neuron protein 1	0.0486	0.3392	0.3392
Trichomonas vaginalis	myo inositol monophosphatase, putative	0.0117	0.0726	0.1031
Onchocerca volvulus		0.0093	0.0551	0.0629
Leishmania major	alpha glucosidase II subunit, putative	0.0036	0.0136	0.0483
Schistosoma mansoni	hypothetical protein	0.005	0.0235	0.0395
Onchocerca volvulus		0.0125	0.0777	0.0957
Entamoeba histolytica	pyruvate kinase, putative	0.0023	0.0044	0.0284
Echinococcus multilocularis	mitochondrial import inner membrane translocase subunit TIM23, putative	0.0043	0.019	0.019
Schistosoma mansoni	ataxia telangiectasia mutated (atm)-related	0.0052	0.025	0.042
Loa Loa (eye worm)	transcription factor SMAD2	0.0127	0.0794	0.1287
Plasmodium falciparum	AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative	0.0022	0.0033	0.012
Echinococcus multilocularis	diuretic hormone 44 receptor GPRdih2	0.005	0.0235	0.0235
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0028	0.0078	0.0109
Trypanosoma cruzi	DNA polymerase kappa, putative	0.0019	0.0016	0.005
Brugia malayi	Calcitonin receptor-like protein seb-1	0.0156	0.1008	0.1635
Brugia malayi	Mitochondrial import inner membrane translocase subunit Tim17 family protein	0.0043	0.019	0.0306
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0031	0.01	0.0139
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0052	0.025	0.0353
Schistosoma mansoni	tar DNA-binding protein	0.0203	0.1347	0.2266
Entamoeba histolytica	myo-inositol monophosphatase, putative	0.0117	0.0726	0.717
Trypanosoma brucei	FAT domain/Rapamycin binding domain/Phosphatidylinositol 3- and 4-kinase, putative	0.0021	0.0032	0.0108
Onchocerca volvulus		0.0205	0.1359	0.1799
Echinococcus multilocularis	pyruvate kinase	0.0033	0.0117	0.0117
Entamoeba histolytica	FKBP-rapamycin associated protein (FRAP), putative	0.0052	0.025	0.2363
Trypanosoma brucei	DNA polymerase kappa, putative	0.0019	0.0016	0.005
Schistosoma mansoni	histone-lysine n-methyltransferase setb1	0.0125	0.0777	0.1307
Loa Loa (eye worm)	inositol-1	0.0117	0.0726	0.1176
Trichomonas vaginalis	neutral alpha-glucosidase ab precursor, putative	0.0036	0.0136	0.019
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0031	0.01	0.0139
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0028	0.0078	0.0109
Loa Loa (eye worm)	hypothetical protein	0.0125	0.0777	0.126
Schistosoma mansoni	inositol monophosphatase	0.0117	0.0726	0.1221
Plasmodium falciparum	ataxin-2 like protein, putative	0.0025	0.0058	0.0211
Brugia malayi	RNA recognition motif domain containing protein	0.0203	0.1347	0.2187
Trichomonas vaginalis	dihydroorotate dehydrogenase, putative	0.0156	0.1006	0.143
Trichomonas vaginalis	neutral alpha-glucosidase ab precursor, putative	0.0036	0.0136	0.019
Brugia malayi	Pre-SET motif family protein	0.0869	0.6153	1
Loa Loa (eye worm)	hypothetical protein	0.0033	0.0117	0.0186
Schistosoma mansoni	histone-lysine n-methyltransferase setb1	0.0125	0.0777	0.1307
Trypanosoma brucei	DNA polymerase kappa, putative	0.0019	0.0016	0.005
Echinococcus granulosus	terminal deoxycytidyl transferase rev1	0.0019	0.0016	0.0016
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0101	0.061	0.061
Trypanosoma brucei	dihydroorotate dehydrogenase (fumarate)	0.04	0.2768	1
Mycobacterium ulcerans	exodeoxyribonuclease III protein XthA	0.0022	0.0033	0.0029
Schistosoma mansoni	hypothetical protein	0.0195	0.1283	0.2158
Trichomonas vaginalis	DNA polymerase eta, putative	0.0019	0.0016	0.002
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0028	0.0078	0.0108
Loa Loa (eye worm)	TAR-binding protein	0.0203	0.1347	0.2187
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0101	0.061	0.061
Schistosoma mansoni	cellular tumor antigen P53	0.0205	0.1359	0.2285
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0034	0.0119	0.0167
Mycobacterium ulcerans	extragenic suppressor protein SuhB	0.0117	0.0726	0.1197
Plasmodium falciparum	pyruvate kinase	0.0033	0.0117	0.0421
Schistosoma mansoni	histone-lysine n-methyltransferase setb1	0.0125	0.0777	0.1307
Leishmania major	DNA polymerase kappa, putative,DNA polymerase IV, putative	0.0019	0.0016	0.005
Echinococcus granulosus	DNA apurinic or apyrimidinic site lyase	0.0022	0.0033	0.0033
Schistosoma mansoni	ap endonuclease	0.0022	0.0033	0.0056
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0101	0.061	0.1026
Trichomonas vaginalis	dihydropyrimidine dehydrogenase, putative	0.0156	0.1006	0.143
Plasmodium vivax	ataxin-2 like protein, putative	0.0025	0.0058	0.0211
Echinococcus multilocularis	histone lysine methyltransferase setb histone lysine methyltransferase eggless	0.0125	0.0777	0.0777
Brugia malayi	Pre-SET motif family protein	0.0125	0.0777	0.126
Trypanosoma brucei	DNA polymerase IV, putative	0.0019	0.0016	0.005
Schistosoma mansoni	dihydroorotate dehydrogenase	0.04	0.2768	0.4656
Brugia malayi	GTP-binding regulatory protein Gs alpha-S chain, putative	0.0101	0.061	0.0988
Schistosoma mansoni	hypothetical protein	0.0107	0.065	0.1093
Brugia malayi	hypothetical protein	0.0039	0.016	0.0257
Schistosoma mansoni	hypothetical protein	0.0043	0.019	0.032
Brugia malayi	exodeoxyribonuclease III family protein	0.0022	0.0033	0.005
Echinococcus multilocularis	cadherin EGF LAG seven pass G type receptor	0.005	0.0235	0.0235
Brugia malayi	Mitochondrial import inner membrane translocase subunit Tim17 family protein	0.0043	0.019	0.0306
Echinococcus granulosus	inositol monophosphatase 1	0.0117	0.0726	0.0726
Plasmodium falciparum	mitochondrial import inner membrane translocase subunit TIM23, putative	0.0043	0.019	0.0687
Trichomonas vaginalis	dihydroorotate dehydrogenase, putative	0.0156	0.1006	0.143
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0044	0.0195	0.0275
Schistosoma mansoni	rab geranylgeranyl transferase alpha subunit	0.0019	0.0016	0.0027
Plasmodium vivax	mitochondrial import inner membrane translocase subunit TIM23, putative	0.0043	0.019	0.0687
Loa Loa (eye worm)	pre-SET domain-containing protein family protein	0.0869	0.6153	1
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0101	0.061	0.061
Brugia malayi	Dihydroorotate dehydrogenase, mitochondrial precursor, putative	0.04	0.2768	0.4496
Echinococcus multilocularis	GPCR, family 2	0.005	0.0235	0.0235
Leishmania major	pyruvate kinase	0.0033	0.0117	0.0414
Loa Loa (eye worm)	latrophilin receptor protein 2	0.005	0.0235	0.0378
Schistosoma mansoni	alpha-glucosidase	0.0139	0.088	0.148
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0038	0.0154	0.0217
Leishmania major	dihydroorotate dehydrogenase	0.04	0.2768	1
Echinococcus granulosus	microtubule associated protein 2	0.0683	0.4812	0.4812
Trypanosoma cruzi	DNA polymerase kappa, putative	0.0019	0.0016	0.005
Brugia malayi	hypothetical protein	0.0486	0.3392	0.551
Brugia malayi	hypothetical protein	0.0039	0.016	0.0257
Trypanosoma brucei	DNA polymerase IV, putative	0.0019	0.0016	0.005
Echinococcus multilocularis	pyruvate kinase	0.0033	0.0117	0.0117
Echinococcus multilocularis	dihydropyrimidine dehydrogenase (NADP+)	0.0156	0.1006	0.1006
Loa Loa (eye worm)	glutaminase 2	0.084	0.5945	0.9661
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0038	0.0154	0.0217
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0052	0.025	0.0353
Echinococcus multilocularis	geminin	0.0195	0.1283	0.1283
Trichomonas vaginalis	alpha-glucosidase, putative	0.0036	0.0136	0.019
Schistosoma mansoni	inositol monophosphatase	0.0117	0.0726	0.1221
Echinococcus granulosus	5'partial\|histone lysine N methyltransferase SETDB2	0.012	0.0744	0.0744
Entamoeba histolytica	hypothetical protein	0.0114	0.0704	0.6947
Loa Loa (eye worm)	hypothetical protein	0.0019	0.0016	0.0023
Entamoeba histolytica	exodeoxyribonuclease III, putative	0.0022	0.0033	0.0173
Echinococcus granulosus	diuretic hormone 44 receptor GPRdih2	0.005	0.0235	0.0235
Loa Loa (eye worm)	phosphatidylinositol 3	0.0052	0.025	0.0403
Leishmania major	hypothetical protein, conserved	0.0025	0.0058	0.0204
Brugia malayi	latrophilin 2 splice variant baaae	0.0107	0.065	0.1053
Trypanosoma cruzi	myo-inositol-1(or 4)-monophosphatase 1, putative	0.0117	0.0726	0.2616
Mycobacterium tuberculosis	Probable dihydroorotate dehydrogenase PyrD	0.04	0.2768	1
Loa Loa (eye worm)	GTP-binding regulatory protein Gs alpha-S chain	0.0101	0.061	0.0988
Giardia lamblia	Endonuclease/Exonuclease/phosphatase	0.0022	0.0033	0.1324
Mycobacterium ulcerans	dihydroorotate dehydrogenase 2	0.04	0.2768	0.4642
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0038	0.0154	0.0217
Schistosoma mansoni	pyruvate kinase	0.0033	0.0117	0.0196
Brugia malayi	Glycosyl hydrolases family 31 protein	0.0036	0.0136	0.0217
Treponema pallidum	exodeoxyribonuclease (exoA)	0.0022	0.0033	0.5
Trypanosoma brucei	inositol-1(or 4)-monophosphatase 1, putative	0.0117	0.0726	0.2616
Trypanosoma brucei	DNA polymerase IV, putative	0.0019	0.0016	0.005
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0041	0.0174	0.0244
Toxoplasma gondii	exonuclease III APE	0.0022	0.0033	0.012
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0101	0.061	0.1026
Trypanosoma brucei	Phosphatidylinositol 3-kinase tor1	0.0052	0.025	0.0896
Trypanosoma cruzi	apurinic/apyrimidinic endonuclease, putative	0.0022	0.0033	0.0112
Trypanosoma brucei	pyruvate kinase 1	0.0033	0.0117	0.0414
Echinococcus granulosus	pyruvate kinase	0.0033	0.0117	0.0117
Echinococcus multilocularis	terminal deoxycytidyl transferase rev1	0.0019	0.0016	0.0016
Onchocerca volvulus		0.0989	0.702	1
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0031	0.0098	0.0136
Entamoeba histolytica	glycosyl hydrolase, family 31 protein	0.0036	0.0136	0.1208
Entamoeba histolytica	hypothetical protein	0.0114	0.0704	0.6947
Brugia malayi	Dihydroorotate dehydrogenase, mitochondrial precursor, putative	0.04	0.2768	0.4496
Plasmodium vivax	pyruvate kinase, putative	0.0033	0.0117	0.0421
Giardia lamblia	DINP protein human, muc B family	0.0019	0.0016	0.0639
Echinococcus granulosus	dna polymerase kappa	0.0019	0.0016	0.0016
Chlamydia trachomatis	pyruvate kinase	0.0033	0.0117	0.5
Trypanosoma brucei	PAB1-binding protein , putative	0.0025	0.0058	0.0204
Trypanosoma brucei	target of rapamycin kinase 3, putative	0.0041	0.0174	0.0621
Trypanosoma cruzi	dihydroorotate dehydrogenase, putative	0.04	0.2768	1
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0041	0.0174	0.0244
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0028	0.0078	0.0109
Brugia malayi	hypothetical protein	0.0114	0.0704	0.1141
Loa Loa (eye worm)	hypothetical protein	0.0205	0.1359	0.2205
Brugia malayi	Mitochondrial import inner membrane translocase subunit Tim17 family protein	0.0043	0.019	0.0306
Entamoeba histolytica	hypothetical protein	0.0114	0.0704	0.6947
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0028	0.0078	0.0109
Toxoplasma gondii	mitochondrial inner membrane translocase subunit TIM17, putative	0.0043	0.019	0.0687
Trypanosoma brucei	DNA polymerase kappa, putative	0.0019	0.0016	0.005
Onchocerca volvulus		0.0099	0.0594	0.0691
Schistosoma mansoni	ap endonuclease	0.0022	0.0033	0.0056
Trichomonas vaginalis	dihydroorotate dehydrogenase, putative	0.0156	0.1006	0.143
Entamoeba histolytica	dihydropyrimidine dehydrogenase, putative	0.0156	0.1006	1
Schistosoma mansoni	phosphatidylinositol 3-and 4-kinase	0.0017	0.0002	0.0004
Trypanosoma cruzi	pyruvate kinase 2, putative	0.0033	0.0117	0.0414
Trypanosoma cruzi	dihydroorotate dehydrogenase, putative	0.04	0.2768	1
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0028	0.0078	0.0108
Trypanosoma brucei	phosphatidylinositol 3-kinase tor, putative	0.0024	0.0053	0.0185
Trypanosoma cruzi	Phosphatidylinositol 3-kinase tor1	0.0052	0.025	0.0896
Echinococcus multilocularis	dna polymerase kappa	0.0019	0.0016	0.0016
Trypanosoma brucei	pyruvate kinase 1, putative	0.0033	0.0117	0.0414
Trypanosoma cruzi	hypothetical protein, conserved	0.0036	0.0136	0.0483
Trichomonas vaginalis	DNA polymerase IV / kappa, putative	0.0019	0.0016	0.002
Plasmodium vivax	dihydroorotate dehydrogenase, mitochondrial precursor, putative	0.04	0.2768	1
Plasmodium vivax	AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative	0.0022	0.0033	0.012
Loa Loa (eye worm)	hypothetical protein	0.0107	0.065	0.1053
Wolbachia endosymbiont of Brugia malayi	fructose-1,6-bisphosphatase	0.0117	0.0726	0.2533
Trichomonas vaginalis	sucrase-isomaltase, putative	0.0036	0.0136	0.019
Schistosoma mansoni	microtubule-associated protein tau	0.0683	0.4812	0.8094
Brugia malayi	Iron-sulfur cluster assembly accessory protein	0.0099	0.0594	0.0962
Loa Loa (eye worm)	RNA binding protein	0.0203	0.1347	0.2187
Echinococcus granulosus	dihydropyrimidine dehydrogenase NADP	0.0156	0.1006	0.1006
Schistosoma mansoni	terminal deoxycytidyl transferase	0.0019	0.0016	0.0027
Trypanosoma brucei	DNA polymerase kappa, putative	0.0019	0.0016	0.005
Trypanosoma brucei	DNA polymerase kappa, putative	0.0019	0.0016	0.005
Trichomonas vaginalis	set domain proteins, putative	0.0989	0.702	1
Echinococcus granulosus	pyruvate kinase	0.0033	0.0117	0.0117
Loa Loa (eye worm)	hypothetical protein	0.0156	0.1008	0.1635
Echinococcus granulosus	neutral alpha glucosidase AB	0.0036	0.0136	0.0136
Echinococcus multilocularis	histone lysine N methyltransferase SETMAR	0.0125	0.0777	0.0777
Brugia malayi	TAR-binding protein	0.0203	0.1347	0.2187
Echinococcus granulosus	dihydropyrimidine dehydrogenase NADP	0.0156	0.1006	0.1006
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0041	0.0174	0.0244
Entamoeba histolytica	phosphatidylinositol3-kinaseTor2, putative	0.0052	0.025	0.2363
Trichomonas vaginalis	alpha-glucosidase, putative	0.0036	0.0136	0.019
Brugia malayi	Pyruvate kinase, M2 isozyme	0.0033	0.0117	0.0186
Echinococcus granulosus	survival motor neuron protein 1	0.0486	0.3392	0.3392
Trypanosoma brucei	DNA polymerase kappa, putative	0.0019	0.0016	0.005
Loa Loa (eye worm)	MH2 domain-containing protein	0.0127	0.0794	0.1287
Mycobacterium leprae	possible inositol monophosphatase SubH (IMPase) (inositol-1-phosphatase) (I-1-Pase ).	0.0105	0.0637	0.1962
Loa Loa (eye worm)	glycosyl hydrolase family 31 protein	0.0036	0.0136	0.0217
Trichomonas vaginalis	myo inositol monophosphatase, putative	0.0117	0.0726	0.1031
Trypanosoma brucei	phosphatidylinositol 4-kinase, putative	0.0052	0.025	0.0896
Trypanosoma cruzi	DNA polymerase eta, putative	0.0019	0.0016	0.005
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0035	0.0127	0.0178
Echinococcus multilocularis	inositol monophosphatase 1	0.0117	0.0726	0.0726
Entamoeba histolytica	hypothetical protein	0.0114	0.0704	0.6947
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0031	0.0098	0.0136
Mycobacterium tuberculosis	Probable exodeoxyribonuclease III protein XthA (exonuclease III) (EXO III) (AP endonuclease VI)	0.0022	0.0033	0.0062
Plasmodium vivax	SET domain protein, putative	0.0125	0.0777	0.2808
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0101	0.061	0.061
Brugia malayi	MH2 domain containing protein	0.0127	0.0794	0.1287
Trypanosoma cruzi	apurinic/apyrimidinic endonuclease	0.0022	0.0033	0.0112
Loa Loa (eye worm)	glycosyl hydrolase family 31 protein	0.0161	0.1042	0.1691
Brugia malayi	Glycosyl hydrolases family 31 protein	0.0161	0.1042	0.1691
Loa Loa (eye worm)	hypothetical protein	0.0043	0.019	0.0306
Toxoplasma gondii	inositol(myo)-1(or 4)-monophosphatase 2, putative	0.0117	0.0726	0.2622
Schistosoma mansoni	alpha-glucosidase	0.0139	0.088	0.148
Trypanosoma cruzi	dihydroorotate dehydrogenase, putative	0.0156	0.1006	0.3629
Brugia malayi	RNA binding protein	0.0203	0.1347	0.2187
Mycobacterium tuberculosis	Probable pyruvate kinase PykA	0.0033	0.0117	0.0366
Trichomonas vaginalis	pyruvate kinase, putative	0.0033	0.0117	0.0163
Loa Loa (eye worm)	pyruvate kinase	0.0033	0.0117	0.0186
Trypanosoma cruzi	PAB1-binding protein , putative	0.0025	0.0058	0.0204
Loa Loa (eye worm)	hypothetical protein	0.0023	0.0044	0.0068
Schistosoma mansoni	glutaminase	0.084	0.5945	1
Schistosoma mansoni	tar DNA-binding protein	0.0203	0.1347	0.2266
Trichomonas vaginalis	inositol monophosphatase, putative	0.0117	0.0726	0.1031
Loa Loa (eye worm)	glutaminase	0.084	0.5945	0.9661
Trypanosoma cruzi	Phosphatidylinositol 3-kinase tor2	0.0052	0.025	0.0896
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0052	0.025	0.0353
Echinococcus multilocularis	dna polymerase eta	0.0019	0.0016	0.0016
Toxoplasma gondii	glycosyl hydrolase, family 31 protein	0.0036	0.0136	0.049
Trypanosoma brucei	DNA polymerase kappa, putative	0.0019	0.0016	0.005
Trypanosoma cruzi	target of rapamycin kinase 3	0.0041	0.0174	0.0621
Brugia malayi	ImpB/MucB/SamB family protein	0.0019	0.0016	0.0023
Trichomonas vaginalis	ap endonuclease, putative	0.0022	0.0033	0.0044
Brugia malayi	Phosphatidylinositol 3- and 4-kinase family protein	0.0052	0.025	0.0403
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0038	0.0154	0.0217
Echinococcus multilocularis	DNA (apurinic or apyrimidinic site) lyase	0.0022	0.0033	0.0033
Wolbachia endosymbiont of Brugia malayi	dihydroorotate dehydrogenase 2	0.04	0.2768	1
Brugia malayi	glutaminase DH11.1	0.084	0.5945	0.9661
Schistosoma mansoni	tar DNA-binding protein	0.0203	0.1347	0.2266
Schistosoma mansoni	hypothetical protein	0.005	0.0235	0.0395
Trichomonas vaginalis	alpha-glucosidase, putative	0.0036	0.0136	0.019
Echinococcus multilocularis	microtubule associated protein 2	0.0683	0.4812	0.4812
Trichomonas vaginalis	maltase-glucoamylase, putative	0.0036	0.0136	0.019
Leishmania major	DNA polymerase eta, putative	0.0019	0.0016	0.005
Trichomonas vaginalis	alpha-glucosidase, putative	0.0036	0.0136	0.019
Brugia malayi	hypothetical protein	0.0025	0.0058	0.0092
Brugia malayi	Corticotropin releasing factor receptor 2 precursor, putative	0.0156	0.1008	0.1635
Echinococcus multilocularis	FKBP12 rapamycin complex associated protein	0.0052	0.025	0.025
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0101	0.061	0.1026
Loa Loa (eye worm)	RNA recognition domain-containing protein domain-containing protein	0.0203	0.1347	0.2187
Leishmania major	apurinic/apyrimidinic endonuclease-redox protein	0.0022	0.0033	0.0112
Loa Loa (eye worm)	hypothetical protein	0.0486	0.3392	0.551
Schistosoma mansoni	hypothetical protein	0.005	0.0235	0.0395
Trypanosoma brucei	apurinic/apyrimidinic endonuclease, putative	0.0022	0.0033	0.0112
Brugia malayi	Inositol-1	0.0117	0.0726	0.1176
Echinococcus multilocularis	lysosomal alpha glucosidase	0.0161	0.1042	0.1042
Brugia malayi	calcium-independent alpha-latrotoxin receptor 2, putative	0.005	0.0235	0.0378
Giardia lamblia	Pyruvate kinase	0.0033	0.0117	0.4666
Trypanosoma brucei	DNA polymerase eta, putative	0.0019	0.0016	0.005
Trichomonas vaginalis	dihydroorotate dehydrogenase, putative	0.0156	0.1006	0.143
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0038	0.0154	0.0217
Mycobacterium leprae	Probable dihydroorotate dehydrogenase PyrD	0.04	0.2768	1
Mycobacterium ulcerans	pyruvate kinase	0.0033	0.0117	0.017
Trypanosoma cruzi	myo-inositol-1(or 4)-monophosphatase 1, putative	0.0117	0.0726	0.2616
Trypanosoma cruzi	DNA polymerase kappa, putative	0.0019	0.0016	0.005
Leishmania major	target of rapamycin (TOR) kinase 1, putative	0.0052	0.025	0.0896
Trypanosoma cruzi	DNA polymerase kappa, putative	0.0019	0.0016	0.005
Echinococcus granulosus	histone lysine methyltransferase setb	0.0125	0.0777	0.0777
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0031	0.01	0.0139
Schistosoma mansoni	alpha glucosidase	0.0036	0.0136	0.0228
Echinococcus multilocularis	lysosomal alpha glucosidase	0.0161	0.1042	0.1042
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0028	0.0078	0.0108
Brugia malayi	Latrophilin receptor protein 2	0.005	0.0235	0.0378
Loa Loa (eye worm)	hypothetical protein	0.0025	0.0058	0.0092
Plasmodium falciparum	ataxin-2 like protein, putative	0.0025	0.0058	0.0211
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0038	0.0154	0.0217
Toxoplasma gondii	target of rapamycin (TOR), putative	0.0038	0.0154	0.0558
Plasmodium falciparum	dihydroorotate dehydrogenase	0.04	0.2768	1
Leishmania major	pyruvate kinase	0.0033	0.0117	0.0414
Loa Loa (eye worm)	ImpB/MucB/SamB family protein	0.0019	0.0016	0.0023
Loa Loa (eye worm)	hypothetical protein	0.005	0.0235	0.0378
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0041	0.0174	0.0244
Echinococcus multilocularis	tar DNA binding protein	0.0203	0.1347	0.1347
Schistosoma mansoni	DNA polymerase eta	0.0019	0.0016	0.0027
Toxoplasma gondii	LsmAD domain-containing protein	0.0025	0.0058	0.0211
Schistosoma mansoni	tar DNA-binding protein	0.0203	0.1347	0.2266
Trypanosoma cruzi	pyruvate kinase 2, putative	0.0033	0.0117	0.0414
Echinococcus multilocularis	Basic leucine zipper (bZIP) transcription	0.0114	0.0704	0.0704
Trypanosoma brucei	DNA polymerase kappa, putative	0.0019	0.0016	0.005
Schistosoma mansoni	transcription factor LCR-F1	0.0114	0.0704	0.1184
Mycobacterium tuberculosis	Inositol-1-monophosphatase SuhB	0.0105	0.0637	0.2256
Brugia malayi	ImpB/MucB/SamB family protein	0.0019	0.0016	0.0023
Loa Loa (eye worm)	pyruvate kinase	0.0033	0.0117	0.0186
Echinococcus granulosus	tar DNA binding protein	0.0203	0.1347	0.1347
Echinococcus multilocularis	phosphatidylinositol 3 and 4 kinase	0.0017	0.0002	0.0002
Echinococcus granulosus	dna polymerase eta	0.0019	0.0016	0.0016
Echinococcus multilocularis	dihydropyrimidine dehydrogenase (NADP+)	0.0156	0.1006	0.1006
Schistosoma mansoni	histone-lysine n-methyltransferase suv9	0.0125	0.0777	0.1307
Leishmania major	myo-inositol-1(or 4)-monophosphatase 1, putative	0.0117	0.0726	0.2616
Loa Loa (eye worm)	pyruvate kinase	0.0033	0.0117	0.0186
Loa Loa (eye worm)	exodeoxyribonuclease III family protein	0.0022	0.0033	0.005
Trypanosoma brucei	DNA polymerase kappa, putative	0.0019	0.0016	0.005
Echinococcus granulosus	phosphatidylinositol 3 and 4 kinase	0.0017	0.0002	0.0002
Leishmania major	DNA polymerase kappa, putative	0.0019	0.0016	0.005
Trichomonas vaginalis	pyruvate kinase, putative	0.0033	0.0117	0.0163
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0038	0.0154	0.0217
Schistosoma mansoni	hypothetical protein	0.0114	0.0704	0.1184
Echinococcus granulosus	FKBP12 rapamycin complex associated protein	0.0052	0.025	0.025
Schistosoma mansoni	survival motor neuron protein	0.0099	0.0594	0.0999
Schistosoma mansoni	hypothetical protein	0.0099	0.0594	0.0999
Brugia malayi	Pyruvate kinase, muscle isozyme	0.0033	0.0117	0.0186
Entamoeba histolytica	glycosyl hydrolase, family 31 protein	0.0036	0.0136	0.1208
Trichomonas vaginalis	dihydroorotate dehydrogenase, putative	0.0156	0.1006	0.143

Activities

Activity type	Activity value	Assay description	Source	Reference
CL (ADMET)	> 72 ml/min.kg	Clearance in mouse liver microsomes by LC-MS/MS analysis	ChEMBL.	24900364
IC50 (functional)	= 4 nM	Antiplasmodial activity against Plasmodium falciparum 3D7 infected in human renal proximal tubule cells after 72 hrs by SYBR green assay	ChEMBL.	24900364
IC50 (binding)	= 17 nM	Inhibition of Plasmodium falciparum DHODH after 20 mins by 2,6-dichloroindophenol-reduction based assay	ChEMBL.	24900364
IC50 (binding)	= 3100 nM	Inhibition of human DHODH after 20 mins by 2,6-dichloroindophenol-reduction based assay	ChEMBL.	24900364

Phenotypes

Whole-cell/tissue/organism interactions

Species name	Source	Reference	Is orphan
Plasmodium falciparum	ChEMBL23	24900364

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: CHEMBL2012961

Bibliographic References

1 literature reference was collected for this gene.

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Detailed information for compound 1183859