TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 430.459 | Formula: C23H22N6O3
H donors: 1 H acceptors: 3 LogP: 5.34 Rotable bonds: 8
Rule of 5 violations (Lipinski): 1
SMILES: Cc1ccc(cc1)C(=O)N/N=C(/c1ccc(cc1)N(C)C)\N=N\c1cccc(c1)[N+](=O)[O-]
InChi: 1S/C23H22N6O3/c1-16-7-9-18(10-8-16)23(30)27-26-22(17-11-13-20(14-12-17)28(2)3)25-24-19-5-4-6-21(15-19)29(31)32/h4-15H,1-3H3,(H,27,30)/b25-24+,26-22-
InChiKey: IDTITUILFMAGOQ-LQMSAZQOSA-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

No curated genes were found associated with this compound

Predicted pathogen targets for this compound

By orthology

No druggable targets predicted by orthology data

By sequence similarity to non orthologous known druggable targets

No druggable targets predicted by sequence similarity

Ranking Plot

Putative Targets List

Species	Potential target	Raw	Global	Species
Echinococcus multilocularis	sodium:potassium dependent atpase beta subunit	0.002	0.0097	0.0096
Echinococcus granulosus	nervana 2	0.002	0.0097	0.0096
Leishmania major	phosphatidylinositol 4-kinase, putative	0.0064	0.0546	0.0546
Trichomonas vaginalis	phopsphatidylinositol 3-kinase, drosophila, putative	0.0064	0.0546	0.0527
Brugia malayi	Pin1-type peptidyl-prolyl cis-trans isomerase, BmPin1	0.0034	0.0244	0.0243
Echinococcus granulosus	phosphatidylinositol 3 kinase catalytic subunit	0.0064	0.0546	0.0545
Leishmania major	hypothetical protein, unknown function	0.0064	0.0546	0.0546
Loa Loa (eye worm)	TAR-binding protein	0.0128	0.1201	0.1201
Brugia malayi	Phosphatidylinositol 3- and 4-kinase family protein	0.0064	0.0546	0.0545
Leishmania major	peptidyl-prolyl cis-trans isomerase/rotamase, putative,PPIase, putative	0.0033	0.0235	0.0235
Echinococcus granulosus	expressed protein	0.0034	0.0244	0.0243
Schistosoma mansoni	tar DNA-binding protein	0.0128	0.1201	0.1201
Schistosoma mansoni	hypothetical protein	0.0016	0.0059	0.0058
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0989	1	1
Loa Loa (eye worm)	phosphatidylinositol 3	0.0064	0.0546	0.0545
Echinococcus multilocularis	expressed protein	0.0034	0.0244	0.0243
Brugia malayi	Phosphatidylinositol 3- and 4-kinase family protein	0.0064	0.0546	0.0545
Toxoplasma gondii	phosphatidylinositol 3- and 4-kinase	0.0064	0.0546	0.0736
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0187	0.1805	0.1789
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0332	0.3283	0.3269
Toxoplasma gondii	AGC kinase	0.003	0.0203	0.0274
Trypanosoma cruzi	phosphatidylinositol kinase related protein, putative	0.0064	0.0546	0.0546
Schistosoma mansoni	rotamase	0.0034	0.0244	0.0243
Leishmania major	target of rapamycin (TOR) kinase 1, putative	0.0989	1	1
Brugia malayi	Voltage-gated potassium channel, HERG (KCNH2)-related. C. elegans unc-103 ortholog	0.0036	0.0264	0.0263
Trichomonas vaginalis	phosphatidylinositol kinase, putative	0.0064	0.0546	0.0527
Entamoeba histolytica	phosphatidylinositol 3-kinase, putative	0.0064	0.0546	0.0451
Trichomonas vaginalis	phosphatidylinositol 3-kinase class, putative	0.0064	0.0546	0.0527
Trypanosoma brucei	phosphatidylinositol 3-kinase, putative	0.0332	0.3283	0.3283
Loa Loa (eye worm)	pigment dispersing factor receptor c	0.0051	0.0416	0.0415
Trypanosoma cruzi	phosphatidylinositol 4-kinase, putative	0.0064	0.0546	0.0546
Trypanosoma brucei	FAT domain/Rapamycin binding domain/Phosphatidylinositol 3- and 4-kinase, putative	0.0411	0.4091	0.4091
Trypanosoma brucei	FK506-binding protein (FKBP)-type peptidyl-prolyl isomerase, putative	0.0054	0.0443	0.0443
Echinococcus granulosus	nervana 2	0.002	0.0097	0.0096
Entamoeba histolytica	phosphatidylinositol 3-kinase, putative	0.0064	0.0546	0.0451
Trichomonas vaginalis	AGC family protein kinase	0.0032	0.0224	0.0204
Brugia malayi	calcium-independent alpha-latrotoxin receptor 2, putative	0.0016	0.0059	0.0058
Trichomonas vaginalis	AGC family protein kinase	0.0032	0.0224	0.0204
Echinococcus granulosus	FKBP12 rapamycin complex associated protein	0.0989	1	1
Trichomonas vaginalis	AGC family protein kinase	0.0032	0.0224	0.0204
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0332	0.3283	0.3269
Echinococcus granulosus	peptidyl prolyl cis trans isomerase FKBP1A	0.0054	0.0443	0.0442
Entamoeba histolytica	hypothetical protein	0.0064	0.0546	0.0451
Brugia malayi	RNA recognition motif domain containing protein	0.0128	0.1201	0.1201
Echinococcus granulosus	Glutaredoxin protein 5	0.002	0.0097	0.0096
Entamoeba histolytica	PH domain containing protein kinase, putative	0.0022	0.012	0.0021
Brugia malayi	Phosphatidylinositol 3- and 4-kinase family protein	0.0064	0.0546	0.0545
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0989	1	1
Entamoeba histolytica	phosphatidylinositol 3-kinase, putative	0.0064	0.0546	0.0451
Echinococcus granulosus	tumor protein p63	0.0336	0.3329	0.3329
Entamoeba histolytica	phosphatidylinositol 4-kinase, putative	0.0064	0.0546	0.0451
Trypanosoma brucei	phosphatidylinositol kinase related protein, putative	0.0187	0.1805	0.1805
Echinococcus granulosus	serine/threonine protein kinase	0.0022	0.012	0.0119
Echinococcus granulosus	serine threonine protein kinase nrc	0.002	0.0099	0.0099
Loa Loa (eye worm)	phosphatidylinositol kinase	0.0064	0.0546	0.0545
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0591	0.5932	0.5924
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0533	0.5342	0.5333
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0787	0.7932	0.7928
Trichomonas vaginalis	immunophilin, putative	0.0054	0.0443	0.0424
Echinococcus granulosus	phosphatidylinositol 4 kinase alpha	0.0064	0.0546	0.0545
Schistosoma mansoni	serine/threonine-protein kinase	0.0022	0.012	0.0119
Brugia malayi	Phosphatidylinositol 3- and 4-kinase family protein	0.0187	0.1805	0.1804
Echinococcus multilocularis	GPCR, family 2	0.0016	0.0059	0.0058
Schistosoma mansoni	tar DNA-binding protein	0.0128	0.1201	0.1201
Schistosoma mansoni	phosphatidylinositol 3-kinase class	0.0064	0.0546	0.0545
Entamoeba histolytica	phosphatidylinositol3-kinaseTor2, putative	0.0989	1	1
Trichomonas vaginalis	rotamase, putative	0.0033	0.0235	0.0216
Schistosoma mansoni	phosphatidylinositol 4-kinase	0.0064	0.0546	0.0545
Echinococcus granulosus	peptidyl prolyl cis trans isomerase FKBP4	0.0054	0.0443	0.0442
Wolbachia endosymbiont of Brugia malayi	parvulin-like peptidyl-prolyl isomerase, PPID	0.001	0	0.5
Giardia lamblia	Phosphoinositide-3-kinase, class 3	0.0064	0.0546	0.0451
Entamoeba histolytica	phosphatidylinositol-4,5-bisphosphate 3-kinase, putative	0.0064	0.0546	0.0451
Echinococcus multilocularis	phosphatidylinositol 4 phosphate 3 kinase C2	0.0064	0.0546	0.0545
Entamoeba histolytica	PH domain containing protein kinase, putative	0.0022	0.012	0.0021
Trypanosoma brucei	phosphatidylinositol 4-kinase, putative	0.0989	1	1
Trypanosoma brucei	phosphatidylinositol 3-kinase catalytic subunit, putative	0.0064	0.0546	0.0546
Trypanosoma cruzi	rac serine-threonine kinase, putative	0.0022	0.012	0.012
Trypanosoma cruzi	phosphatidylinositol 3-kinase, putative	0.0187	0.1805	0.1805
Schistosoma mansoni	cellular tumor antigen P53	0.0049	0.0396	0.0396
Brugia malayi	Corticotropin releasing factor receptor 2 precursor, putative	0.0051	0.0416	0.0415
Echinococcus granulosus	cadherin EGF LAG seven pass G type receptor	0.0016	0.0059	0.0058
Trypanosoma cruzi	target of rapamycin kinase 3	0.0787	0.794	0.794
Echinococcus granulosus	phosphatidylinositol 4 phosphate 3 kinase C2	0.0064	0.0546	0.0545
Schistosoma mansoni	phosphatidylinositol 4-kinase type-II	0.0064	0.0546	0.0545
Plasmodium vivax	hypothetical protein	0.0064	0.0546	1
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0736	0.741	0.7405
Echinococcus granulosus	GPCR family 2	0.0016	0.0059	0.0058
Loa Loa (eye worm)	phosphatidylinositol 3	0.0989	1	1
Giardia lamblia	70 kDa peptidylprolyl isomerase, putative	0.0054	0.0443	0.0347
Loa Loa (eye worm)	hypothetical protein	0.0031	0.0215	0.0214
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0736	0.741	0.7405
Leishmania major	phosphatidylinositol kinase related protein, putative	0.0064	0.0546	0.0546
Echinococcus multilocularis	serine protein kinase ATM	0.0187	0.1805	0.1804
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0534	0.5351	0.5341
Echinococcus granulosus	tar DNA binding protein	0.0128	0.1201	0.1201
Schistosoma mansoni	immunophilin	0.0054	0.0443	0.0442
Schistosoma mansoni	tar DNA-binding protein	0.0128	0.1201	0.1201
Echinococcus multilocularis	Zinc finger, PHD finger	0.0064	0.0546	0.0545
Plasmodium vivax	hypothetical protein, conserved	0.0064	0.0546	1
Trichomonas vaginalis	peptidylprolyl isomerase, putative	0.0054	0.0443	0.0424
Loa Loa (eye worm)	hypothetical protein	0.0046	0.0368	0.0367
Plasmodium falciparum	phosphatidylinositol 4-kinase	0.0064	0.0546	1
Trichomonas vaginalis	AGC family protein kinase	0.0032	0.0224	0.0204
Schistosoma mansoni	hypothetical protein	0.0016	0.0059	0.0058
Schistosoma mansoni	tar DNA-binding protein	0.0128	0.1201	0.1201
Schistosoma mansoni	hypothetical protein	0.0145	0.1371	0.1371
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0591	0.5932	0.5924
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0064	0.0546	0.0527
Echinococcus multilocularis	PIK kinase, FAT and Armadillo domain containing protein	0.0145	0.1371	0.1371
Echinococcus granulosus	Phosphatidylinositol 4 kinase type 2 beta	0.0064	0.0546	0.0545
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0533	0.5342	0.5333
Loa Loa (eye worm)	FKBP-type peptidyl-prolyl cis-trans isomerase-12	0.0054	0.0443	0.0442
Schistosoma mansoni	tar DNA-binding protein	0.0128	0.1201	0.1201
Trypanosoma cruzi	phosphatidylinositol kinase related protein, putative	0.0123	0.1153	0.1153
Onchocerca volvulus		0.0064	0.0546	1
Schistosoma mansoni	phosphatidylinositol 4-kinase	0.0064	0.0546	0.0545
Leishmania major	phosphatidylinositol kinase, putative	0.0064	0.0546	0.0546
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0585	0.5873	0.5864
Echinococcus granulosus	serine protein kinase ATM	0.0187	0.1805	0.1804
Entamoeba histolytica	peptidyl-prolyl cis-trans isomerase, FKBP-type , putative	0.0054	0.0443	0.0347
Echinococcus multilocularis	tumor protein p63	0.0336	0.3329	0.3329
Plasmodium falciparum	peptidyl-prolyl cis-trans isomerase FKBP35	0.0054	0.0443	0.7704
Trypanosoma brucei	phosphatidylinositol 3-related kinase, putative	0.0332	0.3283	0.3283
Schistosoma mansoni	serine/threonine-protein kinase	0.0022	0.012	0.0119
Echinococcus multilocularis	peptidyl prolyl cis trans isomerase FKBP4	0.0046	0.0368	0.0367
Toxoplasma gondii	non-specific serine/threonine protein kinase	0.0208	0.2023	0.2731
Schistosoma mansoni	voltage-gated potassium channel	0.004	0.0298	0.0297
Trypanosoma cruzi	FK506-binding protein (FKBP)-type peptidyl-prolyl isomerase, putative	0.0054	0.0443	0.0443
Echinococcus multilocularis	peptidyl prolyl cis trans isomerase FKBP4	0.0054	0.0443	0.0442
Loa Loa (eye worm)	hypothetical protein	0.0064	0.0546	0.0545
Giardia lamblia	Hypothetical protein	0.0064	0.0546	0.0451
Leishmania major	phosphatidylinositol 4-kinase alpha, putative	0.0064	0.0546	0.0546
Trichomonas vaginalis	conserved hypothetical protein	0.0145	0.1371	0.1354
Brugia malayi	Protein kinase domain containing protein	0.0032	0.0224	0.0223
Plasmodium falciparum	phosphatidylinositol 3- and 4-kinase, putative	0.0064	0.0546	1
Loa Loa (eye worm)	Pin1-type peptidyl-prolyl cis-trans isomerase	0.0034	0.0244	0.0243
Schistosoma mansoni	phosphatidylinositol-45-bisphosphate 3-kinase catalytic subunit alpha PI3K	0.0064	0.0546	0.0545
Leishmania major	phosphatidylinositol 3-kinase, putative	0.0332	0.3283	0.3283
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0187	0.1805	0.1789
Trypanosoma cruzi	rac serine-threonine kinase, putative	0.002	0.0099	0.0099
Giardia lamblia	GTOR	0.0989	1	1
Schistosoma mansoni	fkbp-rapamycin associated protein	0.0187	0.1805	0.1804
Trypanosoma brucei	peptidyl-prolyl cis-trans isomerase, putative	0.0054	0.0443	0.0443
Toxoplasma gondii	peptidylprolyl isomerase	0.0033	0.0235	0.0317
Echinococcus granulosus	phosphatidylinositol 4 kinase beta	0.0064	0.0546	0.0545
Loa Loa (eye worm)	MH2 domain-containing protein	0.0122	0.1144	0.1143
Loa Loa (eye worm)	RNA recognition domain-containing protein domain-containing protein	0.0128	0.1201	0.1201
Loa Loa (eye worm)	hypothetical protein	0.0208	0.2023	0.2023
Trypanosoma cruzi	peptidyl-prolyl cis-trans isomerase, putative	0.0054	0.0443	0.0443
Brugia malayi	FAT domain containing protein	0.0145	0.1371	0.1371
Echinococcus multilocularis	serine threonine protein kinase nrc serine threonine protein kinase gad	0.002	0.0099	0.0099
Trichomonas vaginalis	rotamase, putative	0.0034	0.0244	0.0224
Plasmodium falciparum	phosphatidylinositol 3-kinase	0.0064	0.0546	1
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0332	0.3283	0.3269
Trypanosoma cruzi	peptidyl-prolyl cis-trans isomerase	0.0033	0.0235	0.0235
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0585	0.5873	0.5864
Trichomonas vaginalis	AGC family protein kinase	0.0032	0.0224	0.0204
Entamoeba histolytica	hypothetical protein	0.0064	0.0546	0.0451
Schistosoma mansoni	ataxia telangiectasia mutated (atm)	0.0187	0.1805	0.1804
Trichomonas vaginalis	voltage and ligand gated potassium channel, putative	0.0034	0.0239	0.022
Entamoeba histolytica	peptidyl-prolyl cis-trans isomerase, putative	0.0033	0.0235	0.0137
Echinococcus granulosus	calcium:calmodulin dependent protein kinase	0.002	0.0099	0.0099
Loa Loa (eye worm)	hypothetical protein	0.0123	0.1153	0.1152
Echinococcus multilocularis	nervana 2	0.002	0.0097	0.0096
Trichomonas vaginalis	phosphatidylinositol kinase, putative	0.0064	0.0546	0.0527
Loa Loa (eye worm)	phosphatidylinositol 3	0.0064	0.0546	0.0545
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0844	0.8522	0.8519
Loa Loa (eye worm)	hypothetical protein	0.0064	0.0546	0.0545
Loa Loa (eye worm)	phosphatidylinositol 3	0.0064	0.0546	0.0545
Treponema pallidum	peptidyl-prolyl cis-trans isomerase, FKBP-type, 22 kDa (fklB)	0.0054	0.0443	0.5
Trypanosoma cruzi	phosphatidylinositol 4-kinase alpha, putative	0.0064	0.0546	0.0546
Entamoeba histolytica	FKBP-rapamycin associated protein (FRAP), putative	0.0989	1	1
Entamoeba histolytica	phosphatidylinositol 3-kinase 3, putative	0.0064	0.0546	0.0451
Echinococcus multilocularis		0.0064	0.0546	0.0545
Brugia malayi	Phosphatidylinositol 3- and 4-kinase family protein	0.0332	0.3283	0.3282
Plasmodium vivax	phosphatidylinositol 3- and 4-kinase, putative	0.0064	0.0546	1
Loa Loa (eye worm)	hypothetical protein	0.0187	0.1805	0.1804
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0064	0.0546	0.0527
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0787	0.7932	0.7928
Echinococcus granulosus	diuretic hormone 44 receptor GPRdih2	0.0016	0.0059	0.0058
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0736	0.741	0.7405
Loa Loa (eye worm)	RNA binding protein	0.0128	0.1201	0.1201
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0534	0.5351	0.5341
Entamoeba histolytica	protein kinase, putative	0.003	0.0203	0.0105
Entamoeba histolytica	hypothetical protein	0.0187	0.1805	0.1723
Echinococcus granulosus	sodium:potassium dependent atpase beta subunit	0.002	0.0097	0.0096
Brugia malayi	TAR-binding protein	0.0128	0.1201	0.1201
Echinococcus multilocularis	cadherin EGF LAG seven pass G type receptor	0.0016	0.0059	0.0058
Entamoeba histolytica	phosphatidylinositol 3-kinase, putative	0.0064	0.0546	0.0451
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0736	0.741	0.7405
Echinococcus multilocularis	serine:threonine protein kinase SMG1	0.0187	0.1805	0.1804
Trypanosoma brucei	phosphatidylinositol 4-kinase, putative	0.0064	0.0546	0.0546
Entamoeba histolytica	phosphatidylinositol 3-kinase, putative	0.0064	0.0546	0.0451
Schistosoma mansoni	immunophilin FK506 binding protein FKBP12	0.0054	0.0443	0.0442
Giardia lamblia	Phosphoinositide-3-kinase, catalytic, alpha polypeptide	0.0064	0.0546	0.0451
Toxoplasma gondii	FATC domain-containing protein	0.0187	0.1805	0.2436
Trypanosoma cruzi	phosphatidylinositol 3-kinase vps34-like	0.0064	0.0546	0.0546
Schistosoma mansoni	hypothetical protein	0.0064	0.0546	0.0545
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0534	0.5351	0.5341
Leishmania major	target of rapamycin kinase (TOR) kinase 3	0.0787	0.794	0.794
Trichomonas vaginalis	AGC family protein kinase	0.0032	0.0224	0.0204
Echinococcus granulosus	DNA dependent protein kinase catalytic subunit	0.0064	0.0546	0.0545
Trypanosoma cruzi	phosphatidylinositol 3-kinase 2, putative	0.0064	0.0546	0.0546
Loa Loa (eye worm)	AGC/RSK/P70 protein kinase	0.003	0.0203	0.0202
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0533	0.5342	0.5333
Echinococcus multilocularis	rac serine:threonine kinase	0.0022	0.012	0.0119
Echinococcus multilocularis	phosphatidylinositol 3 and 4 kinase	0.0332	0.3283	0.3282
Brugia malayi	Phosphatidylinositol 3- and 4-kinase family protein	0.0187	0.1805	0.1804
Echinococcus multilocularis	nervana 2	0.002	0.0097	0.0096
Leishmania major	fk506-binding protein 1-like protein	0.0054	0.0443	0.0443
Echinococcus multilocularis	phosphatidylinositol 4,5 bisphosphate 3 kinase	0.0064	0.0546	0.0545
Trypanosoma brucei	rac serine-threonine kinase, putative	0.0032	0.0224	0.0224
Loa Loa (eye worm)	hypothetical protein	0.0145	0.1371	0.1371
Trichomonas vaginalis	conserved hypothetical protein	0.0208	0.2023	0.2007
Brugia malayi	Latrophilin receptor protein 2	0.0016	0.0059	0.0058
Plasmodium vivax	70 kDa peptidylprolyl isomerase, putative	0.0054	0.0443	0.7704
Loa Loa (eye worm)	transcription factor SMAD2	0.0122	0.1144	0.1143
Schistosoma mansoni	hypothetical protein	0.0016	0.0059	0.0058
Brugia malayi	latrophilin 2 splice variant baaae	0.0035	0.0251	0.025
Trypanosoma cruzi	peptidyl-prolyl cis-trans isomerase	0.0033	0.0235	0.0235
Entamoeba histolytica	peptidyl-prolyl cis-trans isomerase, FKBP-type, putative	0.0054	0.0443	0.0347
Mycobacterium ulcerans	FK-506 binding protein, peptidyl-prolyl cis-trans isomerase	0.0054	0.0443	0.5
Trichomonas vaginalis	phosphatidylinositol 4-kinase, putative	0.0064	0.0546	0.0527
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0736	0.741	0.7405
Trichomonas vaginalis	phosphatidylinositol 3-kinase catalytic subunit alpha, beta, delta, putative	0.0064	0.0546	0.0527
Trypanosoma brucei	peptidyl-prolyl cis-trans isomerase/rotamase, putative	0.0033	0.0235	0.0235
Brugia malayi	Phosphatidylinositol 3- and 4-kinase family protein	0.0064	0.0546	0.0545
Loa Loa (eye worm)	phosphatidylinositol 3	0.0064	0.0546	0.0545
Trichomonas vaginalis	phopsphatidylinositol 3-kinase, drosophila, putative	0.0064	0.0546	0.0527
Loa Loa (eye worm)	latrophilin receptor protein 2	0.0016	0.0059	0.0058
Trypanosoma cruzi	phosphatidylinositol 3-kinase 2, putative	0.0064	0.0546	0.0546
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0736	0.741	0.7405
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0736	0.741	0.7405
Plasmodium vivax	phosphatidylinositol 4-kinase, putative	0.0064	0.0546	1
Loa Loa (eye worm)	hypothetical protein	0.0049	0.0396	0.0396
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0989	1	1
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0332	0.3283	0.3269
Brugia malayi	FKBP-type peptidyl-prolyl cis-trans isomerase-12, BmFKBP-12	0.0054	0.0443	0.0442
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0123	0.1153	0.1135
Brugia malayi	FKBP-type peptidyl-prolyl cis-trans isomerase-59, BmFKBP59	0.0054	0.0443	0.0442
Echinococcus granulosus	Phosphatidylinositol 4 kinase type 2 beta	0.0064	0.0546	0.0545
Loa Loa (eye worm)	hypothetical protein	0.0051	0.0416	0.0415
Brugia malayi	Phosphatidylinositol 3- and 4-kinase family protein	0.0064	0.0546	0.0545
Echinococcus multilocularis	tar DNA binding protein	0.0128	0.1201	0.1201
Trypanosoma cruzi	Protein kinase B	0.0022	0.012	0.012
Schistosoma mansoni	immunophilin	0.0054	0.0443	0.0442
Trypanosoma cruzi	Phosphatidylinositol 3-kinase tor2	0.0989	1	1
Echinococcus multilocularis	diuretic hormone 44 receptor GPRdih2	0.0016	0.0059	0.0058
Leishmania major	hypothetical protein, conserved	0.0064	0.0546	0.0546
Schistosoma mansoni	phosphatidylinositol-45-bisphosphate 3-kinase catalytic subunit alpha PI3K	0.0064	0.0546	0.0545
Brugia malayi	RNA binding protein	0.0128	0.1201	0.1201
Schistosoma mansoni	phosphatidylinositol-45-bisphosphate 3-kinase catalytic subunit alpha PI3K	0.0064	0.0546	0.0545
Loa Loa (eye worm)	hypothetical protein	0.0202	0.1953	0.1953
Trichomonas vaginalis	voltage and ligand gated potassium channel, putative	0.0034	0.0239	0.022
Brugia malayi	p70 ribosomal S6 kinase beta	0.003	0.0203	0.0202
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0265	0.2605	0.259
Echinococcus granulosus	serine:threonine protein kinase SMG1	0.0187	0.1805	0.1804
Brugia malayi	Phosphatidylinositol 3- and 4-kinase family protein	0.0064	0.0546	0.0545
Toxoplasma gondii	target of rapamycin (TOR), putative	0.0736	0.741	1
Plasmodium vivax	phosphatidylinositol 4-kinase, putative	0.0064	0.0546	1
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0663	0.6673	0.6666
Toxoplasma gondii	phosphatidylinositol 3- and 4-kinase	0.0064	0.0546	0.0736
Echinococcus granulosus	PIK kinase FAT and Armadillo domain containing protein	0.0145	0.1371	0.1371
Toxoplasma gondii	phosphatidylinositol 3- and 4-kinase	0.0064	0.0546	0.0736
Echinococcus multilocularis	DNA dependent protein kinase catalytic subunit	0.0064	0.0546	0.0545
Leishmania major	phosphatidylinositol 3-kinase, putative	0.0064	0.0546	0.0546
Trichomonas vaginalis	conserved hypothetical protein	0.0123	0.1153	0.1135
Schistosoma mansoni	immunophilin	0.0046	0.0368	0.0367
Trypanosoma cruzi	phosphatidylinositol 4-kinase alpha, putative	0.0064	0.0546	0.0546
Trypanosoma cruzi	phosphatidylinositol kinase related protein, putative	0.0187	0.1805	0.1805
Trypanosoma cruzi	phosphatidylinositol kinase, putative	0.0064	0.0546	0.0546
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0787	0.7932	0.7928
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0187	0.1805	0.1789
Trypanosoma cruzi	phosphatidylinositol 4-kinase, putative	0.0064	0.0546	0.0546
Schistosoma mansoni	hypothetical protein	0.0016	0.0059	0.0058
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0787	0.7932	0.7928
Trichomonas vaginalis	phosphatidylinositol 3-kinase class, putative	0.0064	0.0546	0.0527
Brugia malayi	Calcitonin receptor-like protein seb-1	0.0051	0.0416	0.0415
Entamoeba histolytica	protein kinase, putative	0.0032	0.0224	0.0125
Schistosoma mansoni	hypothetical protein	0.0035	0.0251	0.025
Brugia malayi	phosphatidylinositol 4-kinase, catalytic, alpha polypeptide	0.0064	0.0546	0.0545
Trypanosoma brucei	phosphatidylinositol 4-kinase alpha, putative	0.0064	0.0546	0.0546
Onchocerca volvulus		0.0064	0.0546	1
Echinococcus multilocularis	FKBP12 rapamycin complex associated protein	0.0989	1	1
Entamoeba histolytica	hypothetical protein	0.0064	0.0546	0.0451
Echinococcus granulosus	phosphatidylinositol 45 bisphosphate 3 kinase	0.0064	0.0546	0.0545
Trypanosoma cruzi	phosphatidylinositol 3-related kinase, putative	0.0332	0.3283	0.3283
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0591	0.5932	0.5924
Echinococcus granulosus	peptidyl prolyl cis trans isomerase FKBP4	0.0046	0.0368	0.0367
Toxoplasma gondii	phosphatidylinositol 3- and 4-kinase	0.0064	0.0546	0.0736
Loa Loa (eye worm)	AGC/AKT protein kinase	0.0032	0.0224	0.0223
Leishmania major	target of rapamycin (TOR) kinase 2, putative	0.0989	1	1
Trichomonas vaginalis	fk506-binding protein, putative	0.0054	0.0443	0.0424
Brugia malayi	MH2 domain containing protein	0.0122	0.1144	0.1143
Trichomonas vaginalis	AGC family protein kinase	0.0032	0.0224	0.0204
Loa Loa (eye worm)	hypothetical protein	0.0035	0.0251	0.025
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0332	0.3283	0.3269
Leishmania major	phosphatidylinositol 3-related kinase, putative	0.0332	0.3283	0.3283
Mycobacterium leprae	conserved hypothetical protein	0.0064	0.0546	0.5
Echinococcus multilocularis	fk506 binding protein	0.0054	0.0443	0.0442
Trypanosoma cruzi	FK506-binding protein (FKBP)-type peptidyl-prolyl isomerase, putative	0.0054	0.0443	0.0443
Trichomonas vaginalis	phosphatidylinositol 3-kinase catalytic subunit alpha, beta, delta, putative	0.0064	0.0546	0.0527
Echinococcus granulosus	phosphatidylinositol 3 and 4 kinase	0.0332	0.3283	0.3282
Trypanosoma brucei	target of rapamycin kinase 3, putative	0.0787	0.794	0.794
Trichomonas vaginalis	phosphatidylinositol kinase, putative	0.0064	0.0546	0.0527
Schistosoma mansoni	phosphatidylinositol 3-and 4-kinase	0.0332	0.3283	0.3282
Echinococcus multilocularis	Glutaredoxin protein 5	0.002	0.0097	0.0096
Echinococcus granulosus	potassium voltage gated channel subfamily H	0.0036	0.0264	0.0263
Entamoeba histolytica	protein kinase, putative	0.0032	0.0224	0.0125
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0642	0.6454	0.6447
Leishmania major	peptidylprolyl isomerase-like protein	0.0054	0.0443	0.0443
Trichomonas vaginalis	phosphatidylinositol 3-kinase catalytic subunit gamma, putative	0.0064	0.0546	0.0527
Loa Loa (eye worm)	phosphatidylinositol 3	0.0064	0.0546	0.0545
Trypanosoma brucei	phosphatidylinositol 3-kinase, putative	0.0064	0.0546	0.0546
Loa Loa (eye worm)	phosphatidylinositol 4-kinase type 3 alpha isoform 1	0.0064	0.0546	0.0545
Plasmodium vivax	phosphatidylinositol 3-kinase, putative	0.0064	0.0546	1
Trypanosoma brucei	Phosphatidylinositol 3-kinase tor1	0.0989	1	1
Loa Loa (eye worm)	FKBP5 protein	0.0054	0.0443	0.0442
Loa Loa (eye worm)	voltage and ligand gated potassium channel	0.0036	0.0264	0.0263
Schistosoma mansoni	ataxia telangiectasia mutated (atm)-related	0.0989	1	1
Giardia lamblia	Phosphatidylinositol 4-kinase	0.0064	0.0546	0.0451
Trypanosoma cruzi	phosphatidylinositol 3-related kinase, putative	0.0332	0.3283	0.3283
Giardia lamblia	FKBP-type peptidyl-prolyl cis-trans isomerase	0.0054	0.0443	0.0347
Trichomonas vaginalis	peptidylprolyl isomerase, putative	0.0054	0.0443	0.0424
Entamoeba histolytica	hypothetical protein	0.0064	0.0546	0.0451
Trypanosoma cruzi	peptidyl-prolyl cis-trans isomerase, putative	0.0054	0.0443	0.0443
Trichomonas vaginalis	phosphatidylinositol kinase, putative	0.0064	0.0546	0.0527
Trypanosoma brucei	phosphatidylinositol 3-kinase tor, putative	0.0468	0.4673	0.4673
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0787	0.7932	0.7928
Echinococcus multilocularis	potassium voltage gated channel subfamily H	0.0036	0.0264	0.0263
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0534	0.5351	0.5341
Mycobacterium tuberculosis	Conserved hypothetical protein	0.0064	0.0546	0.5
Loa Loa (eye worm)	phosphatidylinositol 3	0.0332	0.3283	0.3282
Schistosoma mansoni	voltage-gated potassium channel	0.004	0.0298	0.0297
Toxoplasma gondii	phosphatidylinositol 3- and 4-kinase	0.0064	0.0546	0.0736
Trichomonas vaginalis	conserved hypothetical protein	0.0034	0.0244	0.0224
Entamoeba histolytica	protein kinase rad3, putative	0.0187	0.1805	0.1723
Loa Loa (eye worm)	hypothetical protein	0.0016	0.0059	0.0058
Echinococcus multilocularis	Phosphatidylinositol 4 kinase type 2 beta	0.0064	0.0546	0.0545
Trypanosoma cruzi	Phosphatidylinositol 3-kinase tor1	0.0989	1	1
Trichomonas vaginalis	phosphatidylinositol 3-kinase class, putative	0.0064	0.0546	0.0527
Echinococcus multilocularis	phosphatidylinositol 4 kinase alpha	0.0064	0.0546	0.0545
Trypanosoma cruzi	phosphatidylinositol 3-kinase, putative	0.0064	0.0546	0.0546
Entamoeba histolytica	Phosphatidylinositol 3- and 4-kinase family	0.0187	0.1805	0.1723
Echinococcus multilocularis	Phosphatidylinositol 4 kinase type 2 beta	0.0064	0.0546	0.0545

Activities

Activity type	Activity value	Assay description	Source	Reference
GI50 (functional)	-4.78	PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the DU-145 Prostate cell line. (Class of assay: confirmatory)	ChEMBL.	No reference
GI50 (functional)	-4.683	PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the MDA-N Breast cell line. (Class of assay: confirmatory)	ChEMBL.	No reference
GI50 (functional)	-4.555	PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the HL-60(TB) Leukemia cell line. (Class of assay: confirmatory)	ChEMBL.	No reference
GI50 (functional)	-4.213	PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the UO-31 Renal cell line. (Class of assay: confirmatory)	ChEMBL.	No reference
GI50 (functional)	-4	PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the SN12C Renal cell line. (Class of assay: confirmatory)	ChEMBL.	No reference
GI50 (functional)	-4	PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the NCI-H23 Non-Small Cell Lung cell line. (Class of assay: confirmatory)	ChEMBL.	No reference
GI50 (functional)	-4	PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the HOP-92 Non-Small Cell Lung cell line. (Class of assay: confirmatory)	ChEMBL.	No reference
GI50 (functional)	-4	PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the SF-539 Central Nervous System cell line. (Class of assay: confirmatory)	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: CHEMBL2000900

Bibliographic References

No literature references available for this target.

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Detailed information for compound 1644993