TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 477.465 | Formula: C21H25F2N7O4
H donors: 0 H acceptors: 4 LogP: 2.25 Rotable bonds: 6
Rule of 5 violations (Lipinski): 1
SMILES: COc1c(OC)ccc2c1nc(n2c1nc(nc(n1)N1CCOCC1)N1CCOCC1)C(F)F
InChi: 1S/C21H25F2N7O4/c1-31-14-4-3-13-15(16(14)32-2)24-18(17(22)23)30(13)21-26-19(28-5-9-33-10-6-28)25-20(27-21)29-7-11-34-12-8-29/h3-4,17H,5-12H2,1-2H3
InChiKey: XZCFLSVUEQRRCU-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	phosphatidylinositol-4,5-bisphosphate 3-kinase, catalytic subunit beta	Starlite/ChEMBL	References
Mus musculus	phosphatidylinositol 3-kinase, catalytic, alpha polypeptide	Starlite/ChEMBL	References

Predicted pathogen targets for this compound

By orthology

Species	Potential target	Known druggable target/s	Ortholog Group
Schistosoma mansoni	phosphatidylinositol-45-bisphosphate 3-kinase catalytic subunit alpha PI3K	Get druggable targets OG5_127444	All targets in OG5_127444
Trichomonas vaginalis	phosphatidylinositol 3-kinase class, putative	Get druggable targets OG5_127444	All targets in OG5_127444
Leishmania infantum	phosphatidylinositol 3-kinase 2, putative	Get druggable targets OG5_127444	All targets in OG5_127444
Leishmania donovani	phosphatidylinositol 3-kinase 2, putative	Get druggable targets OG5_127444	All targets in OG5_127444
Trichomonas vaginalis	phosphatidylinositol 3-kinase catalytic subunit alpha, beta, delta, putative	Get druggable targets OG5_127444	All targets in OG5_127444
Trichomonas vaginalis	phopsphatidylinositol 3-kinase, drosophila, putative	Get druggable targets OG5_127444	All targets in OG5_127444
Entamoeba histolytica	phosphatidylinositol 3-kinase, putative	Get druggable targets OG5_127444	All targets in OG5_127444
Entamoeba histolytica	hypothetical protein	Get druggable targets OG5_127444	All targets in OG5_127444
Trichomonas vaginalis	phosphatidylinositol kinase, putative	Get druggable targets OG5_127444	All targets in OG5_127444
Leishmania mexicana	phosphatidylinositol 3-kinase, putative	Get druggable targets OG5_127444	All targets in OG5_127444
Echinococcus granulosus	phosphatidylinositol 45 bisphosphate 3 kinase	Get druggable targets OG5_127444	All targets in OG5_127444
Giardia lamblia	Phosphoinositide-3-kinase, catalytic, alpha polypeptide	Get druggable targets OG5_127444	All targets in OG5_127444
Entamoeba histolytica	phosphatidylinositol 3-kinase, putative	Get druggable targets OG5_127444	All targets in OG5_127444
Schistosoma japonicum	ko:K00922 phosphatidylinositol-4,5-bisphosphate 3-kinase [EC2.7.1.153], putative	Get druggable targets OG5_127444	All targets in OG5_127444
Trypanosoma cruzi	phosphatidylinositol 3-kinase 2, putative	Get druggable targets OG5_127444	All targets in OG5_127444
Trypanosoma cruzi	phosphatidylinositol 3-kinase 2, putative	Get druggable targets OG5_127444	All targets in OG5_127444
Echinococcus multilocularis	phosphatidylinositol 4,5 bisphosphate 3 kinase	Get druggable targets OG5_127444	All targets in OG5_127444
Trichomonas vaginalis	phosphatidylinositol 3-kinase catalytic subunit gamma, putative	Get druggable targets OG5_127444	All targets in OG5_127444
Loa Loa (eye worm)	hypothetical protein	Get druggable targets OG5_127444	All targets in OG5_127444
Entamoeba histolytica	phosphatidylinositol 3-kinase 1, putative	Get druggable targets OG5_127444	All targets in OG5_127444
Brugia malayi	Phosphatidylinositol 3- and 4-kinase family protein	Get druggable targets OG5_127444	All targets in OG5_127444
Loa Loa (eye worm)	phosphatidylinositol 3	Get druggable targets OG5_127444	All targets in OG5_127444

By sequence similarity to non orthologous known druggable targets

Species	Potential target	Known druggable target	Length	Alignment span	Identity
Trypanosoma brucei	phosphatidylinositol 4-kinase alpha, putative	phosphatidylinositol-4,5-bisphosphate 3-kinase, catalytic subunit beta	582 aa	491 aa	25.2 %
Entamoeba histolytica	phosphatidylinositol 3-kinase, putative	phosphatidylinositol 3-kinase, catalytic, alpha polypeptide	1068 aa	927 aa	29.0 %

Ranking Plot

Putative Targets List

Species	Potential target	Raw	Global	Species
Trichomonas vaginalis	sugar transporter, putative	0.0034	0.0345	0.0586
Trichomonas vaginalis	glucose transporter, putative	0.0034	0.0345	0.0586
Leishmania major	glucose transporter, lmgt3	0.0034	0.0345	0.426
Schistosoma mansoni	protein kinase	0.0033	0.0335	0.0287
Trypanosoma cruzi	hexose transporter	0.0034	0.0345	0.0711
Plasmodium falciparum	proline--tRNA ligase	0.0038	0.0442	0.0315
Plasmodium vivax	proline--tRNA ligase, putative	0.0038	0.0442	0.0315
Trypanosoma cruzi	hexose transporter, putative	0.0034	0.0345	0.0711
Giardia lamblia	Phosphoinositide-3-kinase, class 3	0.0035	0.037	0.0715
Echinococcus granulosus	calcium:calmodulin dependent protein kinase type 1	0.0033	0.0335	0.0287
Plasmodium vivax	hexose transporter	0.0108	0.2038	0.1932
Leishmania major	glucose transporter/membrane transporter D2, putative	0.0034	0.0345	0.426
Echinococcus granulosus	calcium dependent protein kinase	0.0031	0.0289	0.0222
Plasmodium vivax	phosphatidylinositol 3-kinase, putative	0.0046	0.0633	0.0507
Entamoeba histolytica	protein kinase, putative	0.0033	0.0335	0.0431
Schistosoma mansoni	hypothetical protein	0.0108	0.2038	0.269
Plasmodium falciparum	calcium-dependent protein kinase 1	0.0033	0.0336	0.0207
Echinococcus multilocularis	calcium:calmodulin dependent protein kinase type	0.0033	0.0335	0.0287
Echinococcus granulosus	calcium:calmodulin dependent protein kinase type	0.0033	0.0335	0.0287
Brugia malayi	Phosphatidylinositol 3- and 4-kinase family protein	0.007	0.1181	0.222
Entamoeba histolytica	phosphatidylinositol 3-kinase, putative	0.007	0.1181	0.222
Trypanosoma brucei	glucose transporter, putative	0.0034	0.0345	0.2034
Echinococcus granulosus	General substrate transporter	0.0093	0.1693	0.2203
Mycobacterium leprae	Possible lysyl-tRNA synthetase 2 LysX	0.0024	0.0132	0.3046
Toxoplasma gondii	calcium-dependent protein kinase CDPK2A	0.0033	0.0336	0.032
Entamoeba histolytica	phosphatidylinositol 4-kinase, putative	0.0046	0.0633	0.106
Schistosoma mansoni	serine/threonine protein kinase	0.0033	0.0335	0.0287
Loa Loa (eye worm)	hypothetical protein	0.0026	0.0182	0.0077
Trypanosoma brucei	glucose transporter, putative	0.0034	0.0345	0.2034
Brugia malayi	Phosphatidylinositol 3- and 4-kinase family protein	0.0107	0.2021	0.3998
Toxoplasma gondii	phosphatidylinositol 3- and 4-kinase	0.0046	0.0633	0.0784
Entamoeba histolytica	phosphatidylinositol 3-kinase, putative	0.0208	0.4309	0.884
Trypanosoma brucei	THT1 - hexose transporter, putative	0.0034	0.0345	0.2034
Leishmania major	prolyl-tRNA synthetase, putative,bifunctional aminoacyl-tRNA synthetase, putative	0.0038	0.0442	0.62
Trypanosoma cruzi	prolyl-tRNA synthetase, putative	0.0038	0.0442	0.0911
Brugia malayi	bifunctional aminoacyl-tRNA synthetase	0.0032	0.032	0.0399
Mycobacterium ulcerans	lysyl-tRNA synthetase	0.0024	0.0132	0.5
Trypanosoma brucei	THT1 - hexose transporter, putative	0.0034	0.0345	0.2034
Echinococcus granulosus	calcium:calmodulin dependent protein kinase type	0.0033	0.0335	0.0287
Echinococcus granulosus	phosphatidylinositol 3 kinase catalytic subunit	0.0046	0.0633	0.0707
Entamoeba histolytica	protein kinase, putative	0.0033	0.0335	0.0431
Plasmodium falciparum	calcium-dependent protein kinase 5	0.0033	0.0336	0.0207
Trypanosoma brucei	glucose transporter, putative	0.0034	0.0345	0.2034
Plasmodium vivax	CDK-related protein kinase 6, putative	0.0459	1	1
Trypanosoma cruzi	lysyl-tRNA synthetase, putative	0.0024	0.0132	0.0271
Toxoplasma gondii	facilitative glucose transporter GT1	0.0108	0.2038	0.2985
Trichomonas vaginalis	phosphatidylinositol kinase, putative	0.0046	0.0633	0.1186
Trichomonas vaginalis	phopsphatidylinositol 3-kinase, drosophila, putative	0.0232	0.4857	1
Loa Loa (eye worm)	phosphatidylinositol 3	0.006	0.0942	0.1239
Schistosoma mansoni	phosphatidylinositol-45-bisphosphate 3-kinase catalytic subunit alpha PI3K	0.007	0.1181	0.148
Trichomonas vaginalis	conserved hypothetical protein	0.0108	0.2038	0.4119
Trypanosoma brucei	glucose transporter, putative	0.0034	0.0345	0.2034
Echinococcus multilocularis	solute carrier family 2 facilitated glucose	0.0108	0.2038	0.269
Echinococcus multilocularis	solute carrier family 2 facilitated glucose	0.0108	0.2038	0.269
Trichomonas vaginalis	phosphatidylinositol kinase, putative	0.0232	0.4857	1
Echinococcus multilocularis	calcium:calmodulin dependent protein kinase type	0.0033	0.0335	0.0287
Plasmodium falciparum	calcium-dependent protein kinase 3	0.0033	0.0336	0.0207
Leishmania major	glucose transporter, lmgt2	0.0034	0.0345	0.426
Loa Loa (eye worm)	calcium/calmodulin-dependent protein kinase ID	0.0033	0.0335	0.0311
Mycobacterium tuberculosis	Lysyl-tRNA synthetase 2 LysX	0.0021	0.0049	0.5
Brugia malayi	Bifunctional aminoacyl-tRNA synthetase	0.0032	0.032	0.0399
Echinococcus multilocularis	glutamyl tRNA synthetase cytoplasmic	0.0032	0.032	0.0266
Echinococcus multilocularis	calcium:calmodulin dependent protein kinase type	0.0033	0.0335	0.0287
Trypanosoma brucei	phosphatidylinositol 3-kinase, putative	0.007	0.1181	1
Schistosoma mansoni	protein kinase	0.0033	0.0335	0.0287
Mycobacterium tuberculosis	Lysyl-tRNA synthetase 1 LysS (lysine--tRNA ligase 1) (LysRS 1) (lysine translase)	0.0021	0.0049	0.5
Trichomonas vaginalis	phosphatidylinositol 3-kinase class, putative	0.007	0.1181	0.2329
Plasmodium falciparum	protein kinase 7	0.0306	0.6518	0.6471
Entamoeba histolytica	phosphatidylinositol 3-kinase, putative	0.007	0.1181	0.222
Loa Loa (eye worm)	hypothetical protein	0.0125	0.242	0.3499
Toxoplasma gondii	phosphatidylinositol 3- and 4-kinase	0.0046	0.0633	0.0784
Echinococcus multilocularis	phosphatidylinositol 4 phosphate 3 kinase C2	0.0107	0.2021	0.2665
Trichomonas vaginalis	glucose transporter, putative	0.0034	0.0345	0.0586
Plasmodium falciparum	phosphatidylinositol 3-kinase	0.0046	0.0633	0.0507
Trypanosoma cruzi	phosphatidylinositol 3-kinase vps34-like	0.007	0.1181	0.2431
Trypanosoma brucei	glucose transporter, putative	0.0034	0.0345	0.2034
Trichomonas vaginalis	phosphatidylinositol 3-kinase catalytic subunit alpha, beta, delta, putative	0.007	0.1181	0.2329
Schistosoma mansoni	glutamyl-tRNA synthetase cytoplasmic (glutamate--tRNA ligase) (glurs)	0.0032	0.032	0.0266
Trypanosoma brucei	phosphatidylinositol 4-kinase alpha, putative	0.0046	0.0633	0.4775
Entamoeba histolytica	hypothetical protein	0.0208	0.4309	0.884
Plasmodium vivax	calcium-dependent protein kinase 4, putative	0.0033	0.0336	0.0207
Brugia malayi	Calcium/calmodulin-dependent protein kinase type II alpha chain	0.0033	0.0335	0.0431
Loa Loa (eye worm)	hypothetical protein	0.0032	0.032	0.0288
Loa Loa (eye worm)	hypothetical protein	0.0032	0.032	0.0288
Brugia malayi	Cam kinase protein 1	0.0033	0.0335	0.0431
Plasmodium vivax	calcium-dependent protein kinase 1, putative	0.0033	0.0336	0.0207
Trypanosoma cruzi	hexose transporter, putative	0.0034	0.0345	0.0711
Trichomonas vaginalis	lysyl-tRNA synthetase, putative	0.0024	0.0132	0.0141
Loa Loa (eye worm)	phosphatidylinositol 4-kinase type 3 alpha isoform 1	0.0046	0.0633	0.0766
Toxoplasma gondii	cell-cycle-associated protein kinase MAPK, putative	0.0175	0.355	0.5352
Echinococcus granulosus	phosphatidylinositol 45 bisphosphate 3 kinase	0.0337	0.722	1
Trichomonas vaginalis	phosphatidylinositol 3-kinase class, putative	0.0195	0.4016	0.8247
Trypanosoma brucei	glucose transporter, putative	0.0034	0.0345	0.2034
Giardia lamblia	Prolyl-tRNA synthetase	0.0032	0.032	0.0565
Echinococcus multilocularis	General substrate transporter	0.0093	0.1693	0.2203
Leishmania major	prolyl-tRNA synthetase, putative,bifunctional aminoacyl-tRNA synthetase, putative	0.0038	0.0442	0.62
Echinococcus granulosus	solute carrier family 2 facilitated glucose	0.0108	0.2038	0.269
Entamoeba histolytica	phosphatidylinositol 3-kinase, putative	0.0083	0.1473	0.2838
Trypanosoma brucei	glucose transporter, putative	0.0034	0.0345	0.2034
Echinococcus granulosus	phosphatidylinositol 4 phosphate 3 kinase C2	0.0107	0.2021	0.2665
Trichomonas vaginalis	phosphatidylinositol 3-kinase catalytic subunit alpha, beta, delta, putative	0.0195	0.4016	0.8247
Toxoplasma gondii	protein kinase, putative	0.0306	0.6518	1
Echinococcus granulosus	calcium:calmodulin dependent protein kinase type	0.0033	0.0335	0.0287
Chlamydia trachomatis	lysine--tRNA ligase	0.0024	0.0132	0.5
Echinococcus multilocularis	Zinc finger, PHD finger	0.0046	0.0633	0.0707
Echinococcus multilocularis	calcium:calmodulin dependent protein kinase type	0.0033	0.0335	0.0287
Schistosoma mansoni	glucose transport protein	0.0108	0.2038	0.269
Schistosoma mansoni	phosphatidylinositol-45-bisphosphate 3-kinase catalytic subunit alpha PI3K	0.0046	0.0633	0.0707
Loa Loa (eye worm)	CAMK/CAMK2 protein kinase	0.0033	0.0335	0.0311
Trypanosoma brucei	glucose transporter 1E	0.0034	0.0345	0.2034
Brugia malayi	phosphatidylinositol 4-kinase, catalytic, alpha polypeptide	0.0046	0.0633	0.106
Trypanosoma brucei	glucose transporter 2A	0.0034	0.0345	0.2034
Trichomonas vaginalis	sugar transporter, putative	0.0034	0.0345	0.0586
Trypanosoma cruzi	phosphatidylinositol 3-kinase, putative	0.006	0.0942	0.194
Leishmania major	glucose transporter, lmgt1	0.0034	0.0345	0.426
Echinococcus granulosus	solute carrier family 2 facilitated glucose	0.0108	0.2038	0.269
Loa Loa (eye worm)	sugar transporter	0.0108	0.2038	0.2915
Leishmania major	protein kinase, putative	0.0033	0.0335	0.4068
Trypanosoma brucei	THT1 - hexose transporter, putative	0.0034	0.0345	0.2034
Giardia lamblia	Phosphoinositide-3-kinase, catalytic, alpha polypeptide	0.0171	0.3468	1
Trypanosoma cruzi	phosphatidylinositol 4-kinase alpha, putative	0.0046	0.0633	0.1302
Echinococcus multilocularis	calcium dependent protein kinase	0.0031	0.0289	0.0222
Trichomonas vaginalis	prolyl-tRNA synthetase, putative	0.0032	0.032	0.0534
Trypanosoma cruzi	prolyl-tRNA synthetase, putative	0.0038	0.0442	0.0911
Trypanosoma brucei	bifunctional aminoacyl-tRNA synthetase, putative	0.0038	0.0442	0.296
Schistosoma mansoni	glucose transport protein	0.0108	0.2038	0.269
Trichomonas vaginalis	sugar transporter, putative	0.0034	0.0345	0.0586
Echinococcus granulosus	solute carrier family 2 facilitated glucose	0.0108	0.2038	0.269
Plasmodium falciparum	calcium-dependent protein kinase 2	0.0033	0.0336	0.0207
Entamoeba histolytica	prolyl-tRNA synthetase, putative	0.0032	0.032	0.0399
Plasmodium falciparum	calcium-dependent protein kinase 4	0.0033	0.0336	0.0207
Loa Loa (eye worm)	hypothetical protein	0.0033	0.0335	0.0311
Echinococcus multilocularis	solute carrier family 2 facilitated glucose	0.0108	0.2038	0.269
Plasmodium vivax	calcium-dependent protein kinase 3, putative	0.0033	0.0336	0.0207
Plasmodium vivax	mitogen-activated protein kinase 2, putative	0.0175	0.355	0.3464
Schistosoma mansoni	protein kinase	0.0033	0.0335	0.0287
Trypanosoma cruzi	phosphatidylinositol 3-kinase 2, putative	0.0232	0.4857	1
Trypanosoma cruzi	hexose transporter, putative	0.0034	0.0345	0.0711
Entamoeba histolytica	phosphatidylinositol-4,5-bisphosphate 3-kinase, putative	0.0046	0.0633	0.106
Trichomonas vaginalis	conserved hypothetical protein	0.0034	0.0345	0.0586
Trypanosoma cruzi	phosphatidylinositol 4-kinase alpha, putative	0.0046	0.0633	0.1302
Schistosoma mansoni	glucose transport protein	0.0108	0.2038	0.269
Loa Loa (eye worm)	phosphatidylinositol 3	0.0312	0.6672	1
Loa Loa (eye worm)	hypothetical protein	0.0107	0.2021	0.2888
Trichomonas vaginalis	phosphatidylinositol kinase, putative	0.007	0.1181	0.2329
Brugia malayi	phosphoinositide 3'-hydroxykinase p110-alpha subunit, putative	0.0104	0.1947	0.3842
Schistosoma mansoni	phosphatidylinositol-45-bisphosphate 3-kinase catalytic subunit alpha PI3K	0.0337	0.722	1
Trichomonas vaginalis	phosphatidylinositol 3-kinase catalytic subunit gamma, putative	0.0232	0.4857	1
Brugia malayi	Sugar transporter family protein	0.0108	0.2038	0.4035
Toxoplasma gondii	calcium-dependent protein kinase CDPK2B	0.0033	0.0336	0.032
Mycobacterium leprae	Probable prolyl tRNA synthetase ProS	0.0032	0.032	1
Echinococcus granulosus	solute carrier family 2 facilitated glucose	0.0108	0.2038	0.269
Brugia malayi	Phosphatidylinositol 3- and 4-kinase family protein	0.0232	0.4857	1
Plasmodium falciparum	mitogen-activated protein kinase 2	0.0175	0.355	0.3464
Trichomonas vaginalis	phosphatidylinositol 3-kinase class, putative	0.0046	0.0633	0.1186
Entamoeba histolytica	phosphatidylinositol 3-kinase, putative	0.0232	0.4857	1
Plasmodium falciparum	hexose transporter	0.0108	0.2038	0.1932
Echinococcus multilocularis	solute carrier family 2, facilitated glucose	0.0108	0.2038	0.269
Toxoplasma gondii	calcium-dependent protein kinase CDPK3	0.0033	0.0336	0.032
Leishmania major	phosphatidylinositol 4-kinase alpha, putative	0.0046	0.0633	1
Trypanosoma brucei	glucose transporter, putative	0.0034	0.0345	0.2034
Plasmodium vivax	calcium-dependent protein kinase, putative	0.0033	0.0336	0.0207
Echinococcus granulosus	glutamyl tRNA synthetase cytoplasmic	0.0032	0.032	0.0266
Trypanosoma cruzi	phosphatidylinositol 3-kinase 2, putative	0.0232	0.4857	1
Toxoplasma gondii	prolyl-tRNA synthetase (ProRS)	0.0038	0.0442	0.0486
Trichomonas vaginalis	phosphatidylinositol 4-kinase, putative	0.0046	0.0633	0.1186
Schistosoma mansoni	phosphatidylinositol 4-kinase	0.0046	0.0633	0.0707
Echinococcus multilocularis	phosphatidylinositol 4,5 bisphosphate 3 kinase	0.0337	0.722	1
Trichomonas vaginalis	conserved hypothetical protein	0.0034	0.0345	0.0586
Echinococcus granulosus	phosphatidylinositol 4 kinase alpha	0.0046	0.0633	0.0707
Schistosoma mansoni	glutamyl-tRNA synthetase cytoplasmic (glutamate--tRNA ligase) (glurs)	0.0032	0.032	0.0266
Trichomonas vaginalis	CAMK family protein kinase	0.0033	0.0335	0.0566
Mycobacterium ulcerans	lysyl-tRNA synthetase	0.0024	0.0132	0.5
Entamoeba histolytica	phosphatidylinositol 3-kinase 1, putative	0.0222	0.4618	0.9496
Echinococcus multilocularis	phosphatidylinositol 4 kinase alpha	0.0046	0.0633	0.0707
Trypanosoma brucei	calcium/calmodulin-dependent protein kinase, putative	0.0033	0.0335	0.1942
Leishmania major	phosphatidylinositol 3-kinase, putative	0.0046	0.0633	1

Activities

Activity type	Activity value	Assay description	Source	Reference
IC50 (binding)	= 335 nM	Inhibition of mouse recombinant PI3K p110alpha expressed in Sf21 insect cells using phosphatidylinositol as substrate after 1 hr by phosphoimaging	ChEMBL.	21882832
IC50 (binding)	= 801 nM	Inhibition of human recombinant PI3K p110beta expressed in Sf21 insect cells using phosphatidylinositol as substrate after 1 hr by phosphoimaging	ChEMBL.	21882832

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: CHEMBL1911015

Bibliographic References

1 literature reference was collected for this gene.

If you have references for this compound, please enter them in a user comment (below) or Contact us.

Detailed information for compound 1580203