TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 365.43 | Formula: C23H19N5
H donors: 2 H acceptors: 2 LogP: 4.8 Rotable bonds: 4
Rule of 5 violations (Lipinski): 1
SMILES: c1ccc(cc1)Nc1nccc(n1)C1=C(NN2C1C=CC=C2)c1ccccc1
InChi: 1S/C23H19N5/c1-3-9-17(10-4-1)22-21(20-13-7-8-16-28(20)27-22)19-14-15-24-23(26-19)25-18-11-5-2-6-12-18/h1-16,20,27H,(H,24,25,26)
InChiKey: SYJVSHJJQVAKBM-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	glycogen synthase kinase 3 beta	Starlite/ChEMBL	References

Predicted pathogen targets for this compound

By orthology

Species	Potential target	Known druggable target/s	Ortholog Group
Plasmodium falciparum	glycogen synthase kinase 3	Get druggable targets OG5_126888	All targets in OG5_126888
Echinococcus granulosus	glycogen synthase kinase 3 beta	Get druggable targets OG5_126888	All targets in OG5_126888
Entamoeba histolytica	protein kinase domain containing protein	Get druggable targets OG5_126888	All targets in OG5_126888
Leishmania infantum	glycogen synthase kinase 3	Get druggable targets OG5_126888	All targets in OG5_126888
Schistosoma mansoni	glycogen synthase kinase 3-related (gsk3) (cmgc group III)	Get druggable targets OG5_126888	All targets in OG5_126888
Cryptosporidium parvum	hypothetical protein	Get druggable targets OG5_126888	All targets in OG5_126888
Candida albicans	Serine/threonine protein kinase required for induction of IME2 by Ime1p	Get druggable targets OG5_126888	All targets in OG5_126888
Candida albicans	second truncated form of RIM11 Serine/threonine protein kinase	Get druggable targets OG5_126888	All targets in OG5_126888
Loa Loa (eye worm)	CMGC/GSK protein kinase	Get druggable targets OG5_126888	All targets in OG5_126888
Brugia malayi	intracellular kinase	Get druggable targets OG5_126888	All targets in OG5_126888
Echinococcus multilocularis	glycogen synthase kinase 3 beta	Get druggable targets OG5_126888	All targets in OG5_126888
Echinococcus multilocularis	protein kinase shaggy	Get druggable targets OG5_126888	All targets in OG5_126888
Trypanosoma brucei	protein kinase, putative	Get druggable targets OG5_126888	All targets in OG5_126888
Onchocerca volvulus		Get druggable targets OG5_126888	All targets in OG5_126888
Trichomonas vaginalis	CMGC family protein kinase	Get druggable targets OG5_126888	All targets in OG5_126888
Neospora caninum	hypothetical protein	Get druggable targets OG5_126888	All targets in OG5_126888
Leishmania braziliensis	protein kinase, putative,glycogen synthase kinase, putative	Get druggable targets OG5_126888	All targets in OG5_126888
Candida albicans	second truncated form of RIM11 Serine/threonine protein kinase	Get druggable targets OG5_126888	All targets in OG5_126888
Plasmodium vivax	glycogen synthase kinase 3, putative	Get druggable targets OG5_126888	All targets in OG5_126888
Candida albicans	hypothetical protein	Get druggable targets OG5_126888	All targets in OG5_126888
Entamoeba histolytica	protein kinase domain containing protein	Get druggable targets OG5_126888	All targets in OG5_126888
Schistosoma japonicum	ko:K08822 glycogen synthase kinase 3 alpha, putative	Get druggable targets OG5_126888	All targets in OG5_126888
Giardia lamblia	Kinase, CMGC GSK	Get druggable targets OG5_126888	All targets in OG5_126888
Echinococcus granulosus	protein kinase shaggy	Get druggable targets OG5_126888	All targets in OG5_126888
Plasmodium knowlesi	glycogen synthase kinase 3, putative	Get druggable targets OG5_126888	All targets in OG5_126888
Plasmodium berghei	glycogen synthase kinase 3, putative	Get druggable targets OG5_126888	All targets in OG5_126888
Entamoeba histolytica	protein kinase, putative	Get druggable targets OG5_126888	All targets in OG5_126888
Loa Loa (eye worm)	CMGC/GSK protein kinase	Get druggable targets OG5_126888	All targets in OG5_126888
Plasmodium yoelii	Protein kinase domain, putative	Get druggable targets OG5_126888	All targets in OG5_126888
Leishmania mexicana	protein kinase, putative,glycogen synthase kinase, putative	Get druggable targets OG5_126888	All targets in OG5_126888
Trypanosoma cruzi	glycogen synthase kinase 3, putative	Get druggable targets OG5_126888	All targets in OG5_126888
Babesia bovis	protein kinase domain containing protein	Get druggable targets OG5_126888	All targets in OG5_126888
Leishmania major	glycogen synthase kinase, putative;with=GeneDB:LinJ18_V3.0270	Get druggable targets OG5_126888	All targets in OG5_126888
Leishmania donovani	glycogen synthase kinase 3, putative	Get druggable targets OG5_126888	All targets in OG5_126888
Toxoplasma gondii	cell-cycle-associated protein kinase GSK, putative	Get druggable targets OG5_126888	All targets in OG5_126888
Trypanosoma congolense	protein kinase, putative	Get druggable targets OG5_126888	All targets in OG5_126888
Cryptosporidium hominis	hypothetical protein	Get druggable targets OG5_126888	All targets in OG5_126888
Giardia lamblia	Kinase, CMGC GSK	Get druggable targets OG5_126888	All targets in OG5_126888
Trypanosoma brucei gambiense	protein kinase, putative,glycogen synthase kinase, putative	Get druggable targets OG5_126888	All targets in OG5_126888
Theileria parva	glycogen synthase kinase, putative	Get druggable targets OG5_126888	All targets in OG5_126888
Trichomonas vaginalis	CMGC family protein kinase	Get druggable targets OG5_126888	All targets in OG5_126888

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	flap endonuclease-1, putative	0.0026	0.0298	0.0207
Trichomonas vaginalis	phosphofructokinase, putative	0.0108	0.2056	0.1983
Trypanosoma cruzi	NADH-cytochrome b5 reductase, putative	0.002	0.0178	0.0279
Leishmania major	arginase	0.0167	0.3314	0.9293
Mycobacterium tuberculosis	Possible DNA-damage-inducible protein P DinP (DNA polymerase V) (pol IV 2) (DNA nucleotidyltransferase (DNA-directed))	0.0019	0.0154	0.0281
Mycobacterium tuberculosis	Probable membrane NADH dehydrogenase NdhA	0.0107	0.2038	0.8837
Onchocerca volvulus		0.0058	0.0985	0.0822
Entamoeba histolytica	type A flavoprotein, putative	0.0068	0.1204	0.3343
Trichomonas vaginalis	phosphofructokinase, putative	0.0029	0.0369	0.0279
Echinococcus granulosus	ankyrin repeat and death domain containing protein	0.0029	0.0366	0.0789
Trichomonas vaginalis	NADPH cytochrome P450, putative	0.0068	0.1204	0.1122
Toxoplasma gondii	histone lysine methyltransferase SET/SUV39	0.006	0.1036	0.5258
Mycobacterium tuberculosis	Dihydrolipoamide dehydrogenase LpdC (lipoamide reductase (NADH)) (lipoyl dehydrogenase) (dihydrolipoyl dehydrogenase) (diaphoras	0.0119	0.2294	1
Leishmania major	NADH-cytochrome b5 reductase, putative	0.002	0.0178	0.0279
Echinococcus granulosus	cytochrome b5 reductase 4	0.002	0.0178	0.0246
Trypanosoma cruzi	NADH-dependent fumarate reductase, putative	0.002	0.0178	0.0279
Echinococcus granulosus	histone lysine methyltransferase setb	0.006	0.1036	0.272
Mycobacterium ulcerans	dihydrolipoamide dehydrogenase, LpdB	0.0016	0.0093	0.0033
Toxoplasma gondii	cell-cycle-associated protein kinase GSK, putative	0.0058	0.0985	0.4987
Trypanosoma brucei	NADH-dependent fumarate reductase	0.002	0.0178	0.0427
Mycobacterium ulcerans	monooxygenase	0.002	0.0178	0.0279
Leishmania major	NADH-dependent fumarate reductase-like protein	0.002	0.0178	0.0279
Schistosoma mansoni	NADPH flavin oxidoreductase	0.009	0.1667	0.4602
Echinococcus multilocularis	terminal deoxycytidyl transferase rev1	0.0019	0.0154	0.0179
Schistosoma mansoni	alpha-galactosidase/alpha-n-acetylgalactosaminidase	0.0102	0.1923	0.5332
Plasmodium vivax	glycogen synthase kinase 3, putative	0.0058	0.0985	0.2574
Toxoplasma gondii	flavodoxin domain-containing protein	0.0089	0.1638	0.8476
Trypanosoma cruzi	dihydrolipoyl dehydrogenase, putative	0.0016	0.0093	0.0033
Schistosoma mansoni	alpha-galactosidase/alpha-n-acetylgalactosaminidase	0.0102	0.1923	0.5332
Trypanosoma cruzi	arginase, putative	0.0061	0.1043	0.2765
Trypanosoma cruzi	trypanothione reductase, putative	0.0047	0.075	0.1922
Echinococcus granulosus	Ankyrin	0.0029	0.0371	0.0804
Trypanosoma cruzi	NADH-dependent fumarate reductase, putative	0.002	0.0178	0.0279
Mycobacterium tuberculosis	Probable dehydrogenase	0.0107	0.2038	0.8837
Echinococcus granulosus	NADPH dependent diflavin oxidoreductase 1	0.0178	0.356	1
Mycobacterium ulcerans	DNA polymerase IV	0.0019	0.0154	0.0211
Plasmodium falciparum	arginase	0.0167	0.3314	0.929
Leishmania major	nitrate reductase, putative	0.002	0.0178	0.0279
Leishmania major	NADH-cytochrome b5 reductase, putative	0.002	0.0178	0.0279
Trypanosoma brucei	DNA polymerase IV, putative	0.0019	0.0154	0.0361
Echinococcus granulosus	flap endonuclease 1	0.0026	0.0298	0.0592
Leishmania major	NADH-dependent fumarate reductase, putative	0.002	0.0178	0.0279
Trypanosoma cruzi	ATP-dependent 6-phosphofructokinase, glycosomal	0.0108	0.2056	0.5677
Giardia lamblia	Nitric oxide synthase, inducible	0.0158	0.3126	1
Trypanosoma cruzi	DNA polymerase kappa, putative	0.0019	0.0154	0.0211
Trypanosoma brucei	DNA polymerase eta, putative	0.0019	0.0154	0.0361
Brugia malayi	FAD binding domain containing protein	0.011	0.21	0.24
Echinococcus granulosus	NADH cytochrome b5 reductase 3	0.002	0.0178	0.0246
Trypanosoma brucei	dihydrolipoyl dehydrogenase	0.0016	0.0093	0.0185
Mycobacterium tuberculosis	Probable oxidoreductase	0.0119	0.2294	1
Schistosoma mansoni	cytochrome B5	0.002	0.0178	0.0358
Leishmania major	agmatinase-like protein	0.0061	0.1043	0.2765
Leishmania major	cytochrome-b5 reductase, putative	0.002	0.0178	0.0279
Trypanosoma brucei	unspecified product	0.0019	0.0154	0.0361
Trypanosoma brucei	DNA polymerase kappa, putative	0.0019	0.0154	0.0361
Chlamydia trachomatis	fructose-6-phosphate phosphotransferase	0.0029	0.0369	0.1375
Trypanosoma cruzi	NADH-cytochrome b5 reductase, putative	0.002	0.0178	0.0279
Mycobacterium ulcerans	dihydrolipoamide dehydrogenase	0.0016	0.0093	0.0033
Onchocerca volvulus		0.006	0.1036	0.0873
Trypanosoma cruzi	apurinic/apyrimidinic endonuclease	0.0019	0.0144	0.0181
Loa Loa (eye worm)	exodeoxyribonuclease III family protein	0.0019	0.0144	0.0073
Trypanosoma brucei	agmatinase, putative	0.0061	0.1043	0.2875
Trichomonas vaginalis	CMGC family protein kinase	0.0058	0.0985	0.0901
Leishmania major	cytochrome P450 reductase, putative	0.0158	0.3126	0.8753
Plasmodium falciparum	glutathione reductase	0.0047	0.075	0.1895
Schistosoma mansoni	ankyrin 23/unc44	0.0029	0.0366	0.0894
Brugia malayi	ImpB/MucB/SamB family protein	0.0019	0.0154	0.0177
Trichomonas vaginalis	DNA polymerase eta, putative	0.0019	0.0154	0.0063
Brugia malayi	phosphofructokinase	0.0108	0.2056	0.235
Trypanosoma brucei	S-adenosyl-L-methionine-dependent tRNA 4-demethylwyosine synthase, putative	0.0068	0.1204	0.333
Trypanosoma cruzi	agmatinase, putative	0.0061	0.1043	0.2765
Trichomonas vaginalis	sulfite reductase, putative	0.0178	0.356	0.3502
Mycobacterium tuberculosis	Possible electron transfer protein FdxB	0.002	0.0178	0.0387
Plasmodium falciparum	nitric oxide synthase, putative	0.0178	0.356	1
Trypanosoma brucei	DNA polymerase kappa, putative	0.0019	0.0154	0.0361
Leishmania major	oxidoreductase-like protein	0.002	0.0178	0.0279
Echinococcus multilocularis	protein kinase shaggy	0.0058	0.0985	0.2574
Trypanosoma cruzi	dihydrolipoamide dehydrogenase, putative	0.0016	0.0093	0.0033
Loa Loa (eye worm)	phosphofructokinase	0.0108	0.2056	0.2278
Treponema pallidum	diphosphate--fructose-6-phosphate 1-phosphotransferase	0.0029	0.0369	0.1406
Plasmodium falciparum	NADPH--cytochrome P450 reductase, putative	0.0068	0.1204	0.3205
Echinococcus multilocularis	methionine synthase reductase	0.011	0.21	0.579
Toxoplasma gondii	pyruvate dehydrogenase complex subunit PDH-E3II	0.0016	0.0093	0.0215
Brugia malayi	Melibiase family protein	0.0068	0.1197	0.1368
Trichomonas vaginalis	6-phosphofructokinase, putative	0.0029	0.0369	0.0279
Trypanosoma cruzi	trypanothione reductase, putative	0.0016	0.0093	0.0033
Trichomonas vaginalis	phosphofructokinase, putative	0.0029	0.0369	0.0279
Trichomonas vaginalis	phosphofructokinase, putative	0.0029	0.0369	0.0279
Giardia lamblia	Kinase, CMGC GSK	0.0058	0.0985	0.2942
Trypanosoma cruzi	NADH-dependent fumarate reductase, putative	0.002	0.0178	0.0279
Giardia lamblia	Flavohemoprotein lateral transfer candidate	0.002	0.0178	0.0281
Trypanosoma cruzi	dihydrolipoamide dehydrogenase, putative	0.0016	0.0093	0.0033
Mycobacterium tuberculosis	Probable exodeoxyribonuclease III protein XthA (exonuclease III) (EXO III) (AP endonuclease VI)	0.0019	0.0144	0.0234
Echinococcus multilocularis	histone lysine N methyltransferase SETMAR	0.006	0.1036	0.272
Echinococcus multilocularis	NADH cytochrome b5 reductase 3	0.002	0.0178	0.0246
Echinococcus granulosus	5'partial\|histone lysine N methyltransferase SETDB2	0.0058	0.0988	0.2583
Plasmodium vivax	thioredoxin reductase, putative	0.0047	0.075	0.1895
Trichomonas vaginalis	phosphofructokinase, putative	0.0108	0.2056	0.1983
Trichomonas vaginalis	NADPH fad oxidoreductase, putative	0.0158	0.3126	0.3064
Leishmania major	NADH-cytochrome b5 reductase, putative	0.002	0.0178	0.0279
Mycobacterium ulcerans	oxygenase	0.002	0.0178	0.0279
Trichomonas vaginalis	phosphofructokinase, putative	0.0029	0.0369	0.0279
Mycobacterium ulcerans	flavoprotein disulfide reductase	0.0016	0.0093	0.0033
Mycobacterium ulcerans	flavodoxin reductase Hmp	0.002	0.0178	0.0279
Chlamydia trachomatis	Na(+)-translocating NADH-quinone reductase subunit F	0.002	0.0178	0.0425
Trypanosoma cruzi	NADH-cytochrome b5 reductase, putative	0.002	0.0178	0.0279
Mycobacterium ulcerans	electron transfer protein FdxB	0.002	0.0178	0.0279
Entamoeba histolytica	protein kinase domain containing protein	0.0058	0.0985	0.2653
Trypanosoma cruzi	flap endonuclease-1 (FEN-1), putative	0.0026	0.0298	0.0624
Brugia malayi	Pre-SET motif family protein	0.006	0.1036	0.1184
Trypanosoma cruzi	Flavodoxin/Radical SAM superfamily/Wyosine base formation, putative	0.0068	0.1204	0.3227
Echinococcus granulosus	protein kinase shaggy	0.0058	0.0985	0.2574
Trypanosoma cruzi	cytochrome-b5 reductase, putative	0.002	0.0178	0.0279
Schistosoma mansoni	glycogen synthase kinase 3-related (gsk3) (cmgc group III)	0.0058	0.0985	0.2659
Schistosoma mansoni	ap endonuclease	0.0019	0.0144	0.0261
Treponema pallidum	flavodoxin	0.0068	0.1204	0.5659
Loa Loa (eye worm)	FAD binding domain-containing protein	0.0178	0.356	0.4013
Trypanosoma cruzi	reductase, putative	0.002	0.0178	0.0279
Trypanosoma cruzi	cytochrome-b5 reductase, putative	0.002	0.0178	0.0279
Trichomonas vaginalis	NADPH cytochrome P450, putative	0.0068	0.1204	0.1122
Schistosoma mansoni	hypothetical protein	0.0029	0.0366	0.0894
Brugia malayi	dihydrolipoyl dehydrogenase, mitochondrial precursor, putative	0.0016	0.0093	0.0106
Trypanosoma brucei	NADH-cytochrome b5 reductase, putative	0.002	0.0178	0.0427
Trypanosoma cruzi	NADH-dependent fumarate reductase, putative	0.002	0.0178	0.0279
Trypanosoma cruzi	dihydrolipoamide dehydrogenase, putative	0.0016	0.0093	0.0033
Loa Loa (eye worm)	6-phosphofructokinase	0.0108	0.2056	0.2278
Mycobacterium ulcerans	oxidoreductase	0.002	0.0178	0.0279
Giardia lamblia	Kinase, CMGC GSK	0.0058	0.0985	0.2942
Schistosoma mansoni	diflavin oxidoreductase	0.0089	0.1638	0.4519
Trypanosoma brucei	DNA polymerase kappa, putative	0.0019	0.0154	0.0361
Plasmodium falciparum	NADH-cytochrome b5 reductase, putative	0.002	0.0178	0.0246
Mycobacterium leprae	DIHYDROLIPOAMIDE DEHYDROGENASE LPD (LIPOAMIDE REDUCTASE (NADH)) (LIPOYL DEHYDROGENASE) (DIHYDROLIPOYL DEHYDROGENASE) (DIAPHORASE	0.0119	0.2294	1
Trichomonas vaginalis	phosphofructokinase, putative	0.0029	0.0369	0.0279
Trypanosoma brucei	nitrate reductase, putative	0.002	0.0178	0.0427
Entamoeba histolytica	Arginase, putative	0.0167	0.3314	1
Trypanosoma cruzi	nitrate reductase, putative	0.002	0.0178	0.0279
Brugia malayi	Protein kinase domain containing protein	0.003	0.0378	0.0432
Trypanosoma cruzi	NADH-dependent fumarate reductase, putative	0.002	0.0178	0.0279
Schistosoma mansoni	6-phosphofructokinase	0.0108	0.2056	0.5712
Mycobacterium ulcerans	DNA polymerase IV	0.0019	0.0154	0.0211
Trichomonas vaginalis	set domain proteins, putative	0.0479	0.9995	1
Loa Loa (eye worm)	6-phosphofructokinase	0.0108	0.2056	0.2278
Loa Loa (eye worm)	pre-SET domain-containing protein family protein	0.0421	0.875	1
Trichomonas vaginalis	ap endonuclease, putative	0.0019	0.0144	0.0052
Trypanosoma cruzi	glycogen synthase kinase 3, putative	0.0058	0.0985	0.2599
Chlamydia trachomatis	sulfite reductase	0.011	0.21	1
Loa Loa (eye worm)	flap endonuclease-1	0.0026	0.0298	0.025
Trichomonas vaginalis	NADPH cytochrome P450, putative	0.0068	0.1204	0.1122
Trypanosoma cruzi	DNA polymerase kappa, putative	0.0019	0.0154	0.0211
Loa Loa (eye worm)	cytochrome b5 reductase 4	0.002	0.0178	0.0112
Leishmania major	DNA polymerase kappa, putative,DNA polymerase IV, putative	0.0019	0.0154	0.0211
Trypanosoma brucei	DNA polymerase kappa, putative	0.0019	0.0154	0.0361
Loa Loa (eye worm)	follicle stimulating hormone receptor	0.0235	0.4774	0.5413
Brugia malayi	Cytochrome P450 family protein	0.0026	0.03	0.0343
Brugia malayi	intracellular kinase	0.0058	0.0985	0.1126
Brugia malayi	6-phosphofructokinase	0.0108	0.2056	0.235
Brugia malayi	glutathione reductase	0.0047	0.075	0.0857
Giardia lamblia	DINP protein human, muc B family	0.0019	0.0154	0.0204
Trichomonas vaginalis	DNA polymerase IV / kappa, putative	0.0019	0.0154	0.0063
Trichomonas vaginalis	alpha-galactosidase/alpha-N-acetylgalactosaminidase, putative	0.0068	0.1197	0.1115
Entamoeba histolytica	protein kinase domain containing protein	0.0058	0.0985	0.2653
Loa Loa (eye worm)	glutathione reductase	0.0047	0.075	0.0772
Treponema pallidum	ferredoxin-NADP(+) reductase subunit alpha	0.002	0.0178	0.0434
Trypanosoma brucei	dihydrolipoamide dehydrogenase	0.0016	0.0093	0.0185
Echinococcus granulosus	netrin receptor unc 5	0.0029	0.0366	0.0789
Echinococcus multilocularis	histone lysine methyltransferase setb histone lysine methyltransferase eggless	0.006	0.1036	0.272
Brugia malayi	Thioredoxin reductase	0.0047	0.075	0.0857
Plasmodium vivax	flavodoxin domain containing protein	0.0158	0.3126	0.8749
Echinococcus granulosus	arginase 2 mitochondrial	0.0167	0.3314	0.929
Leishmania major	acetoin dehydrogenase e3 component-like protein	0.0016	0.0093	0.0033
Echinococcus multilocularis	6 phosphofructokinase	0.0108	0.2056	0.5662
Brugia malayi	Flap endonuclease-1	0.0026	0.0298	0.034
Toxoplasma gondii	phosphofructokinase domain-containing protein	0.0029	0.0369	0.1691
Brugia malayi	ImpB/MucB/SamB family protein	0.0019	0.0154	0.0177
Plasmodium vivax	glutathione reductase, putative	0.0047	0.075	0.1895
Toxoplasma gondii	6-phosphofructokinase	0.0029	0.0369	0.1691
Plasmodium vivax	SET domain protein, putative	0.006	0.1036	0.272
Mycobacterium tuberculosis	NADPH-dependent mycothiol reductase Mtr	0.0047	0.075	0.2985
Plasmodium vivax	oxidoreductase NAD-binding domain containing protein	0.002	0.0178	0.0246
Trypanosoma cruzi	oxidoreductase-protein, putative	0.002	0.0178	0.0279
Trypanosoma brucei	NADH-cytochrome b5 reductase, putative	0.002	0.0178	0.0427
Trichomonas vaginalis	conserved hypothetical protein	0.0167	0.3314	0.3254
Leishmania major	cytochrome-b5 reductase, putative	0.002	0.0178	0.0279
Trypanosoma brucei	NADH-cytochrome b5 reductase, putative	0.002	0.0178	0.0427
Giardia lamblia	Hypothetical protein	0.0158	0.3126	1
Schistosoma mansoni	alpha-galactosidase/alpha-n-acetylgalactosaminidase	0.0068	0.1197	0.3263
Wolbachia endosymbiont of Brugia malayi	exonuclease III	0.0019	0.0144	1
Leishmania major	glycogen synthase kinase, putative;with=GeneDB:LinJ18_V3.0270	0.0058	0.0985	0.2599
Trypanosoma brucei	dihydrolipoamide dehydrogenase	0.0016	0.0093	0.0185
Loa Loa (eye worm)	hypothetical protein	0.0029	0.0371	0.0335
Echinococcus multilocularis	cytochrome b5 reductase 4	0.002	0.0178	0.0246
Plasmodium vivax	6-phosphofructokinase, putative	0.0029	0.0369	0.0796
Trypanosoma brucei	DNA polymerase kappa, putative	0.0019	0.0154	0.0361
Schistosoma mansoni	alpha-galactosidase/alpha-n-acetylgalactosaminidase	0.0102	0.1923	0.5332
Loa Loa (eye worm)	ImpB/MucB/SamB family protein	0.0019	0.0154	0.0085
Mycobacterium ulcerans	exodeoxyribonuclease III protein XthA	0.0019	0.0144	0.0181
Giardia lamblia	Flap structure-specific endonuclease	0.0026	0.0298	0.0677
Trichomonas vaginalis	NADPH cytochrome P450, putative	0.0068	0.1204	0.1122
Echinococcus multilocularis	Glycoside hydrolase, family 27	0.0102	0.1923	0.5278
Entamoeba histolytica	type A flavoprotein, putative	0.0068	0.1204	0.3343
Loa Loa (eye worm)	hypothetical protein	0.0068	0.1197	0.1287
Echinococcus multilocularis	glycogen synthase kinase 3 beta	0.0058	0.0985	0.2574
Plasmodium vivax	hypothetical protein, conserved	0.0068	0.1204	0.3205
Plasmodium falciparum	ferredoxin--NADP reductase	0.002	0.0178	0.0246
Trypanosoma cruzi	dihydrolipoamide dehydrogenase, putative	0.0016	0.0093	0.0033
Schistosoma mansoni	retinoblastoma-binding protein 4 (rbbp4)	0.0029	0.0371	0.091
Trichomonas vaginalis	ap endonuclease, putative	0.0019	0.0144	0.0052
Echinococcus granulosus	thioredoxin glutathione reductase	0.0047	0.075	0.1895
Plasmodium vivax	6-phosphofructokinase, putative	0.0029	0.0369	0.0796
Chlamydia trachomatis	fructose-6-phosphate phosphotransferase	0.0029	0.0369	0.1375
Trypanosoma cruzi	NADPH--cytochrome P450 reductase, putative	0.0068	0.1204	0.3227
Trypanosoma cruzi	p450 reductase, putative	0.0178	0.356	1
Trypanosoma cruzi	dihydrolipoamide dehydrogenase, putative	0.0016	0.0093	0.0033
Trypanosoma cruzi	NADPH-dependent FMN/FAD containing oxidoreductase, putative	0.0178	0.356	1
Schistosoma mansoni	dihydrolipoamide dehydrogenase	0.0016	0.0093	0.0114
Echinococcus multilocularis	Alpha N acetylgalactosaminidase	0.0102	0.1923	0.5278
Treponema pallidum	diphosphate--fructose-6-phosphate 1-phosphotransferase	0.0108	0.2056	1
Echinococcus multilocularis	DNA (apurinic or apyrimidinic site) lyase	0.0019	0.0144	0.0149
Echinococcus granulosus	cytochrome b5 reductase 4	0.002	0.0178	0.0246
Trichomonas vaginalis	Arginase, putative	0.0167	0.3314	0.3254
Mycobacterium tuberculosis	Possible oxygenase	0.002	0.0178	0.0387
Trypanosoma cruzi	NADH-cytochrome b5 reductase, putative	0.002	0.0178	0.0279
Entamoeba histolytica	pyrophosphate-dependent phosphofructokinase	0.0029	0.0369	0.0708
Onchocerca volvulus	Netrin receptor homolog	0.0029	0.0366	0.0192
Echinococcus granulosus	NADPH cytochrome P450 reductase	0.0178	0.356	1
Entamoeba histolytica	type A flavoprotein, putative	0.0068	0.1204	0.3343
Brugia malayi	exodeoxyribonuclease III family protein	0.0019	0.0144	0.0165
Entamoeba histolytica	phosphofructokinase, putative	0.0108	0.2056	0.6031
Leishmania major	2-oxoglutarate dehydrogenase, e3 component, lipoamidedehydrogenase-like protein	0.0016	0.0093	0.0033
Echinococcus granulosus	death domain containing protein	0.0029	0.0366	0.0789
Entamoeba histolytica	deoxycytidyl transferase, putative	0.0019	0.0154	0.0033
Mycobacterium tuberculosis	Conserved hypothetical protein	0.0019	0.0154	0.0281
Trypanosoma brucei	NADPH-cytochrome p450 reductase, putative	0.0178	0.356	1
Trypanosoma brucei	NADH-cytochrome b5 reductase, putative	0.002	0.0178	0.0427
Loa Loa (eye worm)	hypothetical protein	0.006	0.1036	0.1101
Schistosoma mansoni	histone-lysine n-methyltransferase setb1	0.006	0.1036	0.2803
Trypanosoma brucei	NADH-dependent fumarate reductase, putative	0.002	0.0178	0.0427
Trypanosoma brucei	DNA polymerase kappa, putative	0.0019	0.0154	0.0361
Giardia lamblia	Pyrophosphate-fructose 6-phosphate 1-phosphotransferase alpha subunit	0.0029	0.0369	0.091
Echinococcus multilocularis	NADPH dependent diflavin oxidoreductase 1	0.0178	0.356	1
Mycobacterium tuberculosis	Probable reductase	0.0107	0.2038	0.8837
Mycobacterium tuberculosis	Probable oxidoreductase	0.002	0.0178	0.0387
Loa Loa (eye worm)	immunoglobulin I-set domain-containing protein	0.0029	0.0366	0.0329
Leishmania major	apurinic/apyrimidinic endonuclease-redox protein	0.0019	0.0144	0.0181
Echinococcus multilocularis	dna polymerase kappa	0.0019	0.0154	0.0179
Trypanosoma brucei	NADH-dependent fumarate reductase, putative	0.002	0.0178	0.0427
Toxoplasma gondii	NADPH-glutathione reductase	0.0016	0.0093	0.0215
Echinococcus granulosus	DNA apurinic or apyrimidinic site lyase	0.0019	0.0144	0.0149
Entamoeba histolytica	Flap nuclease, putative	0.0026	0.0298	0.0485
Toxoplasma gondii	flap structure-specific endonuclease 1, putative	0.0026	0.0298	0.1313
Echinococcus multilocularis		0.0167	0.3314	0.929
Schistosoma mansoni	rab geranylgeranyl transferase alpha subunit	0.0019	0.0154	0.0291
Loa Loa (eye worm)	cytochrome P450 family protein	0.0026	0.03	0.0253
Loa Loa (eye worm)	CMGC/GSK protein kinase	0.0058	0.0985	0.1043
Mycobacterium tuberculosis	Probable 6-phosphofructokinase PfkA (phosphohexokinase) (phosphofructokinase)	0.0108	0.2056	0.8918
Leishmania major	trypanothione reductase	0.0047	0.075	0.1922
Echinococcus multilocularis	Ankyrin	0.0029	0.0371	0.0804
Toxoplasma gondii	thioredoxin reductase	0.0047	0.075	0.3729
Giardia lamblia	Endonuclease/Exonuclease/phosphatase	0.0019	0.0144	0.017
Entamoeba histolytica	phosphofructokinase, putative	0.0108	0.2056	0.6031
Trypanosoma brucei	flap endonuclease-1 (FEN-1), putative	0.0026	0.0298	0.0767
Plasmodium falciparum	AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative	0.0019	0.0144	0.0149
Plasmodium vivax	flap endonuclease 1, putative	0.0026	0.0298	0.0592
Loa Loa (eye worm)	thioredoxin reductase	0.0047	0.075	0.0772
Echinococcus granulosus	dna polymerase kappa	0.0019	0.0154	0.0179
Trypanosoma brucei	NADH-cytochrome b5 reductase, putative	0.002	0.0178	0.0427
Leishmania major	NADPH-cytochrome p450 reductase-like protein	0.0178	0.356	1
Schistosoma mansoni	6-phosphofructokinase	0.0108	0.2056	0.5712
Toxoplasma gondii	NADH-cytochrome b5 reductase 1, putative	0.002	0.0178	0.0671
Schistosoma mansoni	alpha-galactosidase/alpha-n-acetylgalactosaminidase	0.0102	0.1923	0.5332
Schistosoma mansoni	histone-lysine n-methyltransferase setb1	0.006	0.1036	0.2803
Loa Loa (eye worm)	hypothetical protein	0.0178	0.356	0.4013
Loa Loa (eye worm)	FAD binding domain-containing protein	0.011	0.21	0.233
Trypanosoma cruzi	cytochrome P450 reductase, putative	0.0178	0.356	1
Toxoplasma gondii	phosphofructokinase PFKII	0.0029	0.0369	0.1691
Trypanosoma cruzi	p450 reductase, putative	0.002	0.0178	0.0279
Trypanosoma cruzi	dihydrolipoyl dehydrogenase, putative	0.0016	0.0093	0.0033
Trypanosoma cruzi	DNA polymerase kappa, putative	0.0019	0.0154	0.0211
Brugia malayi	flavodoxin family protein	0.0068	0.1204	0.1376
Plasmodium falciparum	S-adenosyl-L-methionine-dependent tRNA 4-demethylwyosine synthase, putative	0.0068	0.1204	0.3205
Leishmania major	ATP-dependent phosphofructokinase	0.0108	0.2056	0.5677
Schistosoma mansoni	arginase	0.0167	0.3314	0.9299
Trypanosoma brucei	dihydrolipoamide dehydrogenase, point mutation	0.0016	0.0093	0.0185
Trypanosoma cruzi	dihydrolipoamide dehydrogenase, putative	0.0016	0.0093	0.0033
Trypanosoma cruzi	agmatinase, putative	0.0061	0.1043	0.2765
Echinococcus multilocularis	thioredoxin glutathione reductase	0.0047	0.075	0.1895
Trypanosoma cruzi	cytochrome P450 reductase, putative	0.0178	0.356	1
Trypanosoma cruzi	NADH-cytochrome b5 reductase, putative	0.002	0.0178	0.0279
Brugia malayi	Immunoglobulin I-set domain containing protein	0.0029	0.0366	0.0418
Schistosoma mansoni	alpha-galactosidase/alpha-n-acetylgalactosaminidase	0.0068	0.1197	0.3263
Plasmodium falciparum	thioredoxin reductase	0.0047	0.075	0.1895
Trypanosoma brucei	cytochrome P450, putative	0.0016	0.0081	0.0152
Schistosoma mansoni	cytochrome P450 reductase	0.0178	0.356	1
Leishmania major	flap endonuclease-1 (FEN-1), putative	0.0026	0.0298	0.0624
Mycobacterium ulcerans	flavodoxin oxidoreductase	0.002	0.0178	0.0279
Leishmania major	p450 reductase, putative	0.0178	0.356	1
Brugia malayi	FAD binding domain containing protein	0.0178	0.356	0.4069
Toxoplasma gondii	flavodoxin domain-containing protein	0.0089	0.1638	0.8476
Brugia malayi	flavodoxin family protein	0.0178	0.356	0.4069
Mycobacterium tuberculosis	Hypothetical oxidoreductase	0.002	0.0178	0.0387
Loa Loa (eye worm)	CMGC/GSK protein kinase	0.0058	0.0985	0.1043
Plasmodium falciparum	ATP-dependent 6-phosphofructokinase	0.0029	0.0369	0.0796
Trypanosoma brucei	ATP-dependent 6-phosphofructokinase, glycosomal	0.0108	0.2056	0.5743
Plasmodium falciparum	flap endonuclease 1	0.0026	0.0298	0.0592
Brugia malayi	Cytochrome b5-like Heme/Steroid binding domain containing protein	0.002	0.0178	0.0203
Schistosoma mansoni	DNA polymerase eta	0.0019	0.0154	0.0291
Leishmania major	dihydrolipoamide dehydrogenase, putative	0.0016	0.0093	0.0033
Trypanosoma brucei	DNA polymerase kappa, putative	0.0019	0.0154	0.0361
Toxoplasma gondii	exonuclease III APE	0.0019	0.0144	0.049
Echinococcus granulosus	6 phosphofructokinase	0.0108	0.2056	0.5662
Echinococcus granulosus	methionine synthase reductase	0.011	0.21	0.579
Leishmania major	DNA polymerase kappa, putative	0.0019	0.0154	0.0211
Entamoeba histolytica	type A flavoprotein, putative	0.0068	0.1204	0.3343
Treponema pallidum	exodeoxyribonuclease (exoA)	0.0019	0.0144	0.0262
Trypanosoma brucei	NADH-cytochrome b5 reductase-like protein	0.002	0.0178	0.0427
Trypanosoma cruzi	NADH-dependent fumarate reductase, putative	0.002	0.0178	0.0279
Echinococcus multilocularis	NADPH cytochrome P450 reductase	0.0178	0.356	1
Brugia malayi	Cytochrome P450 family protein	0.0016	0.0081	0.0092
Brugia malayi	Cytochrome P450 family protein	0.0016	0.0081	0.0092
Mycobacterium tuberculosis	Probable nitrite reductase [NAD(P)H] large subunit [FAD flavoprotein] NirB	0.0107	0.2038	0.8837
Loa Loa (eye worm)	diaphorase	0.002	0.0178	0.0112
Echinococcus granulosus	nuclear factor of activated T cells 5	0.0149	0.2931	0.8185
Plasmodium vivax	arginase, putative	0.0167	0.3314	0.929
Trichomonas vaginalis	phosphofructokinase, putative	0.0029	0.0369	0.0279
Plasmodium vivax	ferredoxin--NADP reductase, putative	0.002	0.0178	0.0246
Trypanosoma brucei	NADH-cytochrome b5 reductase, putative	0.002	0.0178	0.0427
Echinococcus multilocularis	flap endonuclease 1	0.0026	0.0298	0.0592
Brugia malayi	Death domain containing protein	0.0029	0.0366	0.0418
Schistosoma mansoni	histone-lysine n-methyltransferase suv9	0.006	0.1036	0.2803
Loa Loa (eye worm)	hypothetical protein	0.0029	0.0366	0.0329
Mycobacterium ulcerans	formate dehydrogenase H FdhF	0.0178	0.356	1
Mycobacterium ulcerans	6-phosphofructokinase	0.0108	0.2056	0.5677
Trichomonas vaginalis	CMGC family protein kinase	0.0058	0.0985	0.0901
Echinococcus multilocularis	nuclear factor of activated T cells 5	0.0149	0.2931	0.8185
Plasmodium falciparum	ATP-dependent 6-phosphofructokinase	0.0029	0.0369	0.0796
Trypanosoma cruzi	DNA polymerase kappa, putative	0.0019	0.0154	0.0211
Entamoeba histolytica	type A flavoprotein, putative	0.0068	0.1204	0.3343
Mycobacterium tuberculosis	NAD(P)H quinone reductase LpdA	0.0119	0.2294	1
Echinococcus multilocularis	ankyrin repeat and death domain containing protein	0.0029	0.0366	0.0789
Trypanosoma brucei	DNA polymerase IV, putative	0.0019	0.0154	0.0361
Brugia malayi	6-phosphofructokinase	0.0108	0.2056	0.235
Trypanosoma brucei	DNA polymerase kappa, putative	0.0019	0.0154	0.0361
Schistosoma mansoni	histone-lysine n-methyltransferase setb1	0.006	0.1036	0.2803
Trypanosoma brucei	DNA polymerase kappa, putative	0.0019	0.0154	0.0361
Trypanosoma brucei	NADPH-dependent diflavin oxidoreductase 1	0.0178	0.356	1
Brugia malayi	diaphorase	0.002	0.0178	0.0203
Entamoeba histolytica	phosphofructokinase, putative	0.0108	0.2056	0.6031
Loa Loa (eye worm)	flavodoxin family protein	0.0068	0.1204	0.1295
Plasmodium falciparum	glycogen synthase kinase 3	0.0058	0.0985	0.2574
Trypanosoma brucei	oxidoreductase-protein, putative	0.002	0.0178	0.0427
Echinococcus granulosus	Alpha N acetylgalactosaminidase	0.0102	0.1923	0.5278
Leishmania major	hypothetical protein, conserved	0.0068	0.1204	0.3227
Trypanosoma cruzi	arginase, putative	0.0061	0.1043	0.2765
Schistosoma mansoni	netrin receptor unc5	0.0029	0.0366	0.0894
Echinococcus multilocularis	dna polymerase eta	0.0019	0.0154	0.0179
Trypanosoma brucei	NADPH--cytochrome P450 reductase, putative	0.0178	0.356	1
Trypanosoma cruzi	Flavodoxin/Radical SAM superfamily/Wyosine base formation, putative	0.0068	0.1204	0.3227
Toxoplasma gondii	ferredoxin NADP+ oxidoreductase FNR	0.002	0.0178	0.0671
Entamoeba histolytica	protein kinase, putative	0.0058	0.0985	0.2653
Trypanosoma brucei	trypanothione reductase	0.0047	0.075	0.2045
Trypanosoma brucei	apurinic/apyrimidinic endonuclease, putative	0.0019	0.0144	0.0331
Leishmania major	DNA polymerase eta, putative	0.0019	0.0154	0.0211
Mycobacterium tuberculosis	Probable monooxygenase	0.002	0.0178	0.0387
Trichomonas vaginalis	phosphofructokinase, putative	0.0108	0.2056	0.1983
Trichomonas vaginalis	phosphofructokinase, putative	0.0108	0.2056	0.1983
Brugia malayi	Pre-SET motif family protein	0.0421	0.875	1
Schistosoma mansoni	ap endonuclease	0.0019	0.0144	0.0261
Mycobacterium tuberculosis	Putative ferredoxin reductase	0.0107	0.2038	0.8837
Echinococcus granulosus	dna polymerase eta	0.0019	0.0154	0.0179
Leishmania major	dihydrolipoamide dehydrogenase, putative	0.0016	0.0093	0.0033
Toxoplasma gondii	melibiase subfamily protein	0.0102	0.1923	1
Trypanosoma brucei	NADPH--cytochrome P450 reductase, putative	0.0178	0.356	1
Schistosoma mansoni	5-methyl tetrahydrofolate-homocysteine methyltransferase reductase	0.011	0.21	0.5839
Trichomonas vaginalis	conserved hypothetical protein	0.0167	0.3314	0.3254
Loa Loa (eye worm)	hypothetical protein	0.0019	0.0154	0.0085
Mycobacterium leprae	PROBABLE 6-PHOSPHOFRUCTOKINASE PFKA (PHOSPHOHEXOKINASE) (PHOSPHOFRUCTOKINASE)	0.0108	0.2056	0.0695
Schistosoma mansoni	flap endonuclease-1	0.0023	0.0245	0.0548
Plasmodium vivax	NADPH-cytochrome p450 reductase, putative	0.0178	0.356	1
Trypanosoma brucei	protein kinase, putative	0.0058	0.0985	0.2712
Mycobacterium tuberculosis	Probable NADH dehydrogenase Ndh	0.0107	0.2038	0.8837
Brugia malayi	follicle stimulating hormone receptor	0.0235	0.4774	0.5455
Echinococcus granulosus	terminal deoxycytidyl transferase rev1	0.0019	0.0154	0.0179
Echinococcus granulosus	3'partial\|arginase 2 mitochondrial	0.0167	0.3314	0.929
Brugia malayi	Uncoordinated protein 44	0.0029	0.0366	0.0418
Echinococcus granulosus	glycogen synthase kinase 3 beta	0.0058	0.0985	0.2574
Schistosoma mansoni	NADH-cytochrome B5 reductase	0.002	0.0178	0.0358
Trypanosoma brucei	NADH-dependent fumarate reductase	0.002	0.0178	0.0427
Echinococcus multilocularis	netrin receptor unc 5	0.0029	0.0366	0.0789
Trypanosoma brucei	DNA polymerase kappa, putative	0.0019	0.0154	0.0361
Echinococcus multilocularis	arginase 2, mitochondrial	0.0167	0.3314	0.929
Trypanosoma cruzi	DNA polymerase eta, putative	0.0019	0.0154	0.0211
Trypanosoma cruzi	NADH-cytochrome b5 reductase, putative	0.002	0.0178	0.0279
Schistosoma mansoni	terminal deoxycytidyl transferase	0.0019	0.0154	0.0291
Plasmodium vivax	AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative	0.0019	0.0144	0.0149
Trypanosoma cruzi	apurinic/apyrimidinic endonuclease, putative	0.0019	0.0144	0.0181
Trypanosoma brucei	DNA polymerase IV, putative	0.0019	0.0154	0.0361
Leishmania major	reductase, putative	0.002	0.0178	0.0279
Trypanosoma cruzi	oxidoreductase-like protein, putative	0.002	0.0178	0.0279

Activities

Activity type	Activity value	Assay description	Source	Reference
IC50 (binding)	= 0.06 uM	Inhibition of GSK3beta (unknown origin)	ChEMBL.	18054489
IC50 (binding)	= 0.06 uM	Inhibition of GSK3beta (unknown origin)	ChEMBL.	18054489
IC50 (binding)	= 0.7 uM	Inhibition of AP1-mediated transcriptional activation in human Jurkat cells	ChEMBL.	18054489
IC50 (binding)	= 1.7 uM	Inhibition of NFkappaB-mediated transcriptional activation in human A549 cells	ChEMBL.	18054489

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: CHEMBL252669

Bibliographic References

1 literature reference was collected for this gene.

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Detailed information for compound 504614