TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 1057.2 | Formula: C51H72N14O11
H donors: 13 H acceptors: 12 LogP: -2.35 Rotable bonds: 35
Rule of 5 violations (Lipinski): 4
SMILES: NC(=NCCCC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)N1CCCC1C(=O)NC(C(=O)O)Cc1ccccc1)Cc1nc[nH]c1)C1CCCC1)Cc1ccc(cc1)O)C(C)C)NC(=O)C(CC(=O)N)N)N
InChi: 1S/C51H72N14O11/c1-28(2)41(63-44(69)35(14-8-20-57-51(54)55)59-43(68)34(52)25-40(53)67)47(72)60-36(22-30-16-18-33(66)19-17-30)45(70)64-42(31-12-6-7-13-31)48(73)61-37(24-32-26-56-27-58-32)49(74)65-21-9-15-39(65)46(71)62-38(50(75)76)23-29-10-4-3-5-11-29/h3-5,10-11,16-19,26-28,31,34-39,41-42,66H,6-9,12-15,20-25,52H2,1-2H3,(H2,53,67)(H,56,58)(H,59,68)(H,60,72)(H,61,73)(H,62,71)(H,63,69)(H,64,70)(H,75,76)(H4,54,55,57)
InChiKey: GKURABCWZIRTSE-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

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
Brugia malayi	FKBP-type peptidyl-prolyl cis-trans isomerase-12, BmFKBP-12	0.0169	0.0119	0.0116
Loa Loa (eye worm)	phosphatidylinositol 3	0.0579	0.0588	0.0585
Echinococcus granulosus	peptidyl prolyl cis trans isomerase FKBP1A	0.0169	0.0119	0.0119
Echinococcus multilocularis	Phosphatidylinositol 4 kinase type 2 beta	0.0579	0.0588	0.0588
Entamoeba histolytica	protein kinase, putative	0.0103	0.0044	0.0044
Trichomonas vaginalis	phosphatidylinositol 3-kinase catalytic subunit alpha, beta, delta, putative	0.0705	0.0731	0.069
Trypanosoma cruzi	peptidyl-prolyl cis-trans isomerase, putative	0.0169	0.0119	0.0119
Trichomonas vaginalis	conserved hypothetical protein	0.13	0.141	0.1372
Trichomonas vaginalis	PIKK family atypical protein kinase	0.1698	0.1864	0.1828
Trichomonas vaginalis	PIKK family atypical protein kinase	0.4779	0.5379	0.5358
Plasmodium falciparum	phosphatidylinositol 4-kinase	0.0579	0.0588	0.964
Trichomonas vaginalis	PIKK family atypical protein kinase	0.7031	0.7948	0.7939
Brugia malayi	Phosphatidylinositol 3- and 4-kinase family protein	0.0579	0.0588	0.0585
Trichomonas vaginalis	PIKK family atypical protein kinase	0.4786	0.5387	0.5367
Loa Loa (eye worm)	hypothetical protein	0.02	0.0155	0.0152
Brugia malayi	Phosphatidylinositol 3- and 4-kinase family protein	0.0579	0.0588	0.0585
Loa Loa (eye worm)	phosphatidylinositol 3	0.2999	0.3348	0.3346
Entamoeba histolytica	protein kinase rad3, putative	0.1688	0.1852	0.1852
Trichomonas vaginalis	PIKK family atypical protein kinase	0.6577	0.7431	0.7419
Entamoeba histolytica	hypothetical protein	0.1688	0.1852	0.1852
Trypanosoma cruzi	phosphatidylinositol 4-kinase alpha, putative	0.0599	0.061	0.061
Echinococcus multilocularis	DNA dependent protein kinase catalytic subunit	0.083	0.0873	0.0873
Echinococcus multilocularis	serine protein kinase ATM	0.1688	0.1852	0.1852
Giardia lamblia	70 kDa peptidylprolyl isomerase, putative	0.0169	0.0119	0.0119
Giardia lamblia	Phosphoinositide-3-kinase, catalytic, alpha polypeptide	0.0666	0.0686	0.0686
Mycobacterium ulcerans	FK-506 binding protein, peptidyl-prolyl cis-trans isomerase	0.0169	0.0119	0.5
Echinococcus granulosus	phosphatidylinositol 4 phosphate 3 kinase C2	0.0698	0.0722	0.0722
Echinococcus multilocularis	PIK kinase, FAT and Armadillo domain containing protein	0.13	0.141	0.141
Trichomonas vaginalis	voltage and ligand gated potassium channel, putative	0.0216	0.0173	0.0129
Giardia lamblia	Hypothetical protein	0.0579	0.0588	0.0588
Trichomonas vaginalis	PIKK family atypical protein kinase	0.6577	0.7431	0.7419
Trichomonas vaginalis	PIKK family atypical protein kinase	0.5922	0.6684	0.6669
Echinococcus granulosus	phosphatidylinositol 4 kinase beta	0.0579	0.0588	0.0588
Echinococcus multilocularis	peptidyl prolyl cis trans isomerase FKBP4	0.0169	0.0119	0.0119
Trypanosoma brucei	phosphatidylinositol 4-kinase, putative	0.8829	1	1
Loa Loa (eye worm)	hypothetical protein	0.13	0.141	0.1408
Plasmodium vivax	hypothetical protein	0.0579	0.0588	0.964
Loa Loa (eye worm)	hypothetical protein	0.188	0.2071	0.2069
Entamoeba histolytica	Phosphatidylinositol 3- and 4-kinase family	0.1698	0.1864	0.1864
Schistosoma mansoni	phosphatidylinositol 3-kinase class	0.0579	0.0588	0.0585
Loa Loa (eye worm)	phosphatidylinositol kinase	0.0579	0.0588	0.0585
Trichomonas vaginalis	phosphatidylinositol kinase, putative	0.0765	0.0799	0.0758
Trypanosoma cruzi	peptidyl-prolyl cis-trans isomerase, putative	0.0169	0.0119	0.0119
Toxoplasma gondii	non-specific serine/threonine protein kinase	0.188	0.2071	0.2751
Entamoeba histolytica	phosphatidylinositol3-kinaseTor2, putative	0.8829	1	1
Schistosoma mansoni	immunophilin	0.0146	0.0093	0.009
Brugia malayi	Phosphatidylinositol 3- and 4-kinase family protein	0.0765	0.0799	0.0797
Entamoeba histolytica	hypothetical protein	0.0579	0.0588	0.0588
Loa Loa (eye worm)	AGC/RSK/P70 protein kinase	0.0097	0.0037	0.0034
Schistosoma mansoni	immunophilin FK506 binding protein FKBP12	0.0169	0.0119	0.0116
Trypanosoma brucei	phosphatidylinositol 3-kinase catalytic subunit, putative	0.0579	0.0588	0.0546
Entamoeba histolytica	phosphatidylinositol 3-kinase, putative	0.0765	0.0799	0.0799
Plasmodium vivax	phosphatidylinositol 4-kinase, putative	0.0579	0.0588	0.964
Loa Loa (eye worm)	phosphatidylinositol 4-kinase type 3 alpha isoform 1	0.0599	0.061	0.0607
Trichomonas vaginalis	phosphatidylinositol kinase, putative	0.0599	0.061	0.0568
Loa Loa (eye worm)	hypothetical protein	0.0579	0.0588	0.0585
Toxoplasma gondii	target of rapamycin (TOR), putative	0.6577	0.7431	1
Schistosoma mansoni	serine/threonine-protein kinase	0.0071	0.0007	0.0005
Trypanosoma brucei	phosphatidylinositol 4-kinase, putative	0.0579	0.0588	0.0546
Trichomonas vaginalis	PIKK family atypical protein kinase	0.6577	0.7431	0.7419
Trichomonas vaginalis	PIKK family atypical protein kinase	0.6577	0.7431	0.7419
Trypanosoma cruzi	phosphatidylinositol kinase related protein, putative	0.0579	0.0588	0.0588
Leishmania major	hypothetical protein, conserved	0.0668	0.0689	0.0576
Trypanosoma cruzi	phosphatidylinositol 3-related kinase, putative	0.3037	0.3392	0.3392
Trichomonas vaginalis	fk506-binding protein, putative	0.0169	0.0119	0.0075
Brugia malayi	p70 ribosomal S6 kinase beta	0.0097	0.0037	0.0034
Schistosoma mansoni	phosphatidylinositol 4-kinase	0.0599	0.061	0.0607
Echinococcus granulosus	phosphatidylinositol 3 and 4 kinase	0.3037	0.3392	0.3392
Trichomonas vaginalis	PIKK family atypical protein kinase	0.7031	0.7948	0.7939
Onchocerca volvulus		0.0579	0.0588	0.5
Trichomonas vaginalis	PIKK family atypical protein kinase	0.2988	0.3336	0.3306
Trypanosoma cruzi	phosphatidylinositol 3-related kinase, putative	0.3037	0.3392	0.3392
Trichomonas vaginalis	PIKK family atypical protein kinase	0.5277	0.5947	0.5929
Echinococcus granulosus	potassium voltage gated channel subfamily H	0.0231	0.019	0.019
Brugia malayi	Phosphatidylinositol 3- and 4-kinase family protein	0.0638	0.0654	0.0652
Leishmania major	target of rapamycin (TOR) kinase 1, putative	0.8829	1	1
Trichomonas vaginalis	phosphatidylinositol kinase, putative	0.0638	0.0654	0.0612
Brugia malayi	Phosphatidylinositol 3- and 4-kinase family protein	0.0698	0.0722	0.072
Leishmania major	phosphatidylinositol kinase, putative	0.0579	0.0588	0.0474
Trypanosoma cruzi	Phosphatidylinositol 3-kinase tor1	0.8829	1	1
Treponema pallidum	peptidyl-prolyl cis-trans isomerase, FKBP-type, 22 kDa (fklB)	0.0169	0.0119	0.5
Schistosoma mansoni	serine/threonine-protein kinase	0.0071	0.0007	0.0005
Entamoeba histolytica	PH domain containing protein kinase, putative	0.0071	0.0007	0.0007
Schistosoma mansoni	phosphatidylinositol-45-bisphosphate 3-kinase catalytic subunit alpha PI3K	0.0599	0.061	0.0607
Trypanosoma brucei	target of rapamycin kinase 3, putative	0.7038	0.7957	0.7948
Brugia malayi	Phosphatidylinositol 3- and 4-kinase family protein	0.0579	0.0588	0.0585
Brugia malayi	Voltage-gated potassium channel, HERG (KCNH2)-related. C. elegans unc-103 ortholog	0.0231	0.019	0.0187
Leishmania major	hypothetical protein, unknown function	0.0579	0.0588	0.0474
Trypanosoma cruzi	rac serine-threonine kinase, putative	0.0071	0.0007	0.0007
Entamoeba histolytica	phosphatidylinositol 3-kinase, putative	0.0726	0.0755	0.0755
Trypanosoma brucei	FK506-binding protein (FKBP)-type peptidyl-prolyl isomerase, putative	0.0169	0.0119	0.0075
Trichomonas vaginalis	phosphatidylinositol 3-kinase class, putative	0.0599	0.061	0.0568
Echinococcus granulosus	Phosphatidylinositol 4 kinase type 2 beta	0.0579	0.0588	0.0588
Trichomonas vaginalis	PIKK family atypical protein kinase	0.1688	0.1852	0.1816
Trypanosoma cruzi	phosphatidylinositol 4-kinase, putative	0.0579	0.0588	0.0588
Trichomonas vaginalis	PIKK family atypical protein kinase	0.7031	0.7948	0.7939
Trichomonas vaginalis	PIKK family atypical protein kinase	0.1688	0.1852	0.1816
Schistosoma mansoni	phosphatidylinositol 4-kinase type-II	0.0579	0.0588	0.0585
Schistosoma mansoni	fkbp-rapamycin associated protein	0.1688	0.1852	0.185
Trypanosoma brucei	phosphatidylinositol 3-related kinase, putative	0.2999	0.3348	0.3318
Trypanosoma cruzi	Protein kinase B	0.0071	0.0007	0.0007
Trichomonas vaginalis	PIKK family atypical protein kinase	0.4786	0.5387	0.5367
Trypanosoma brucei	phosphatidylinositol 3-kinase, putative	0.0638	0.0654	0.0612
Brugia malayi	Phosphatidylinositol 3- and 4-kinase family protein	0.1688	0.1852	0.185
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0579	0.0588	0.0546
Plasmodium falciparum	phosphatidylinositol 3- and 4-kinase, putative	0.0579	0.0588	0.964
Trypanosoma brucei	Phosphatidylinositol 3-kinase tor1	0.8829	1	1
Schistosoma mansoni	phosphatidylinositol-45-bisphosphate 3-kinase catalytic subunit alpha PI3K	0.0638	0.0654	0.0652
Loa Loa (eye worm)	phosphatidylinositol 3	0.0579	0.0588	0.0585
Trypanosoma cruzi	phosphatidylinositol 4-kinase alpha, putative	0.0599	0.061	0.061
Trichomonas vaginalis	PIKK family atypical protein kinase	0.7031	0.7948	0.7939
Echinococcus multilocularis	Zinc finger, PHD finger	0.0599	0.061	0.061
Trypanosoma brucei	phosphatidylinositol 3-kinase tor, putative	0.4168	0.4682	0.4659
Loa Loa (eye worm)	hypothetical protein	0.0698	0.0722	0.072
Entamoeba histolytica	protein kinase, putative	0.0103	0.0044	0.0044
Giardia lamblia	FKBP-type peptidyl-prolyl cis-trans isomerase	0.0169	0.0119	0.0119
Loa Loa (eye worm)	hypothetical protein	0.0067	0.0003	0.0001
Loa Loa (eye worm)	AGC/AKT protein kinase	0.0103	0.0044	0.0042
Echinococcus multilocularis	FKBP12 rapamycin complex associated protein	0.8829	1	1
Trichomonas vaginalis	immunophilin, putative	0.0169	0.0119	0.0075
Leishmania major	phosphatidylinositol 3-related kinase, putative	0.2999	0.3348	0.3267
Trypanosoma cruzi	phosphatidylinositol 3-kinase vps34-like	0.0638	0.0654	0.0654
Echinococcus multilocularis	voltage gated potassium channel	0.0067	0.0003	0.0003
Leishmania major	target of rapamycin (TOR) kinase 2, putative	0.8829	1	1
Trichomonas vaginalis	PIKK family atypical protein kinase	0.573	0.6465	0.6449
Mycobacterium leprae	conserved hypothetical protein	0.0579	0.0588	0.5
Loa Loa (eye worm)	FKBP5 protein	0.0169	0.0119	0.0116
Toxoplasma gondii	phosphatidylinositol 3- and 4-kinase	0.0599	0.061	0.0774
Echinococcus multilocularis	potassium voltage gated channel subfamily H	0.0231	0.019	0.019
Echinococcus multilocularis	potassium voltage gated channel subfamily H	0.0067	0.0003	0.0003
Trichomonas vaginalis	PIKK family atypical protein kinase	0.2988	0.3336	0.3306
Entamoeba histolytica	hypothetical protein	0.0579	0.0588	0.0588
Trichomonas vaginalis	phosphatidylinositol 4-kinase, putative	0.0599	0.061	0.0568
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0579	0.0588	0.0546
Schistosoma mansoni	immunophilin	0.0169	0.0119	0.0116
Trichomonas vaginalis	conserved hypothetical protein	0.1108	0.1191	0.1152
Echinococcus multilocularis	phosphatidylinositol 4 kinase alpha	0.0599	0.061	0.061
Trichomonas vaginalis	PIKK family atypical protein kinase	0.8829	1	1
Trypanosoma brucei	phosphatidylinositol 3-kinase, putative	0.2988	0.3336	0.3306
Entamoeba histolytica	peptidyl-prolyl cis-trans isomerase, FKBP-type, putative	0.0169	0.0119	0.0119
Entamoeba histolytica	phosphatidylinositol 3-kinase, putative	0.0638	0.0654	0.0654
Echinococcus granulosus	voltage gated potassium channel	0.0067	0.0003	0.0003
Leishmania major	phosphatidylinositol 3-kinase, putative	0.0599	0.061	0.0496
Trypanosoma cruzi	Phosphatidylinositol 3-kinase tor2	0.8829	1	1
Trypanosoma brucei	FAT domain/Rapamycin binding domain/Phosphatidylinositol 3- and 4-kinase, putative	0.3678	0.4123	0.4097
Loa Loa (eye worm)	phosphatidylinositol 3	0.0579	0.0588	0.0585
Entamoeba histolytica	protein kinase, putative	0.0097	0.0037	0.0037
Echinococcus granulosus	phosphatidylinositol 3 kinase catalytic subunit	0.0599	0.061	0.061
Trichomonas vaginalis	PIKK family atypical protein kinase	0.2988	0.3336	0.3306
Echinococcus multilocularis	Phosphatidylinositol 4 kinase type 2 beta	0.0579	0.0588	0.0588
Echinococcus granulosus	FKBP12 rapamycin complex associated protein	0.8829	1	1
Echinococcus granulosus	phosphatidylinositol 45 bisphosphate 3 kinase	0.0934	0.0992	0.0992
Leishmania major	phosphatidylinositol 3-kinase, putative	0.2988	0.3336	0.3255
Schistosoma mansoni	phosphatidylinositol 4-kinase	0.0579	0.0588	0.0585
Plasmodium vivax	phosphatidylinositol 3- and 4-kinase, putative	0.0579	0.0588	0.964
Loa Loa (eye worm)	hypothetical protein	0.1688	0.1852	0.185
Leishmania major	phosphatidylinositol kinase related protein, putative	0.0579	0.0588	0.0474
Trichomonas vaginalis	voltage and ligand gated potassium channel, putative	0.0216	0.0173	0.0129
Plasmodium vivax	phosphatidylinositol 3-kinase, putative	0.0599	0.061	1
Schistosoma mansoni	voltage-gated potassium channel	0.0252	0.0214	0.0211
Trypanosoma cruzi	phosphatidylinositol 3-kinase 2, putative	0.0765	0.0799	0.0799
Entamoeba histolytica	phosphatidylinositol 3-kinase 3, putative	0.0579	0.0588	0.0588
Plasmodium falciparum	peptidyl-prolyl cis-trans isomerase FKBP35	0.0169	0.0119	0.1956
Plasmodium vivax	phosphatidylinositol 4-kinase, putative	0.0579	0.0588	0.964
Leishmania major	target of rapamycin kinase (TOR) kinase 3	0.7038	0.7957	0.7932
Brugia malayi	FKBP-type peptidyl-prolyl cis-trans isomerase-59, BmFKBP59	0.0169	0.0119	0.0116
Brugia malayi	Phosphatidylinositol 3- and 4-kinase family protein	0.1688	0.1852	0.185
Trypanosoma cruzi	hypothetical protein, conserved	0.0089	0.0028	0.0028
Entamoeba histolytica	PH domain containing protein kinase, putative	0.0071	0.0007	0.0007
Trichomonas vaginalis	PIKK family atypical protein kinase	0.6577	0.7431	0.7419
Echinococcus granulosus	Phosphatidylinositol 4 kinase type 2 beta	0.0579	0.0588	0.0588
Echinococcus multilocularis	phosphatidylinositol 4 phosphate 3 kinase C2	0.0698	0.0722	0.0722
Entamoeba histolytica	phosphatidylinositol 3-kinase, putative	0.0638	0.0654	0.0654
Onchocerca volvulus		0.0579	0.0588	0.5
Brugia malayi	Protein kinase domain containing protein	0.0103	0.0044	0.0042
Trypanosoma cruzi	phosphatidylinositol 4-kinase, putative	0.0579	0.0588	0.0588
Loa Loa (eye worm)	phosphatidylinositol 3	0.8829	1	1
Giardia lamblia	GTOR	0.8829	1	1
Entamoeba histolytica	phosphatidylinositol 3-kinase 1, putative	0.0186	0.0138	0.0138
Trichomonas vaginalis	peptidylprolyl isomerase, putative	0.0169	0.0119	0.0075
Loa Loa (eye worm)	FKBP-type peptidyl-prolyl cis-trans isomerase-12	0.0169	0.0119	0.0116
Trypanosoma cruzi	target of rapamycin kinase 3	0.7038	0.7957	0.7957
Trypanosoma brucei	phosphatidylinositol kinase related protein, putative	0.1688	0.1852	0.1816
Toxoplasma gondii	phosphatidylinositol 3- and 4-kinase	0.0579	0.0588	0.0744
Trypanosoma cruzi	phosphatidylinositol kinase related protein, putative	0.1108	0.1191	0.1191
Echinococcus multilocularis	phosphatidylinositol 3 and 4 kinase	0.3037	0.3392	0.3392
Brugia malayi	phosphatidylinositol 4-kinase, catalytic, alpha polypeptide	0.0599	0.061	0.0607
Toxoplasma gondii	FATC domain-containing protein	0.1688	0.1852	0.2455
Trichomonas vaginalis	PIKK family atypical protein kinase	0.8829	1	1
Trichomonas vaginalis	phosphatidylinositol kinase, putative	0.0579	0.0588	0.0546
Entamoeba histolytica	phosphatidylinositol 4-kinase, putative	0.0599	0.061	0.061
Trichomonas vaginalis	PIKK family atypical protein kinase	0.4779	0.5379	0.5358
Trichomonas vaginalis	PIKK family atypical protein kinase	0.5277	0.5947	0.5929
Mycobacterium tuberculosis	Conserved hypothetical protein	0.0579	0.0588	0.5
Trypanosoma cruzi	phosphatidylinositol 3-kinase, putative	0.0579	0.0588	0.0588
Brugia malayi	FAT domain containing protein	0.13	0.141	0.1408
Schistosoma mansoni	ataxia telangiectasia mutated (atm)	0.1688	0.1852	0.185
Trichomonas vaginalis	peptidylprolyl isomerase, putative	0.0169	0.0119	0.0075
Trichomonas vaginalis	PIKK family atypical protein kinase	0.8829	1	1
Trypanosoma cruzi	phosphatidylinositol 3-kinase, putative	0.1688	0.1852	0.1852
Schistosoma mansoni	phosphatidylinositol 3-and 4-kinase	0.3037	0.3392	0.339
Schistosoma mansoni	hypothetical protein	0.0579	0.0588	0.0585
Trichomonas vaginalis	PIKK family atypical protein kinase	0.2988	0.3336	0.3306
Brugia malayi	Phosphatidylinositol 3- and 4-kinase family protein	0.3037	0.3392	0.339
Echinococcus multilocularis	fk506 binding protein	0.0169	0.0119	0.0119
Trypanosoma cruzi	phosphatidylinositol kinase related protein, putative	0.1688	0.1852	0.1852
Loa Loa (eye worm)	hypothetical protein	0.0146	0.0093	0.009
Echinococcus multilocularis		0.0579	0.0588	0.0588
Entamoeba histolytica	phosphatidylinositol 3-kinase, putative	0.0659	0.0678	0.0678
Loa Loa (eye worm)	voltage and ligand gated potassium channel	0.0231	0.019	0.0187
Echinococcus granulosus	potassium voltage gated channel subfamily H	0.0067	0.0003	0.0003
Schistosoma mansoni	immunophilin	0.0169	0.0119	0.0116
Brugia malayi	phosphoinositide 3'-hydroxykinase p110-alpha subunit, putative	0.0168	0.0119	0.0116
Trichomonas vaginalis	conserved hypothetical protein	0.188	0.2071	0.2036
Echinococcus granulosus	serine/threonine protein kinase	0.0071	0.0007	0.0007
Trichomonas vaginalis	PIKK family atypical protein kinase	0.1108	0.1191	0.1152
Leishmania major	phosphatidylinositol 4-kinase alpha, putative	0.0599	0.061	0.0496
Trichomonas vaginalis	PIKK family atypical protein kinase	0.5277	0.5947	0.5929
Echinococcus granulosus	PIK kinase FAT and Armadillo domain containing protein	0.13	0.141	0.141
Trypanosoma cruzi	phosphatidylinositol 3-kinase 2, putative	0.0765	0.0799	0.0799
Plasmodium vivax	hypothetical protein, conserved	0.0579	0.0588	0.964
Trichomonas vaginalis	PIKK family atypical protein kinase	0.524	0.5905	0.5887
Trypanosoma brucei	peptidyl-prolyl cis-trans isomerase, putative	0.0169	0.0119	0.0075
Trichomonas vaginalis	phosphatidylinositol 3-kinase class, putative	0.0638	0.0654	0.0612
Trypanosoma cruzi	FK506-binding protein (FKBP)-type peptidyl-prolyl isomerase, putative	0.0169	0.0119	0.0119
Entamoeba histolytica	hypothetical protein	0.0726	0.0755	0.0755
Echinococcus multilocularis	phosphatidylinositol 4,5 bisphosphate 3 kinase	0.0934	0.0992	0.0992
Leishmania major	phosphatidylinositol 4-kinase, putative	0.0579	0.0588	0.0474
Trichomonas vaginalis	PIKK family atypical protein kinase	0.4779	0.5379	0.5358
Echinococcus granulosus	DNA dependent protein kinase catalytic subunit	0.083	0.0873	0.0873
Trichomonas vaginalis	PIKK family atypical protein kinase	0.4786	0.5387	0.5367
Echinococcus granulosus	serine protein kinase ATM	0.1688	0.1852	0.1852
Schistosoma mansoni	ataxia telangiectasia mutated (atm)-related	0.8829	1	1
Trichomonas vaginalis	PIKK family atypical protein kinase	0.6577	0.7431	0.7419
Entamoeba histolytica	hypothetical protein	0.0579	0.0588	0.0588
Plasmodium vivax	70 kDa peptidylprolyl isomerase, putative	0.0169	0.0119	0.1956
Toxoplasma gondii	phosphatidylinositol 3- and 4-kinase	0.0579	0.0588	0.0744
Giardia lamblia	Phosphatidylinositol 4-kinase	0.0579	0.0588	0.0588
Echinococcus granulosus	peptidyl prolyl cis trans isomerase FKBP4	0.0169	0.0119	0.0119
Echinococcus multilocularis	rac serine:threonine kinase	0.0071	0.0007	0.0007
Echinococcus multilocularis	peptidyl prolyl cis trans isomerase FKBP4	0.0146	0.0093	0.0093
Trichomonas vaginalis	phopsphatidylinositol 3-kinase, drosophila, putative	0.0765	0.0799	0.0758
Trichomonas vaginalis	phosphatidylinositol 3-kinase catalytic subunit alpha, beta, delta, putative	0.0638	0.0654	0.0612
Trypanosoma cruzi	phosphatidylinositol kinase, putative	0.0579	0.0588	0.0588
Toxoplasma gondii	phosphatidylinositol 3- and 4-kinase	0.0599	0.061	0.0774
Schistosoma mansoni	hypothetical protein	0.13	0.141	0.1408
Trichomonas vaginalis	PIKK family atypical protein kinase	0.7031	0.7948	0.7939
Echinococcus granulosus	serine:threonine protein kinase SMG1	0.1688	0.1852	0.1852
Trichomonas vaginalis	PIKK family atypical protein kinase	0.4786	0.5387	0.5367
Schistosoma mansoni	phosphatidylinositol-45-bisphosphate 3-kinase catalytic subunit alpha PI3K	0.0934	0.0992	0.0989
Trichomonas vaginalis	PIKK family atypical protein kinase	0.6577	0.7431	0.7419
Trichomonas vaginalis	phopsphatidylinositol 3-kinase, drosophila, putative	0.0579	0.0588	0.0546
Loa Loa (eye worm)	phosphatidylinositol 3	0.0579	0.0588	0.0585
Trichomonas vaginalis	phosphatidylinositol 3-kinase catalytic subunit gamma, putative	0.0765	0.0799	0.0758
Plasmodium falciparum	phosphatidylinositol 3-kinase	0.0599	0.061	1
Trichomonas vaginalis	PIKK family atypical protein kinase	0.2999	0.3348	0.3318
Entamoeba histolytica	FKBP-rapamycin associated protein (FRAP), putative	0.8829	1	1
Trypanosoma brucei	phosphatidylinositol 4-kinase alpha, putative	0.0599	0.061	0.0568
Entamoeba histolytica	phosphatidylinositol-4,5-bisphosphate 3-kinase, putative	0.0599	0.061	0.061
Echinococcus granulosus	phosphatidylinositol 4 kinase alpha	0.0599	0.061	0.061
Entamoeba histolytica	peptidyl-prolyl cis-trans isomerase, FKBP-type , putative	0.0169	0.0119	0.0119
Toxoplasma gondii	phosphatidylinositol 3- and 4-kinase	0.0579	0.0588	0.0744
Trichomonas vaginalis	PIKK family atypical protein kinase	0.7528	0.8516	0.851
Giardia lamblia	Phosphoinositide-3-kinase, class 3	0.0619	0.0632	0.0632
Echinococcus multilocularis	serine:threonine protein kinase SMG1	0.1688	0.1852	0.1852
Loa Loa (eye worm)	hypothetical protein	0.1108	0.1191	0.1188
Loa Loa (eye worm)	hypothetical protein	0.1791	0.197	0.1968
Loa Loa (eye worm)	phosphatidylinositol 3	0.0894	0.0947	0.0944
Echinococcus granulosus	peptidyl prolyl cis trans isomerase FKBP4	0.0146	0.0093	0.0093
Trichomonas vaginalis	phosphatidylinositol 3-kinase class, putative	0.0705	0.0731	0.069
Schistosoma mansoni	voltage-gated potassium channel	0.0252	0.0214	0.0211
Trichomonas vaginalis	PIKK family atypical protein kinase	0.524	0.5905	0.5887
Trichomonas vaginalis	PIKK family atypical protein kinase	0.237	0.2631	0.2598
Trypanosoma cruzi	FK506-binding protein (FKBP)-type peptidyl-prolyl isomerase, putative	0.0169	0.0119	0.0119

Activities

Activity type	Activity value	Assay description	Source	Reference
Activity (functional)	= 89 %	In vivo residual angiotensin II like activity of the compound was determined in an rat blood pressure assay	ChEMBL.	2913307

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: 336972

Bibliographic References

1 literature reference was collected for this gene.

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Detailed information for compound 404095