TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 412.422 | Formula: C18H16N6O4S
H donors: 2 H acceptors: 6 LogP: 2.38 Rotable bonds: 8
Rule of 5 violations (Lipinski): 1
SMILES: O=C(CSc1nnc(n1C)c1ccccc1)N/N=C/c1cc(ccc1O)[N+](=O)[O-]
InChi: 1S/C18H16N6O4S/c1-23-17(12-5-3-2-4-6-12)21-22-18(23)29-11-16(26)20-19-10-13-9-14(24(27)28)7-8-15(13)25/h2-10,25H,11H2,1H3,(H,20,26)/b19-10+
InChiKey: IAWFSMIIRCVDNQ-VXLYETTFSA-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	glucagon-like peptide 1 receptor	Starlite/ChEMBL	No references
Homo sapiens	lysine (K)-specific demethylase 4E	Starlite/ChEMBL	No references
Homo sapiens	ATPase family, AAA domain containing 5	Starlite/ChEMBL	No references

Predicted pathogen targets for this compound

By orthology

Species	Potential target	Known druggable target/s	Ortholog Group
Echinococcus multilocularis	atpase aaa+ type core atpase aaa type core	Get druggable targets OG5_139225	All targets in OG5_139225

By sequence similarity to non orthologous known druggable targets

Species	Potential target	Known druggable target	Length	Alignment span	Identity
Loa Loa (eye worm)	pigment dispersing factor receptor c	glucagon-like peptide 1 receptor	463 aa	388 aa	25.8 %

Ranking Plot

Putative Targets List

Species	Potential target	Raw	Global	Species
Trypanosoma cruzi	phosphatidylinositol 3-kinase 2, putative	0.0417	0.1808	0.1703
Trichomonas vaginalis	conserved hypothetical protein	0.0433	0.189	0.1563
Leishmania major	phosphatidylinositol 4-kinase alpha, putative	0.0167	0.0535	0.0153
Onchocerca volvulus		0.0138	0.0387	0.0439
Entamoeba histolytica	phosphatidylinositol 3-kinase, putative	0.0226	0.0834	0.0801
Trichomonas vaginalis	phosphatidylinositol 3-kinase class, putative	0.0167	0.0535	0.0153
Loa Loa (eye worm)	phosphatidylinositol 3	0.2023	1	1
Schistosoma mansoni	hypothetical protein	0.0168	0.054	0.054
Trichomonas vaginalis	PIKK family atypical protein kinase	0.1096	0.5273	0.5082
Trypanosoma cruzi	phosphatidylinositol kinase related protein, putative	0.0389	0.1668	0.156
Trichomonas vaginalis	PIKK family atypical protein kinase	0.1507	0.7367	0.7261
Schistosoma mansoni	phosphatidylinositol 3-kinase class	0.0138	0.0387	0.0387
Trichomonas vaginalis	phopsphatidylinositol 3-kinase, drosophila, putative	0.0417	0.1808	0.1478
Echinococcus granulosus	phosphatidylinositol 3 and 4 kinase	0.0684	0.317	0.3146
Brugia malayi	Corticotropin releasing factor receptor 2 precursor, putative	0.011	0.0241	0.0241
Trichomonas vaginalis	PIKK family atypical protein kinase	0.1096	0.5273	0.5082
Brugia malayi	Phosphatidylinositol 3- and 4-kinase family protein	0.0389	0.1668	0.1668
Trypanosoma cruzi	phosphatidylinositol 4-kinase alpha, putative	0.0167	0.0535	0.0413
Trichomonas vaginalis	phosphatidylinositol 3-kinase catalytic subunit alpha, beta, delta, putative	0.0226	0.0834	0.0464
Trichomonas vaginalis	PIKK family atypical protein kinase	0.1611	0.7897	0.7813
Brugia malayi	Pre-SET motif family protein	0.0195	0.0677	0.0677
Trypanosoma brucei	phosphatidylinositol 3-kinase, putative	0.0684	0.317	0.2895
Trichomonas vaginalis	PIKK family atypical protein kinase	0.2023	1	1
Schistosoma mansoni	aryl hydrocarbon receptor	0.0181	0.0607	0.0607
Trichomonas vaginalis	phosphatidylinositol kinase, putative	0.0167	0.0535	0.0153
Brugia malayi	phosphatidylinositol 4-kinase, catalytic, alpha polypeptide	0.0167	0.0535	0.0535
Trypanosoma cruzi	phosphatidylinositol 4-kinase, putative	0.0138	0.0387	0.0263
Trichomonas vaginalis	PIKK family atypical protein kinase	0.1728	0.8497	0.8437
Toxoplasma gondii	phosphatidylinositol 3- and 4-kinase	0.0167	0.0535	0.0211
Trichomonas vaginalis	PIKK family atypical protein kinase	0.1611	0.7897	0.7813
Echinococcus multilocularis	atpase aaa+ type core atpase aaa type core	0.0979	0.4677	0.4658
Echinococcus granulosus	geminin	0.0168	0.054	0.0506
Entamoeba histolytica	phosphatidylinositol 3-kinase, putative	0.0257	0.0993	0.0961
Onchocerca volvulus		0.0138	0.0387	0.0439
Schistosoma mansoni	hypothetical protein	0.0295	0.1183	0.1183
Trypanosoma cruzi	phosphatidylinositol 3-kinase vps34-like	0.0226	0.0834	0.0715
Loa Loa (eye worm)	phosphatidylinositol 3	0.0684	0.317	0.3141
Toxoplasma gondii	non-specific serine/threonine protein kinase	0.0433	0.189	0.2153
Entamoeba histolytica	FKBP-rapamycin associated protein (FRAP), putative	0.2023	1	1
Trichomonas vaginalis	set domain proteins, putative	0.0222	0.0814	0.0444
Trypanosoma cruzi	Phosphatidylinositol 3-kinase tor2	0.2023	1	1
Echinococcus granulosus	aryl hydrocarbon receptor	0.0135	0.037	0.0336
Trichomonas vaginalis	PIKK family atypical protein kinase	0.12	0.5803	0.5634
Echinococcus granulosus	phosphatidylinositol 3 kinase catalytic subunit	0.0167	0.0535	0.0501
Schistosoma mansoni	phosphatidylinositol 3-and 4-kinase	0.0684	0.317	0.317
Echinococcus multilocularis	lysine specific demethylase 5A	0.0071	0.0043	0.0008
Echinococcus granulosus	serine protein kinase ATM	0.0389	0.1668	0.1638
Loa Loa (eye worm)	phosphatidylinositol 3	0.0611	0.2799	0.2768
Trichomonas vaginalis	PIKK family atypical protein kinase	0.1316	0.6395	0.625
Entamoeba histolytica	phosphatidylinositol 3-kinase, putative	0.0358	0.1509	0.1479
Loa Loa (eye worm)	hypothetical protein	0.0075	0.0063	0.002
Loa Loa (eye worm)	phosphatidylinositol 3	0.0138	0.0387	0.0346
Schistosoma mansoni	phosphatidylinositol 4-kinase	0.0167	0.0535	0.0535
Brugia malayi	FAT domain containing protein	0.0295	0.1183	0.1183
Trypanosoma brucei	phosphatidylinositol 3-related kinase, putative	0.0684	0.317	0.2895
Loa Loa (eye worm)	phosphatidylinositol 3	0.0088	0.0127	0.0085
Trichomonas vaginalis	PIKK family atypical protein kinase	0.1611	0.7897	0.7813
Trichomonas vaginalis	phosphatidylinositol kinase, putative	0.0417	0.1808	0.1478
Echinococcus granulosus	phosphatidylinositol 4 kinase alpha	0.0167	0.0535	0.0501
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0684	0.317	0.2895
Schistosoma mansoni	ataxia telangiectasia mutated (atm)-related	0.2023	1	1
Loa Loa (eye worm)	hypothetical protein	0.041	0.1775	0.1739
Loa Loa (eye worm)	hypothetical protein	0.0138	0.0387	0.0346
Brugia malayi	Phosphatidylinositol 3- and 4-kinase family protein	0.0684	0.317	0.317
Loa Loa (eye worm)	hypothetical protein	0.0251	0.0961	0.0922
Trypanosoma cruzi	phosphatidylinositol 4-kinase, putative	0.0138	0.0387	0.0263
Leishmania major	phosphatidylinositol 3-kinase, putative	0.0684	0.317	0.2895
Echinococcus multilocularis	Zinc finger, PHD finger	0.0167	0.0535	0.0501
Leishmania major	phosphatidylinositol 3-related kinase, putative	0.0684	0.317	0.2895
Entamoeba histolytica	protein kinase rad3, putative	0.0389	0.1668	0.1638
Entamoeba histolytica	phosphatidylinositol 4-kinase, putative	0.0167	0.0535	0.0501
Echinococcus granulosus	Transcription factor JmjC domain containing protein	0.0071	0.0043	0.0008
Trichomonas vaginalis	conserved hypothetical protein	0.0251	0.0961	0.0597
Giardia lamblia	Phosphoinositide-3-kinase, catalytic, alpha polypeptide	0.0268	0.105	0.069
Trichomonas vaginalis	PIKK family atypical protein kinase	0.2023	1	1
Loa Loa (eye worm)	pigment dispersing factor receptor c	0.011	0.0241	0.0198
Schistosoma mansoni	phosphatidylinositol-45-bisphosphate 3-kinase catalytic subunit alpha PI3K	0.067	0.3098	0.3098
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0684	0.317	0.2895
Trichomonas vaginalis	PIKK family atypical protein kinase	0.1212	0.5864	0.5698
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0684	0.317	0.2895
Trypanosoma cruzi	phosphatidylinositol 3-related kinase, putative	0.0684	0.317	0.3082
Brugia malayi	latrophilin 2 splice variant baaae	0.0075	0.0063	0.0063
Entamoeba histolytica	phosphatidylinositol 3-kinase, putative	0.0226	0.0834	0.0801
Leishmania major	target of rapamycin (TOR) kinase 2, putative	0.2023	1	1
Trichomonas vaginalis	phosphatidylinositol 3-kinase catalytic subunit gamma, putative	0.0417	0.1808	0.1478
Trichomonas vaginalis	phosphatidylinositol kinase, putative	0.0226	0.0834	0.0464
Echinococcus multilocularis	Phosphatidylinositol 4 kinase type 2 beta	0.0138	0.0387	0.0353
Echinococcus granulosus	phosphatidylinositol 4 kinase beta	0.0138	0.0387	0.0353
Trichomonas vaginalis	PIKK family atypical protein kinase	0.12	0.5803	0.5634
Echinococcus granulosus	lysine specific demethylase 5A	0.0071	0.0043	0.0008
Brugia malayi	Phosphatidylinositol 3- and 4-kinase family protein	0.0226	0.0834	0.0834
Loa Loa (eye worm)	hypothetical protein	0.0295	0.1183	0.1145
Entamoeba histolytica	hypothetical protein	0.0358	0.1509	0.1479
Loa Loa (eye worm)	hypothetical protein	0.0101	0.0197	0.0154
Trichomonas vaginalis	PIKK family atypical protein kinase	0.1094	0.5264	0.5074
Schistosoma mansoni	phosphatidylinositol-45-bisphosphate 3-kinase catalytic subunit alpha PI3K	0.0167	0.0535	0.0535
Schistosoma mansoni	ataxia telangiectasia mutated (atm)	0.0389	0.1668	0.1668
Echinococcus multilocularis	serine protein kinase ATM	0.0389	0.1668	0.1638
Trichomonas vaginalis	PIKK family atypical protein kinase	0.1212	0.5864	0.5698
Trichomonas vaginalis	phosphatidylinositol 4-kinase, putative	0.0167	0.0535	0.0153
Trypanosoma brucei	target of rapamycin kinase 3, putative	0.1612	0.7906	0.7822
Echinococcus granulosus	PIK kinase FAT and Armadillo domain containing protein	0.0295	0.1183	0.1152
Echinococcus multilocularis	DNA dependent protein kinase catalytic subunit	0.0138	0.0387	0.0353
Echinococcus multilocularis		0.0138	0.0387	0.0353
Entamoeba histolytica	Phosphatidylinositol 3- and 4-kinase family	0.0389	0.1668	0.1638
Mycobacterium leprae	conserved hypothetical protein	0.0138	0.0387	0.5
Loa Loa (eye worm)	hypothetical protein	0.0135	0.0368	0.0326
Trichomonas vaginalis	PIKK family atypical protein kinase	0.1611	0.7897	0.7813
Echinococcus multilocularis	phosphatidylinositol 4 phosphate 3 kinase C2	0.0316	0.1292	0.1261
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0389	0.1668	0.1332
Trypanosoma brucei	phosphatidylinositol 3-kinase, putative	0.0226	0.0834	0.0464
Trichomonas vaginalis	phosphatidylinositol 3-kinase catalytic subunit alpha, beta, delta, putative	0.0327	0.135	0.1001
Echinococcus multilocularis	aryl hydrocarbon receptor	0.0135	0.037	0.0336
Trichomonas vaginalis	PIKK family atypical protein kinase	0.1096	0.5273	0.5082
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0389	0.1668	0.1332
Leishmania major	target of rapamycin (TOR) kinase 1, putative	0.2023	1	1
Trichomonas vaginalis	PIKK family atypical protein kinase	0.1507	0.7367	0.7261
Schistosoma mansoni	transcription factor LCR-F1	0.0069	0.0035	0.0035
Loa Loa (eye worm)	hypothetical protein	0.011	0.0241	0.0198
Trichomonas vaginalis	conserved hypothetical protein	0.0295	0.1183	0.0828
Schistosoma mansoni	hypothetical protein	0.0168	0.054	0.054
Toxoplasma gondii	target of rapamycin (TOR), putative	0.1507	0.7367	1
Loa Loa (eye worm)	hypothetical protein	0.0118	0.0285	0.0242
Echinococcus granulosus	DNA dependent protein kinase catalytic subunit	0.0138	0.0387	0.0353
Schistosoma mansoni	phosphatidylinositol 4-kinase	0.0138	0.0387	0.0387
Echinococcus multilocularis	serine:threonine protein kinase SMG1	0.0389	0.1668	0.1638
Leishmania major	target of rapamycin kinase (TOR) kinase 3	0.1612	0.7906	0.7822
Brugia malayi	hypothetical protein	0.0069	0.0035	0.0035
Brugia malayi	jmjC domain containing protein	0.0071	0.0043	0.0043
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0389	0.1668	0.1332
Trichomonas vaginalis	PIKK family atypical protein kinase	0.1507	0.7367	0.7261
Trichomonas vaginalis	PIKK family atypical protein kinase	0.136	0.6617	0.6481
Brugia malayi	aryl hydrocarbon receptor AHR-1	0.0118	0.0285	0.0285
Trypanosoma cruzi	phosphatidylinositol 3-kinase, putative	0.0389	0.1668	0.156
Entamoeba histolytica	phosphatidylinositol 3-kinase 3, putative	0.0138	0.0387	0.0353
Trypanosoma cruzi	Phosphatidylinositol 3-kinase tor1	0.2023	1	1
Brugia malayi	jmjC domain containing protein	0.0071	0.0043	0.0043
Echinococcus multilocularis	phosphatidylinositol 4,5 bisphosphate 3 kinase	0.067	0.3098	0.3073
Loa Loa (eye worm)	hypothetical protein	0.0433	0.189	0.1855
Brugia malayi	Phosphatidylinositol 3- and 4-kinase family protein	0.0138	0.0387	0.0387
Echinococcus granulosus	phosphatidylinositol 4 phosphate 3 kinase C2	0.0316	0.1292	0.1261
Loa Loa (eye worm)	phosphatidylinositol kinase	0.0138	0.0387	0.0346
Brugia malayi	phosphoinositide 3'-hydroxykinase p110-alpha subunit, putative	0.0253	0.0971	0.0971
Trichomonas vaginalis	phosphatidylinositol 3-kinase class, putative	0.0226	0.0834	0.0464
Plasmodium vivax	phosphatidylinositol 3-kinase, putative	0.0167	0.0535	1
Trypanosoma cruzi	phosphatidylinositol kinase related protein, putative	0.0138	0.0387	0.0263
Trypanosoma brucei	phosphatidylinositol 4-kinase, putative	0.2023	1	1
Echinococcus multilocularis	FKBP12 rapamycin complex associated protein	0.2023	1	1
Brugia malayi	Phosphatidylinositol 3- and 4-kinase family protein	0.0316	0.1292	0.1292
Schistosoma mansoni	phosphatidylinositol 4-kinase type-II	0.0138	0.0387	0.0387
Trypanosoma cruzi	phosphatidylinositol 3-kinase 2, putative	0.0417	0.1808	0.1703
Trypanosoma brucei	phosphatidylinositol kinase related protein, putative	0.0389	0.1668	0.1332
Trypanosoma cruzi	phosphatidylinositol kinase, putative	0.0138	0.0387	0.0263
Brugia malayi	Calcitonin receptor-like protein seb-1	0.011	0.0241	0.0241
Echinococcus multilocularis	PIK kinase, FAT and Armadillo domain containing protein	0.0295	0.1183	0.1152
Schistosoma mansoni	hypothetical protein	0.0069	0.0035	0.0035
Echinococcus granulosus	phosphatidylinositol 45 bisphosphate 3 kinase	0.067	0.3098	0.3073
Trypanosoma cruzi	target of rapamycin kinase 3	0.1612	0.7906	0.7879
Entamoeba histolytica	phosphatidylinositol3-kinaseTor2, putative	0.2023	1	1
Loa Loa (eye worm)	hypothetical protein	0.0119	0.0287	0.0245
Trichomonas vaginalis	PIKK family atypical protein kinase	0.1094	0.5264	0.5074
Entamoeba histolytica	phosphatidylinositol-4,5-bisphosphate 3-kinase, putative	0.0167	0.0535	0.0501
Trichomonas vaginalis	PIKK family atypical protein kinase	0.1507	0.7367	0.7261
Trichomonas vaginalis	PIKK family atypical protein kinase	0.1212	0.5864	0.5698
Trichomonas vaginalis	PIKK family atypical protein kinase	0.1507	0.7367	0.7261
Mycobacterium tuberculosis	Conserved hypothetical protein	0.0138	0.0387	0.5
Entamoeba histolytica	hypothetical protein	0.0138	0.0387	0.0353
Leishmania major	phosphatidylinositol 3-kinase, putative	0.0167	0.0535	0.0153
Loa Loa (eye worm)	phosphatidylinositol 4-kinase type 3 alpha isoform 1	0.0167	0.0535	0.0494
Onchocerca volvulus		0.0222	0.0814	1
Trypanosoma brucei	FAT domain/Rapamycin binding domain/Phosphatidylinositol 3- and 4-kinase, putative	0.0845	0.3992	0.375
Trichomonas vaginalis	PIKK family atypical protein kinase	0.1507	0.7367	0.7261
Plasmodium falciparum	phosphatidylinositol 3-kinase	0.0167	0.0535	1
Brugia malayi	Phosphatidylinositol 3- and 4-kinase family protein	0.0389	0.1668	0.1668
Loa Loa (eye worm)	pre-SET domain-containing protein family protein	0.0195	0.0677	0.0636
Loa Loa (eye worm)	phosphatidylinositol 3	0.0138	0.0387	0.0346
Trypanosoma brucei	Phosphatidylinositol 3-kinase tor1	0.2023	1	1
Toxoplasma gondii	FATC domain-containing protein	0.0389	0.1668	0.1835
Giardia lamblia	Phosphoinositide-3-kinase, class 3	0.0197	0.0686	0.0311
Brugia malayi	Phosphatidylinositol 3- and 4-kinase family protein	0.0138	0.0387	0.0387
Echinococcus granulosus	FKBP12 rapamycin complex associated protein	0.2023	1	1
Trypanosoma cruzi	phosphatidylinositol 3-related kinase, putative	0.0684	0.317	0.3082
Brugia malayi	Phosphatidylinositol 3- and 4-kinase family protein	0.0138	0.0387	0.0387
Trypanosoma brucei	phosphatidylinositol 3-kinase tor, putative	0.0961	0.4584	0.4366
Loa Loa (eye worm)	phosphatidylinositol 3	0.0138	0.0387	0.0346
Entamoeba histolytica	phosphatidylinositol 3-kinase 1, putative	0.0279	0.1102	0.107
Echinococcus multilocularis	phosphatidylinositol 4 kinase alpha	0.0167	0.0535	0.0501
Schistosoma mansoni	fkbp-rapamycin associated protein	0.0389	0.1668	0.1668
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0684	0.317	0.2895
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0549	0.2481	0.2178
Trypanosoma brucei	phosphatidylinositol 4-kinase alpha, putative	0.0167	0.0535	0.0153
Schistosoma mansoni	phosphatidylinositol-45-bisphosphate 3-kinase catalytic subunit alpha PI3K	0.0226	0.0834	0.0834
Trypanosoma cruzi	phosphatidylinositol 4-kinase alpha, putative	0.0167	0.0535	0.0413
Trichomonas vaginalis	PIKK family atypical protein kinase	0.2023	1	1
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0684	0.317	0.2895
Trypanosoma cruzi	phosphatidylinositol 3-kinase, putative	0.0138	0.0387	0.0263
Echinococcus multilocularis	phosphatidylinositol 3 and 4 kinase	0.0684	0.317	0.3146
Entamoeba histolytica	hypothetical protein	0.0389	0.1668	0.1638
Entamoeba histolytica	hypothetical protein	0.0138	0.0387	0.0353
Entamoeba histolytica	phosphatidylinositol 3-kinase, putative	0.0417	0.1808	0.1779
Echinococcus granulosus	Phosphatidylinositol 4 kinase type 2 beta	0.0138	0.0387	0.0353
Loa Loa (eye worm)	phosphatidylinositol 3	0.0138	0.0387	0.0346
Echinococcus multilocularis	Phosphatidylinositol 4 kinase type 2 beta	0.0138	0.0387	0.0353
Trichomonas vaginalis	PIKK family atypical protein kinase	0.1094	0.5264	0.5074
Giardia lamblia	GTOR	0.2023	1	1
Trichomonas vaginalis	PIKK family atypical protein kinase	0.1611	0.7897	0.7813
Entamoeba histolytica	hypothetical protein	0.0138	0.0387	0.0353
Trichomonas vaginalis	PIKK family atypical protein kinase	0.1096	0.5273	0.5082
Schistosoma mansoni	jumonji/arid domain-containing protein	0.0071	0.0043	0.0043
Schistosoma mansoni	hypothetical protein	0.0138	0.0387	0.0387
Loa Loa (eye worm)	hypothetical protein	0.0389	0.1668	0.1632
Brugia malayi	Phosphatidylinositol 3- and 4-kinase family protein	0.0417	0.1808	0.1808
Loa Loa (eye worm)	hypothetical protein	0.0316	0.1292	0.1254
Schistosoma mansoni	hypothetical protein	0.0075	0.0063	0.0063
Trypanosoma cruzi	phosphatidylinositol kinase related protein, putative	0.0251	0.0961	0.0845
Echinococcus granulosus	Phosphatidylinositol 4 kinase type 2 beta	0.0138	0.0387	0.0353
Schistosoma mansoni	jumonji/arid domain-containing protein	0.0071	0.0043	0.0043
Schistosoma mansoni	jumonji domain containing protein	0.0071	0.0043	0.0043
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0251	0.0961	0.0597
Trichomonas vaginalis	PIKK family atypical protein kinase	0.1507	0.7367	0.7261
Echinococcus granulosus	serine:threonine protein kinase SMG1	0.0389	0.1668	0.1638
Echinococcus multilocularis	Transcription factor, JmjC domain containing protein	0.0071	0.0043	0.0008
Toxoplasma gondii	phosphatidylinositol 3- and 4-kinase	0.0167	0.0535	0.0211
Echinococcus multilocularis	geminin	0.0168	0.054	0.0506
Trichomonas vaginalis	phosphatidylinositol 3-kinase class, putative	0.0327	0.135	0.1001

Activities

Activity type	Activity value	Assay description	Source	Reference
EC50 (functional)	> 53 uM	PUBCHEM_BIOASSAY: Dose Response confirmation of uHTS hits for small molecule agonists of the CRF-binding protein and CRF-R2 receptor complex. (Class of assay: confirmatory)	ChEMBL.	No reference
Potency (functional)	5.6234 uM	PUBCHEM_BIOASSAY: qHTS for Inhibitors of binding or entry into cells for Lassa Virus. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID463114, AID540249]	ChEMBL.	No reference
Potency (functional)	9.1962 uM	PUBCHEM_BIOASSAY: qHTS screen for small molecules that inhibit ELG1-dependent DNA repair in human embryonic kidney (HEK293T) cells expressing luciferase-tagged ELG1. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID493107, AID493125]	ChEMBL.	No reference
Potency (functional)	= 10 um	PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Human Jumonji Domain Containing 2E (JMJD2E). (Class of assay: confirmatory)	ChEMBL.	No reference
Potency (functional)	11.2202 uM	PubChem BioAssay. qHTS of GLP-1 Receptor Inverse Agonists (Inhibition Mode). (Class of assay: confirmatory)	ChEMBL.	No reference
Potency (functional)	14.7157 uM	PUBCHEM_BIOASSAY: Primary qHTS for delayed death inhibitors of the malarial parasite plastid, 96 hour incubation. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488745, AID488752, AID488774, AID504848, AID504850]	ChEMBL.	No reference
Potency (functional)	18.526 uM	PUBCHEM_BIOASSAY: Primary qHTS for delayed death inhibitors of the malarial parasite plastid, 48 hour incubation. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488752, AID488774, AID504848, AID504850]	ChEMBL.	No reference
Potency (functional)	20.5962 uM	PubChem BioAssay. A quantitative high throughput screen for small molecules that induce DNA re-replication in SW480 colon adenocarcinoma cells. (Class of assay: confirmatory)	ChEMBL.	No reference
Potency (functional)	56.2341 uM	PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of JMJD2A-Tudor Domain. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID504402]	ChEMBL.	No reference

Phenotypes

Whole-cell/tissue/organism interactions

Species name	Source	Reference	Is orphan
Homo sapiens	ChEMBL23
Plasmodium falciparum	ChEMBL23

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: CHEMBL1995946

Bibliographic References

No literature references available for this target.

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Detailed information for compound 1626757