TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 438.887 | Formula: C21H15ClN4O3S
H donors: 2 H acceptors: 2 LogP: 3.78 Rotable bonds: 3
Rule of 5 violations (Lipinski): 1
SMILES: Clc1ccccc1n1c(=O)[nH]nc1c1cc2c(s1)c1ccc(cc1OCC2)C(=O)N
InChi: 1S/C21H15ClN4O3S/c22-14-3-1-2-4-15(14)26-20(24-25-21(26)28)17-10-11-7-8-29-16-9-12(19(23)27)5-6-13(16)18(11)30-17/h1-6,9-10H,7-8H2,(H2,23,27)(H,25,28)
InChiKey: RZCPZQWWGJRSCI-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 alpha	Starlite/ChEMBL	References

Predicted pathogen targets for this compound

By orthology

Species	Potential target	Known druggable target/s	Ortholog Group
Entamoeba histolytica	hypothetical protein	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
Trichomonas vaginalis	phosphatidylinositol 3-kinase class, putative	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
Giardia lamblia	Phosphoinositide-3-kinase, catalytic, alpha polypeptide	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
Leishmania donovani	phosphatidylinositol 3-kinase 2, 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
Trichomonas vaginalis	phosphatidylinositol 3-kinase catalytic subunit alpha, beta, delta, 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
Echinococcus granulosus	phosphatidylinositol 45 bisphosphate 3 kinase	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
Trichomonas vaginalis	phopsphatidylinositol 3-kinase, drosophila, 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
Loa Loa (eye worm)	hypothetical protein	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
Echinococcus multilocularis	phosphatidylinositol 4,5 bisphosphate 3 kinase	Get druggable targets OG5_127444	All targets in OG5_127444
Schistosoma mansoni	phosphatidylinositol-45-bisphosphate 3-kinase catalytic subunit alpha PI3K	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
Trichomonas vaginalis	phosphatidylinositol 3-kinase catalytic subunit gamma, putative	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
Entamoeba histolytica	phosphatidylinositol 3-kinase 1, putative	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
Entamoeba histolytica	phosphatidylinositol 3-kinase, putative	phosphatidylinositol-4,5-bisphosphate 3-kinase, catalytic subunit alpha	1068 aa	927 aa	29.0 %

Ranking Plot

Putative Targets List

Species	Potential target	Raw	Global	Species
Entamoeba histolytica	P-glycoprotein 5, putative	0.0096	0.0729	0.0729
Echinococcus granulosus	5'partial\|ATP binding cassette sub family B	0.0095	0.0717	0.3419
Trichomonas vaginalis	phosphatidylinositol kinase, putative	0.0118	0.0968	1
Trichomonas vaginalis	multidrug resistance protein 1, 2, putative	0.0096	0.0729	0.753
Echinococcus multilocularis	ATP binding cassette sub family B	0.0095	0.0717	0.3383
Loa Loa (eye worm)	pigment dispersing factor receptor c	0.0058	0.0319	0.1735
Trichomonas vaginalis	sphingomyelin synthetase, putative	0.0051	0.0243	0.2515
Brugia malayi	Phosphatidylcholine:ceramide cholinephosphotransferase 1	0.0051	0.0243	0.2515
Loa Loa (eye worm)	ABC transporter	0.003	0.0011	0.0062
Loa Loa (eye worm)	phosphatidylinositol 3	0.0036	0.0076	0.0414
Echinococcus multilocularis	ATP binding cassette subfamily B (MDR:TAP)	0.0096	0.0729	0.3438
Loa Loa (eye worm)	ABC transporter transmembrane region family protein	0.003	0.0011	0.0062
Echinococcus granulosus	sphingomyelin synthase protein 1	0.0051	0.0243	0.116
Trypanosoma brucei	phosphatidylinositol 3-kinase, putative	0.004	0.0114	0.0206
Entamoeba histolytica	phosphatidylinositol 3-kinase 1, putative	0.0115	0.093	0.093
Entamoeba histolytica	P-glycoprotein-2, putative	0.0096	0.0729	0.0729
Trichomonas vaginalis	phosphatidylinositol 3-kinase class, putative	0.0081	0.0566	0.5848
Mycobacterium ulcerans	transmembrane ABC transporter ATP-binding protein	0.003	0.0011	0.5
Schistosoma mansoni	hypothetical protein	0.0143	0.1233	0.5878
Trichomonas vaginalis	ABC transporter, putative	0.0096	0.0729	0.753
Entamoeba histolytica	hypothetical protein	0.0051	0.0243	0.0243
Mycobacterium ulcerans	transmembrane ABC transporter ATP-binding protein	0.003	0.0011	0.5
Brugia malayi	phosphoinositide 3'-hydroxykinase p110-alpha subunit, putative	0.0104	0.0815	0.842
Schistosoma mansoni	smdr1	0.003	0.0011	0.0054
Loa Loa (eye worm)	hypothetical protein	0.0051	0.0243	0.1326
Trichomonas vaginalis	phosphatidylinositol 3-kinase catalytic subunit alpha, beta, delta, putative	0.0081	0.0566	0.5848
Plasmodium vivax	multidrug resistance protein 1, putative	0.0096	0.0729	1
Schistosoma mansoni	multidrug resistance protein	0.003	0.0011	0.0054
Entamoeba histolytica	hypothetical protein	0.003	0.0011	0.0011
Brugia malayi	Phosphatidylinositol 3- and 4-kinase family protein	0.0077	0.0516	0.5329
Echinococcus multilocularis	multidrug resistance protein 1	0.0067	0.0413	0.1927
Giardia lamblia	Multidrug resistance-associated protein 1	0.003	0.0011	0.0375
Trichomonas vaginalis	lipid A export ATP-binding/permease protein msba, putative	0.0096	0.0729	0.753
Brugia malayi	ABC transporter transmembrane region family protein	0.003	0.0011	0.0118
Schistosoma mansoni	smdr2	0.0096	0.0729	0.3474
Loa Loa (eye worm)	hypothetical protein	0.0096	0.0729	0.3969
Echinococcus granulosus	multidrug resistance associated protein 1	0.003	0.0011	0.0054
Trichomonas vaginalis	lipid A export ATP-binding/permease protein msba, putative	0.0096	0.0729	0.753
Trichomonas vaginalis	multidrug resistance protein 1, 2, putative	0.0096	0.0729	0.753
Plasmodium falciparum	sphingomyelin synthase 1, putative	0.0051	0.0243	0.3235
Trichomonas vaginalis	multidrug resistance protein 1, 2, putative	0.0096	0.0729	0.753
Brugia malayi	Phosphatidylcholine:ceramide cholinephosphotransferase 2	0.0051	0.0243	0.2515
Giardia lamblia	Multidrug resistance-associated protein 1	0.003	0.0011	0.0375
Trichomonas vaginalis	sphingomyelin synthetase, putative	0.0051	0.0243	0.2515
Entamoeba histolytica	ATP-binding cassette protein, putative	0.003	0.0011	0.0011
Entamoeba histolytica	hypothetical protein	0.0051	0.0243	0.0243
Trichomonas vaginalis	multidrug resistance protein 1, 2, putative	0.0096	0.0729	0.753
Echinococcus multilocularis	sphingomyelin synthase protein 1	0.0051	0.0243	0.1112
Brugia malayi	ABC transporter family protein	0.0096	0.0729	0.753
Chlamydia trachomatis	ABC transporter ATP binding protein/permease	0.0096	0.0729	0.5
Trichomonas vaginalis	lipid A export ATP-binding/permease protein msba, putative	0.0096	0.0729	0.753
Trichomonas vaginalis	abcb9, putative	0.0096	0.0729	0.753
Mycobacterium leprae	PROBABLE DRUGS-TRANSPORT TRANSMEMBRANE ATP-BINDING PROTEIN ABC TRANSPORTER	0.003	0.0011	0.5
Plasmodium falciparum	multidrug resistance protein 1	0.0096	0.0729	1
Trypanosoma cruzi	phosphatidylinositol 3-kinase 2, putative	0.0118	0.0968	0.1925
Leishmania major	ATP-binding cassette protein subfamily B, member 2, putative	0.0096	0.0729	0.1444
Echinococcus granulosus	ATP binding cassette sub family B	0.003	0.0011	0.0054
Entamoeba histolytica	phosphatidylinositol 3-kinase, putative	0.0118	0.0968	0.0968
Echinococcus granulosus	multidrug resistance protein 1	0.0067	0.0413	0.1971
Trypanosoma cruzi	phosphatidylinositol 3-kinase, putative	0.0036	0.0076	0.013
Entamoeba histolytica	phosphatidylinositol 3-kinase, putative	0.0094	0.0706	0.0706
Echinococcus granulosus	Mitotic checkpoint protein PRCC C terminal	0.0143	0.1233	0.5878
Brugia malayi	Phosphatidylcholine:ceramide cholinephosphotransferase 1	0.0051	0.0243	0.2515
Trichomonas vaginalis	ATP-binding cassette transporter, putative	0.0096	0.0729	0.753
Brugia malayi	multidrug resistance related protein 1	0.003	0.0011	0.0118
Trichomonas vaginalis	sphingomyelin synthetase, putative	0.0051	0.0243	0.2515
Loa Loa (eye worm)	hypothetical protein	0.003	0.0011	0.0062
Entamoeba histolytica	P-glycoprotein 6, putative	0.003	0.0011	0.0011
Brugia malayi	P-glycoprotein-like protein	0.003	0.0011	0.0118
Trichomonas vaginalis	lipid A export ATP-binding/permease protein msba, putative	0.0096	0.0729	0.753
Echinococcus multilocularis	phosphatidylinositol 4 phosphate 3 kinase C2	0.0077	0.0516	0.2417
Giardia lamblia	Phosphoinositide-3-kinase, catalytic, alpha polypeptide	0.0057	0.0304	1
Toxoplasma gondii	ATP-binding cassette transporter ABC.B1	0.0096	0.0729	1
Mycobacterium leprae	PROBABLE DRUGS-TRANSPORT TRANSMEMBRANE ATP-BINDING PROTEIN ABC TRANSPORTER	0.003	0.0011	0.5
Trypanosoma cruzi	sphingomyelin/ceramide phosphorylethanolamine synthase, bifunctional	0.0488	0.4978	1
Trichomonas vaginalis	ATP-binding cassette transporter, putative	0.0096	0.0729	0.753
Brugia malayi	ABC transporter transmembrane region family protein	0.003	0.0011	0.0118
Schistosoma mansoni	multidrug resistance protein	0.003	0.0011	0.0054
Mycobacterium tuberculosis	Probable transmembrane multidrug efflux pump	0.0096	0.0729	1
Brugia malayi	Corticotropin releasing factor receptor 2 precursor, putative	0.0058	0.0319	0.3292
Brugia malayi	ABC transporter family protein	0.003	0.0011	0.0118
Loa Loa (eye worm)	hypothetical protein	0.0096	0.0729	0.3969
Entamoeba histolytica	P-glyco protein 6, putative	0.0096	0.0729	0.0729
Trichomonas vaginalis	phosphatidylinositol 3-kinase catalytic subunit alpha, beta, delta, putative	0.004	0.0114	0.1178
Entamoeba histolytica	ATP-binding cassette protein, putative	0.003	0.0011	0.0011
Schistosoma mansoni	hypothetical protein	0.004	0.0118	0.0563
Loa Loa (eye worm)	ABC transporter	0.003	0.0011	0.0062
Loa Loa (eye worm)	hypothetical protein	0.0051	0.0243	0.1326
Entamoeba histolytica	multidrug resistance protein, putative	0.003	0.0011	0.0011
Trypanosoma cruzi	phosphatidylinositol 3-kinase vps34-like	0.004	0.0114	0.0206
Echinococcus granulosus	ATP binding cassette subfamily B MDR:TAP	0.0096	0.0729	0.3474
Loa Loa (eye worm)	hypothetical protein	0.0051	0.0243	0.1326
Schistosoma mansoni	phosphatidylinositol-45-bisphosphate 3-kinase catalytic subunit alpha PI3K	0.0222	0.2098	1
Loa Loa (eye worm)	ABC transporter	0.003	0.0011	0.0062
Echinococcus granulosus	phosphatidylinositol 45 bisphosphate 3 kinase	0.0222	0.2098	1
Brugia malayi	Sphingomyelin synthase-related 1	0.0051	0.0243	0.2515
Brugia malayi	multidrug Resistance Protein family member (mrp-5), putative	0.003	0.0011	0.0118
Entamoeba histolytica	hypothetical membrane-spanning protein	0.0051	0.0243	0.0243
Plasmodium vivax	sphingomyelin synthase 1, putative	0.0051	0.0243	0.3235
Entamoeba histolytica	phosphatidylinositol 3-kinase, putative	0.004	0.0114	0.0114
Loa Loa (eye worm)	hypothetical protein	0.0042	0.0137	0.0745
Trichomonas vaginalis	ATP-binding cassette transporter, putative	0.0096	0.0729	0.753
Echinococcus multilocularis	ATP binding cassette subfamily B (MDR:TAP)	0.0096	0.0729	0.3438
Brugia malayi	Calcitonin receptor-like protein seb-1	0.0058	0.0319	0.3292
Echinococcus multilocularis	thyroid hormone receptor alpha	0.0154	0.1357	0.6451
Echinococcus granulosus	ATP binding cassette subfamily B MDR:TAP	0.0096	0.0729	0.3474
Trichomonas vaginalis	phosphatidylinositol kinase, putative	0.004	0.0114	0.1178
Loa Loa (eye worm)	hypothetical protein	0.004	0.0118	0.0643
Trichomonas vaginalis	multidrug resistance protein 1, 2, putative	0.0096	0.0729	0.753
Echinococcus multilocularis	ATP binding cassette subfamily B (MDR:TAP)	0.0096	0.0729	0.3438
Schistosoma mansoni	thyroid hormone receptor	0.0154	0.1357	0.647
Echinococcus granulosus	multidrug resistance protein 1	0.0096	0.0729	0.3474
Trypanosoma brucei	inositol phosphorylceramide synthase	0.0051	0.0243	0.0467
Trichomonas vaginalis	lipid A export ATP-binding/permease protein msba, putative	0.0096	0.0729	0.753
Wolbachia endosymbiont of Brugia malayi	ABC-type multidrug transport system, ATPase and permease component	0.003	0.0011	0.5
Trichomonas vaginalis	lipid A export ATP-binding/permease protein msba, putative	0.003	0.0011	0.0118
Entamoeba histolytica	phosphatidylinositol 3-kinase, putative	0.0052	0.0254	0.0254
Brugia malayi	ABC transporter	0.003	0.0011	0.0118
Trichomonas vaginalis	hypothetical protein	0.0051	0.0243	0.2515
Trichomonas vaginalis	ABC transporter, putative	0.0096	0.0729	0.753
Brugia malayi	Phosphatidylinositol 3- and 4-kinase family protein	0.004	0.0114	0.1178
Trichomonas vaginalis	conserved hypothetical protein	0.0051	0.0243	0.2515
Loa Loa (eye worm)	hypothetical protein	0.0051	0.0243	0.1326
Loa Loa (eye worm)	hypothetical protein	0.0051	0.0243	0.1326
Entamoeba histolytica	hypothetical protein	0.0051	0.0243	0.0243
Echinococcus granulosus	multidrug resistance protein 1	0.0067	0.0413	0.1971
Schistosoma mansoni	multidrug resistance protein	0.0096	0.0729	0.3474
Onchocerca volvulus		0.0096	0.0729	0.5
Echinococcus granulosus	ATP binding cassette subfamily B MDR:TAP	0.0096	0.0729	0.3474
Plasmodium vivax	sphingomyelin synthase 2, putative	0.0051	0.0243	0.3235
Leishmania major	phosphatidylcholine:ceramide cholinephosphotransferase 2	0.0488	0.4978	1
Entamoeba histolytica	hypothetical protein	0.0051	0.0243	0.0243
Trichomonas vaginalis	phosphatidylinositol 3-kinase catalytic subunit gamma, putative	0.0118	0.0968	1
Brugia malayi	Phosphatidylcholine:ceramide cholinephosphotransferase 3	0.0051	0.0243	0.2515
Schistosoma mansoni	multidrug resistance protein	0.003	0.0011	0.0054
Schistosoma mansoni	multidrug resistance protein	0.0096	0.0729	0.3474
Schistosoma mansoni	ATP-binding cassette sub-family B member 7 mitochondrial precursor (abc7)	0.003	0.0011	0.0054
Echinococcus granulosus	phosphatidylinositol 4 phosphate 3 kinase C2	0.0077	0.0516	0.2459
Echinococcus granulosus	multidrug resistance associated protein 7	0.003	0.0011	0.0054
Trichomonas vaginalis	phopsphatidylinositol 3-kinase, drosophila, putative	0.0118	0.0968	1
Brugia malayi	ABC transporter family protein	0.003	0.0011	0.0118
Trichomonas vaginalis	sphingomyelin synthetase, putative	0.0051	0.0243	0.2515
Trichomonas vaginalis	taga, putative	0.0096	0.0729	0.753
Loa Loa (eye worm)	hypothetical protein	0.003	0.0011	0.0062
Trypanosoma brucei	sphingomyelin/ceramide phosphorylethanolamine synthase, bifunctional	0.0488	0.4978	1
Schistosoma mansoni	multidrug resistance protein	0.003	0.0011	0.0054
Entamoeba histolytica	hypothetical protein	0.0094	0.0706	0.0706
Wolbachia endosymbiont of Brugia malayi	ABC-type protease secretion system, ATPase and permease component, AprD	0.003	0.0011	0.5
Leishmania major	p-glycoprotein	0.0096	0.0729	0.1444
Echinococcus granulosus	multidrug resistance protein 1	0.0096	0.0729	0.3474
Echinococcus multilocularis	Mitotic checkpoint protein PRCC, C terminal	0.0143	0.1233	0.5855
Loa Loa (eye worm)	hypothetical protein	0.0095	0.0717	0.3907
Entamoeba histolytica	phosphatidylinositol 3-kinase, putative	0.004	0.0114	0.0114
Trichomonas vaginalis	abcb9, putative	0.0096	0.0729	0.753
Trichomonas vaginalis	multidrug resistance protein 1, 2, putative	0.0096	0.0729	0.753
Entamoeba histolytica	P-glycoprotein-5	0.0096	0.0729	0.0729
Echinococcus granulosus	ATP binding cassette subfamily B MDR:TAP	0.0096	0.0729	0.3474
Plasmodium falciparum	sphingomyelin synthase 1, putative	0.0051	0.0243	0.3235
Loa Loa (eye worm)	hypothetical protein	0.0058	0.0319	0.1735
Entamoeba histolytica	P-glycoprotein-2	0.0096	0.0729	0.0729
Entamoeba histolytica	ATP-binding cassette protein, putative	0.003	0.0011	0.0011
Entamoeba histolytica	ABC transporter, putative	0.003	0.0011	0.0011
Trichomonas vaginalis	ABC transporter, putative	0.0096	0.0729	0.753
Schistosoma mansoni	phosphatidylinositol-45-bisphosphate 3-kinase catalytic subunit alpha PI3K	0.004	0.0114	0.0543
Toxoplasma gondii	ABC transporter transmembrane region domain-containing protein	0.0096	0.0729	1
Schistosoma mansoni	spingomyelin synthetase-related	0.0051	0.0243	0.116
Mycobacterium ulcerans	drugs-transport transmembrane ATP-binding protein ABC transporter	0.003	0.0011	0.5
Brugia malayi	latrophilin 2 splice variant baaae	0.004	0.0118	0.122
Trichomonas vaginalis	lipid A export ATP-binding/permease protein msba, putative	0.0096	0.0729	0.753
Brugia malayi	Phosphatidylcholine:ceramide cholinephosphotransferase 2	0.0051	0.0243	0.2515
Toxoplasma gondii	hypothetical protein	0.0051	0.0243	0.3235
Entamoeba histolytica	hypothetical protein	0.0051	0.0243	0.0243
Brugia malayi	ABC transporter family protein	0.003	0.0011	0.0118
Trypanosoma cruzi	sphingomyelin/ceramide phosphorylethanolamine synthase, bifunctional	0.0488	0.4978	1
Loa Loa (eye worm)	phosphatidylinositol 3	0.0198	0.1836	1
Echinococcus multilocularis	multidrug resistance protein 1	0.0096	0.0729	0.3438
Trichomonas vaginalis	ATP-binding cassette transporter, putative	0.0096	0.0729	0.753
Echinococcus multilocularis	phosphatidylinositol 4,5 bisphosphate 3 kinase	0.0222	0.2098	1
Trypanosoma cruzi	phosphatidylinositol 3-kinase 2, putative	0.0118	0.0968	0.1925
Loa Loa (eye worm)	multidrug resistance protein 3	0.0096	0.0729	0.3969
Schistosoma mansoni	multidrug resistance protein	0.0096	0.0729	0.3474
Echinococcus multilocularis	ATP binding cassette subfamily B (MDR:TAP)	0.0096	0.0729	0.3438
Entamoeba histolytica	ATP-binding cassette protein, putative	0.003	0.0011	0.0011
Loa Loa (eye worm)	hypothetical protein	0.003	0.0011	0.0062
Entamoeba histolytica	P-glycoprotein 6, putative	0.003	0.0011	0.0011
Mycobacterium ulcerans	component linked with the assembly of cytochrome transport transmembrane ATP-binding protein ABC transporter CydD	0.003	0.0011	0.5
Entamoeba histolytica	P-glycoprotein-2	0.0096	0.0729	0.0729
Brugia malayi	multidrug resistance protein 3	0.0096	0.0729	0.753
Trichomonas vaginalis	multidrug resistance protein 1, 2, putative	0.0096	0.0729	0.753
Mycobacterium ulcerans	transmembrane ABC transporter ATP-binding protein	0.003	0.0011	0.5
Entamoeba histolytica	P-glycoprotein-1	0.0096	0.0729	0.0729
Trichomonas vaginalis	abcb9, putative	0.0096	0.0729	0.753
Echinococcus multilocularis	multidrug resistance protein 1	0.0096	0.0729	0.3438
Echinococcus granulosus	ATP binding cassette sub family B	0.003	0.0011	0.0054
Schistosoma mansoni	thyroid hormone receptor	0.0154	0.1357	0.647
Trypanosoma brucei	sphingomyelin/ceramide phosphorylethanolamine synthase, bifunctional	0.0488	0.4978	1
Brugia malayi	Phosphatidylinositol 3- and 4-kinase family protein	0.0118	0.0968	1
Trichomonas vaginalis	ATP-binding cassette transporter, putative	0.0096	0.0729	0.753
Trichomonas vaginalis	ABC transporter, putative	0.0096	0.0729	0.753
Trichomonas vaginalis	ABC transporter, half transporter, putative	0.0096	0.0729	0.753
Loa Loa (eye worm)	ATP-binding cassette sub-family B member 2	0.0096	0.0729	0.3969
Loa Loa (eye worm)	hypothetical protein	0.0077	0.0516	0.2809
Echinococcus multilocularis	ATP binding cassette subfamily B (MDR:TAP)	0.0096	0.0729	0.3438
Giardia lamblia	ABC transporter, putative	0.003	0.0011	0.0375
Trichomonas vaginalis	phosphatidylinositol 3-kinase class, putative	0.004	0.0114	0.1178
Loa Loa (eye worm)	hypothetical protein	0.0051	0.0243	0.1326
Schistosoma mansoni	multidrug resistance protein	0.003	0.0011	0.0054
Plasmodium falciparum	sphingomyelin synthase 2, putative	0.0051	0.0243	0.3235
Trypanosoma brucei	ceramide phosphorylethanolamine synthase	0.0051	0.0243	0.0467
Trichomonas vaginalis	ABC transporter, half transporter, putative	0.0096	0.0729	0.753
Echinococcus granulosus	multidrug resistance protein 1	0.0096	0.0729	0.3474
Giardia lamblia	MRP-like ABC transporter	0.003	0.0011	0.0375
Trichomonas vaginalis	lipid A export ATP-binding/permease protein msba, putative	0.0096	0.0729	0.753
Trichomonas vaginalis	ATP-binding cassette transporter, putative	0.0067	0.0413	0.4272
Brugia malayi	hypothetical protein	0.003	0.0011	0.0118
Trichomonas vaginalis	lipid A export ATP-binding/permease protein msba, putative	0.0096	0.0729	0.753

Activities

Activity type	Activity value	Assay description	Source	Reference
IC50 (binding)	< 0.5 nM	Inhibition of recombinant PI3Kalpha (unknown origin)-mediated 3,4,5-inositoltriphosphate formation after 30 mins by TAMRA-PIP3-based competitive fluorescence polarization assay	ChEMBL.	23265894
IC50 (binding)	= 0.02 uM	Inhibition of PI3Kalpha-mediated AKT Ser 473 phosphorylation in human PC3 cells	ChEMBL.	23265894

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: CHEMBL2322763

Bibliographic References

1 literature reference was collected for this gene.

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Detailed information for compound 1726548