TDR Targets

Basic information

Technical information

TDR Targets ID: 370311
Name: 2-chloro-N-[3-chloro-6-(4-methylpiperazin-1-y l)benzo[b][1,5]benzodiazepin-11-yl]benzamide
MW: 480.389 | Formula: C25H23Cl2N5O
H donors: 1 H acceptors: 1 LogP: 5.01 Rotable bonds: 4
Rule of 5 violations (Lipinski): 1
SMILES: CN1CCN(CC1)C1=Nc2cc(Cl)ccc2N(c2c1cccc2)NC(=O)c1ccccc1Cl
InChi: 1S/C25H23Cl2N5O/c1-30-12-14-31(15-13-30)24-19-7-3-5-9-22(19)32(23-11-10-17(26)16-21(23)28-24)29-25(33)18-6-2-4-8-20(18)27/h2-11,16H,12-15H2,1H3,(H,29,33)
InChiKey: DDNAXKKEJCCHMD-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

2-chloro-N-[3-chloro-6-(4-methyl-1-piperazinyl)-11-benzo[b][1,5]benzodiazepinyl]benzamide
2-chloro-N-[3-chloro-6-(4-methylpiperazino)benzo[b][1,5]benzodiazepin-11-yl]benzamide

Targets

Known targets for this compound

Species	Target name	Source	Bibliographic reference
Homo sapiens	adrenoceptor alpha 2A	Starlite/ChEMBL	References
Homo sapiens	dopamine receptor D1	Starlite/ChEMBL	References
Homo sapiens	dopamine receptor D2	Starlite/ChEMBL	References
Homo sapiens	dopamine receptor D5	Starlite/ChEMBL	References
Homo sapiens	dopamine receptor D4	Starlite/ChEMBL	References
Homo sapiens	5-hydroxytryptamine (serotonin) receptor 2A, G protein-coupled	Starlite/ChEMBL	References

Predicted pathogen targets for this compound

By orthology

Species	Potential target	Known druggable target/s	Ortholog Group
Loa Loa (eye worm)	hypothetical protein	Get druggable targets OG5_134111	All targets in OG5_134111
Schistosoma japonicum	5-hydroxytryptamine receptor 1, putative	Get druggable targets OG5_132667	All targets in OG5_132667
Brugia malayi	Dopamine receptor protein 1	Get druggable targets OG5_134111	All targets in OG5_134111
Schistosoma japonicum	5-hydroxytryptamine receptor, putative	Get druggable targets OG5_132667	All targets in OG5_132667

By sequence similarity to non orthologous known druggable targets

No druggable targets predicted by sequence similarity

Ranking Plot

Putative Targets List

Species	Potential target	Raw	Global	Species
Echinococcus granulosus	neuropeptide FF receptor 2	0.0051	0.0547	0.0547
Plasmodium falciparum	lysine--tRNA ligase	0.0025	0.014	0.0026
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0051	0.0547	0.0547
Echinococcus granulosus	neuropeptide receptor	0.0051	0.0547	0.0547
Echinococcus granulosus	dro:myosuppressin receptor	0.0051	0.0547	0.0547
Loa Loa (eye worm)	neuropeptide F receptor	0.0051	0.0547	0.065
Loa Loa (eye worm)	hypothetical protein	0.0034	0.0277	0.033
Echinococcus granulosus	calcium:calmodulin dependent protein kinase type	0.0035	0.0288	0.0288
Trypanosoma cruzi	hexose transporter, putative	0.0035	0.0295	0.2669
Echinococcus multilocularis	thyrotropin releasing hormone receptor	0.0051	0.0547	0.0547
Trypanosoma brucei	glucose transporter, putative	0.0035	0.0295	0.2669
Brugia malayi	MH2 domain containing protein	0.0114	0.1539	0.1831
Loa Loa (eye worm)	hypothetical protein	0.0051	0.0547	0.065
Leishmania major	glucose transporter/membrane transporter D2, putative	0.0035	0.0295	0.1765
Echinococcus granulosus	sex peptide receptor	0.0051	0.0547	0.0547
Trypanosoma cruzi	hexose transporter	0.0035	0.0295	0.2669
Echinococcus multilocularis	tm gpcr rhodopsin gpcr rhodopsin superfamily	0.0051	0.0547	0.0547
Loa Loa (eye worm)	hypothetical protein	0.0035	0.0288	0.0343
Echinococcus granulosus	solute carrier family 2 facilitated glucose	0.0114	0.1526	0.1526
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0065	0.0757	0.4958
Plasmodium vivax	CDK-related protein kinase 6, putative	0.0482	0.7314	1
Schistosoma mansoni	neuropeptide receptor	0.0051	0.0547	0.3582
Loa Loa (eye worm)	hypothetical protein	0.0051	0.0547	0.065
Brugia malayi	G-protein-linked acetylcholine receptor protein 2, putative	0.0051	0.0547	0.065
Loa Loa (eye worm)	hypothetical protein	0.0051	0.0547	0.065
Echinococcus multilocularis	neuropeptide Y receptor	0.0051	0.0547	0.0547
Echinococcus multilocularis	neuropeptide FF receptor 2	0.0051	0.0547	0.0547
Loa Loa (eye worm)	pigment dispersing factor receptor c	0.0048	0.0492	0.0586
Plasmodium falciparum	hexose transporter	0.0114	0.1526	0.1953
Plasmodium falciparum	protein kinase 7	0.0321	0.4783	0.6481
Loa Loa (eye worm)	hypothetical protein	0.0051	0.0547	0.065
Schistosoma mansoni	phosphatidylinositol 3-and 4-kinase	0.0029	0.0199	0.1307
Plasmodium vivax	lysine--tRNA ligase, putative	0.0025	0.014	0.0026
Schistosoma mansoni	cellular tumor antigen P53	0.0096	0.1243	0.8148
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0029	0.0199	0.1307
Schistosoma mansoni	hypothetical protein	0.0051	0.0547	0.3582
Loa Loa (eye worm)	hypothetical protein	0.0018	0.002	0.0024
Echinococcus multilocularis	dro:myosuppressin receptor	0.0051	0.0547	0.0547
Loa Loa (eye worm)	hypothetical protein	0.0051	0.0547	0.065
Loa Loa (eye worm)	hypothetical protein	0.0551	0.8405	1
Trypanosoma brucei	THT1 - hexose transporter, putative	0.0035	0.0295	0.2669
Loa Loa (eye worm)	gonadotropin-releasing hormone receptor 2	0.0051	0.0547	0.065
Trypanosoma brucei	FAT domain/Rapamycin binding domain/Phosphatidylinositol 3- and 4-kinase, putative	0.0036	0.0309	0.279
Brugia malayi	hypothetical protein	0.0024	0.0121	0.0144
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0051	0.0547	0.3582
Trypanosoma brucei	glucose transporter, putative	0.0035	0.0295	0.2669
Plasmodium vivax	calcium-dependent protein kinase 1, putative	0.0035	0.0289	0.0232
Brugia malayi	G-protein coupled receptor	0.0051	0.0547	0.065
Echinococcus multilocularis	serotonin receptor	0.0051	0.0547	0.0547
Echinococcus granulosus	lysyl tRNA synthetase	0.0025	0.014	0.014
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0065	0.0757	0.4958
Trypanosoma cruzi	prolyl-tRNA synthetase, putative	0.004	0.0366	0.3307
Echinococcus multilocularis	biogenic amine (5HT) receptor	0.0051	0.0547	0.0547
Brugia malayi	Serotonin receptor	0.0051	0.0547	0.065
Plasmodium vivax	calcium-dependent protein kinase 3, putative	0.0035	0.0289	0.0232
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0065	0.0757	0.4958
Echinococcus multilocularis	g protein coupled receptor	0.0051	0.0547	0.0547
Leishmania major	prolyl-tRNA synthetase, putative,bifunctional aminoacyl-tRNA synthetase, putative	0.004	0.0366	0.2483
Plasmodium falciparum	protein kinase 6	0.0482	0.7314	1
Onchocerca volvulus		0.0096	0.1243	1
Giardia lamblia	GTOR	0.0087	0.1106	1
Loa Loa (eye worm)	hypothetical protein	0.0051	0.0547	0.065
Loa Loa (eye worm)	hypothetical protein	0.0051	0.0547	0.065
Echinococcus multilocularis	calcium:calmodulin dependent protein kinase type	0.0035	0.0288	0.0288
Brugia malayi	G protein-coupled receptor	0.0051	0.0547	0.065
Loa Loa (eye worm)	MH2 domain-containing protein	0.0114	0.1539	0.1831
Trypanosoma brucei	calcium/calmodulin-dependent protein kinase, putative	0.0035	0.0288	0.2606
Echinococcus multilocularis	fmrfamide receptor	0.0051	0.0547	0.0547
Brugia malayi	Dopamine receptor	0.0051	0.0547	0.065
Toxoplasma gondii	non-specific serine/threonine protein kinase	0.0018	0.0029	0.0062
Trypanosoma brucei	bifunctional aminoacyl-tRNA synthetase, putative	0.004	0.0366	0.3307
Leishmania major	phosphatidylinositol 3-kinase, putative	0.0029	0.0199	0.0793
Brugia malayi	hypothetical protein	0.0051	0.0547	0.065
Echinococcus granulosus	rhodopsin orphan GPCR	0.0051	0.0547	0.0547
Loa Loa (eye worm)	hypothetical protein	0.0018	0.0029	0.0035
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0065	0.0757	0.4958
Mycobacterium leprae	Possible lysyl-tRNA synthetase 2 LysX	0.0025	0.014	0.3046
Plasmodium falciparum	calcium-dependent protein kinase 4	0.0035	0.0289	0.0232
Trichomonas vaginalis	prolyl-tRNA synthetase, putative	0.0034	0.0277	0.1816
Echinococcus granulosus	somatostatin receptor	0.0051	0.0547	0.0547
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0051	0.0549	0.3598
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0047	0.0478	0.3129
Echinococcus granulosus	General substrate transporter	0.0098	0.1275	0.1275
Schistosoma mansoni	ataxia telangiectasia mutated (atm)-related	0.0087	0.1106	0.7249
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0051	0.0547	0.3582
Loa Loa (eye worm)	hypothetical protein	0.0051	0.0547	0.065
Loa Loa (eye worm)	hypothetical protein	0.0096	0.1243	0.1479
Trypanosoma brucei	glucose transporter 2A	0.0035	0.0295	0.2669
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0051	0.0547	0.0547
Loa Loa (eye worm)	hypothetical protein	0.0051	0.0547	0.065
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0029	0.0199	0.1307
Echinococcus multilocularis	neuropeptide Y receptor	0.0051	0.0547	0.0547
Trypanosoma brucei	glucose transporter, putative	0.0035	0.0295	0.2669
Echinococcus granulosus	peptide allatostatin:somatostatin	0.0051	0.0547	0.0547
Entamoeba histolytica	hypothetical protein	0.0035	0.0293	0.2645
Brugia malayi	hypothetical protein	0.0051	0.0547	0.065
Schistosoma mansoni	glucose transport protein	0.0114	0.1526	1
Brugia malayi	hypothetical protein	0.0051	0.0547	0.065
Echinococcus multilocularis	solute carrier family 2 facilitated glucose	0.0114	0.1526	0.1526
Entamoeba histolytica	protein kinase, putative	0.0035	0.0288	0.2606
Echinococcus multilocularis	fmrfamide receptor	0.0051	0.0547	0.0547
Loa Loa (eye worm)	hypothetical protein	0.0051	0.0547	0.065
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0051	0.0547	0.0547
Echinococcus multilocularis	tumor protein p63	0.0653	1	1
Brugia malayi	gonadotropin-releasing hormone receptor 2	0.0051	0.0547	0.065
Schistosoma mansoni	neuropeptide F-like receptor	0.0051	0.0547	0.3582
Echinococcus multilocularis	glutamyl tRNA synthetase cytoplasmic	0.0034	0.0277	0.0277
Schistosoma mansoni	biogenic amine (5HT) receptor	0.0051	0.0547	0.3582
Plasmodium vivax	mitogen-activated protein kinase 2, putative	0.0183	0.2625	0.3481
Loa Loa (eye worm)	hypothetical protein	0.0051	0.0547	0.065
Trichomonas vaginalis	sugar transporter, putative	0.0035	0.0295	0.1935
Schistosoma mansoni	glucose transport protein	0.0114	0.1526	1
Trypanosoma cruzi	Phosphatidylinositol 3-kinase tor2	0.0087	0.1106	1
Mycobacterium tuberculosis	Lysyl-tRNA synthetase 2 LysX	0.0022	0.008	0.5
Schistosoma mansoni	neuropeptide receptor	0.0051	0.0547	0.3582
Plasmodium falciparum	calcium-dependent protein kinase 3	0.0035	0.0289	0.0232
Brugia malayi	neuropeptide F receptor	0.0051	0.0547	0.065
Schistosoma mansoni	lysyl-tRNA synthetase	0.0025	0.014	0.0919
Brugia malayi	Unidentified vitellogenin-linked transcript protein 6, putative	0.0051	0.0547	0.065
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0051	0.0547	0.0547
Schistosoma mansoni	histamine-responsive GPCR (AAF21638)	0.0051	0.0547	0.3582
Echinococcus granulosus	calcium:calmodulin dependent protein kinase type 1	0.0035	0.0288	0.0288
Trypanosoma brucei	THT1 - hexose transporter, putative	0.0035	0.0295	0.2669
Toxoplasma gondii	protein kinase, putative	0.0321	0.4783	1
Echinococcus granulosus	tachykinin peptides receptor 99D	0.0051	0.0547	0.0547
Brugia malayi	lysyl-tRNA synthetase	0.0025	0.014	0.0167
Echinococcus granulosus	rhodopsin orphan GPCR	0.0051	0.0547	0.0547
Trichomonas vaginalis	conserved hypothetical protein	0.0018	0.0029	0.0193
Trypanosoma cruzi	PAB1-binding protein , putative	0.0024	0.0121	0.1097
Schistosoma mansoni	protein kinase	0.0035	0.0288	0.1889
Schistosoma mansoni	amine GPCR	0.0051	0.0547	0.3582
Echinococcus multilocularis	tachykinin peptides receptor 99D	0.0051	0.0547	0.0547
Echinococcus multilocularis	orexin receptor type 2	0.0051	0.0547	0.0547
Loa Loa (eye worm)	follicle stimulating hormone receptor	0.0051	0.0547	0.065
Trypanosoma brucei	phosphatidylinositol 3-related kinase, putative	0.0029	0.0199	0.1803
Schistosoma mansoni	neuropeptide receptor	0.0051	0.0547	0.3582
Schistosoma mansoni	protein kinase	0.0035	0.0288	0.1889
Trypanosoma brucei	glucose transporter, putative	0.0035	0.0295	0.2669
Loa Loa (eye worm)	hypothetical protein	0.0051	0.0547	0.065
Leishmania major	glucose transporter, lmgt3	0.0035	0.0295	0.1765
Trypanosoma cruzi	prolyl-tRNA synthetase, putative	0.004	0.0366	0.3307
Trypanosoma brucei	PAB1-binding protein , putative	0.0024	0.0121	0.1097
Loa Loa (eye worm)	hypothetical protein	0.0028	0.0177	0.021
Echinococcus multilocularis	neuropeptides capa receptor	0.0051	0.0547	0.0547
Mycobacterium ulcerans	lysyl-tRNA synthetase	0.0025	0.014	0.5
Brugia malayi	hypothetical protein	0.0035	0.0293	0.0348
Schistosoma mansoni	peptide (FMRFamide/neurokinin-3)-like receptor	0.0051	0.0547	0.3582
Echinococcus granulosus	survival motor neuron protein 1	0.0457	0.6921	0.6921
Brugia malayi	GnHR receptor homolog	0.0051	0.0547	0.065
Loa Loa (eye worm)	hypothetical protein	0.0051	0.0547	0.065
Plasmodium falciparum	calcium-dependent protein kinase 5	0.0035	0.0289	0.0232
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0052	0.0557	0.3651
Schistosoma mansoni	neuropeptide receptor	0.0051	0.0547	0.3582
Echinococcus granulosus	calcium:calmodulin dependent protein kinase type	0.0035	0.0288	0.0288
Trichomonas vaginalis	CAMK family protein kinase	0.0035	0.0288	0.1889
Echinococcus multilocularis	FKBP12 rapamycin complex associated protein	0.0087	0.1106	0.1106
Echinococcus multilocularis	neuropeptide receptor	0.0051	0.0547	0.0547
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0051	0.0547	0.3582
Echinococcus granulosus	g-protein coupled receptor	0.0051	0.0547	0.0547
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0065	0.0757	0.4958
Schistosoma mansoni	amine GPCR	0.0051	0.0547	0.3582
Schistosoma mansoni	adenoreceptor	0.0051	0.0547	0.3582
Loa Loa (eye worm)	G-protein coupled receptor	0.0051	0.0547	0.065
Echinococcus multilocularis	solute carrier family 2, facilitated glucose	0.0114	0.1526	0.1526
Echinococcus granulosus	neuropeptide s receptor	0.0051	0.0547	0.0547
Loa Loa (eye worm)	TYRA-2 protein	0.0051	0.0547	0.065
Echinococcus granulosus	tm gpcr rhodopsin	0.0051	0.0547	0.0547
Loa Loa (eye worm)	hypothetical protein	0.0051	0.0547	0.065
Schistosoma mansoni	peptide (FMRFamide/somatostatin)-like receptor	0.0051	0.0547	0.3582
Entamoeba histolytica	protein kinase, putative	0.0035	0.0288	0.2606
Echinococcus granulosus	rhodopsin orphan GPCR	0.0051	0.0547	0.0547
Echinococcus granulosus	G protein coupled 5 hydroxytryptamine receptor	0.0051	0.0547	0.0547
Echinococcus granulosus	rhodopsin orphan GPCR	0.0051	0.0547	0.0547
Plasmodium vivax	hexose transporter	0.0114	0.1526	0.1953
Loa Loa (eye worm)	hypothetical protein	0.0051	0.0547	0.065
Brugia malayi	Dopamine receptor protein 2	0.0051	0.0547	0.065
Leishmania major	glucose transporter, lmgt1	0.0035	0.0295	0.1765
Loa Loa (eye worm)	hypothetical protein	0.0051	0.0547	0.065
Loa Loa (eye worm)	hypothetical protein	0.0051	0.0547	0.065
Chlamydia trachomatis	lysine--tRNA ligase	0.0025	0.014	0.5
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0052	0.0557	0.3651
Loa Loa (eye worm)	hypothetical protein	0.0051	0.0547	0.065
Echinococcus multilocularis	growth hormone secretagogue receptor type 1	0.0051	0.0547	0.0547
Brugia malayi	Serotonin/octopamine receptor family protein 7	0.0051	0.0547	0.065
Schistosoma mansoni	biogenic amine receptor	0.0051	0.0547	0.3582
Schistosoma mansoni	glutamyl-tRNA synthetase cytoplasmic (glutamate--tRNA ligase) (glurs)	0.0034	0.0277	0.1816
Echinococcus granulosus	solute carrier family 2 facilitated glucose	0.0114	0.1526	0.1526
Echinococcus multilocularis	g protein coupled receptor	0.0051	0.0547	0.0547
Brugia malayi	bifunctional aminoacyl-tRNA synthetase	0.0034	0.0277	0.033
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0029	0.0199	0.1307
Leishmania major	protein kinase, putative	0.0035	0.0288	0.1694
Loa Loa (eye worm)	hypothetical protein	0.0051	0.0547	0.065
Trypanosoma cruzi	Phosphatidylinositol 3-kinase tor1	0.0087	0.1106	1
Echinococcus multilocularis	serotonin receptor	0.0051	0.0547	0.0547
Brugia malayi	hypothetical protein	0.0051	0.0547	0.065
Loa Loa (eye worm)	hypothetical protein	0.0051	0.0547	0.065
Leishmania major	target of rapamycin (TOR) kinase 1, putative	0.0087	0.1106	1
Echinococcus multilocularis	pyroglutamylated rfamide peptide receptor	0.0051	0.0547	0.0547
Echinococcus granulosus	neuropeptides capa receptor	0.0051	0.0547	0.0547
Trypanosoma brucei	phosphatidylinositol 4-kinase, putative	0.0087	0.1106	1
Echinococcus granulosus	phosphatidylinositol 3 and 4 kinase	0.0029	0.0199	0.0199
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0051	0.0547	0.0547
Trichomonas vaginalis	sugar transporter, putative	0.0035	0.0295	0.1935
Toxoplasma gondii	lysine-tRNA ligase	0.0025	0.014	0.0293
Brugia malayi	Calcium/calmodulin-dependent protein kinase type II alpha chain	0.0035	0.0288	0.0343
Leishmania major	glucose transporter, lmgt2	0.0035	0.0295	0.1765
Brugia malayi	Calcitonin receptor-like protein seb-1	0.0048	0.0492	0.0586
Echinococcus granulosus	neuropeptide Y receptor	0.0051	0.0547	0.0547
Loa Loa (eye worm)	hypothetical protein	0.0051	0.0547	0.065
Schistosoma mansoni	growth hormone secretagogue receptor	0.0051	0.0547	0.3582
Trypanosoma brucei	glucose transporter, putative	0.0035	0.0295	0.2669
Loa Loa (eye worm)	hypothetical protein	0.0051	0.0547	0.065
Echinococcus granulosus	thyrotropin releasing hormone receptor	0.0051	0.0547	0.0547
Trichomonas vaginalis	conserved hypothetical protein	0.0035	0.0295	0.1935
Schistosoma mansoni	opsin-like receptor	0.0051	0.0547	0.3582
Loa Loa (eye worm)	hypothetical protein	0.0034	0.0277	0.033
Trypanosoma cruzi	PAB1-binding protein , putative	0.0024	0.0121	0.1097
Schistosoma mansoni	amine GPCR	0.0051	0.0547	0.3582
Loa Loa (eye worm)	hypothetical protein	0.0051	0.0547	0.065
Echinococcus multilocularis	tm gpcr rhodopsin gpcr rhodopsin superfamily	0.0051	0.0547	0.0547
Loa Loa (eye worm)	hypothetical protein	0.0033	0.0255	0.0303
Echinococcus granulosus	biogenic amine 5HT receptor	0.0051	0.0547	0.0547
Trypanosoma cruzi	phosphatidylinositol 3-related kinase, putative	0.0029	0.0199	0.1803
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0069	0.0827	0.542
Loa Loa (eye worm)	hypothetical protein	0.0048	0.0492	0.0586
Brugia malayi	hypothetical protein	0.0051	0.0547	0.065
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0029	0.0199	0.1307
Loa Loa (eye worm)	hypothetical protein	0.0051	0.0547	0.065
Trypanosoma brucei	lysyl-tRNA synthetase, putative	0.0025	0.014	0.1267
Echinococcus multilocularis	peptide (allatostatin:somatostatin)	0.0051	0.0547	0.0547
Echinococcus multilocularis	calcium:calmodulin dependent protein kinase type	0.0035	0.0288	0.0288
Schistosoma mansoni	glucose transport protein	0.0114	0.1526	1
Schistosoma mansoni	ancient conserved domain protein 2 (cyclin m2)	0.0051	0.0547	0.3582
Brugia malayi	Melatonin receptor type 1A	0.0051	0.0547	0.065
Trichomonas vaginalis	glucose transporter, putative	0.0035	0.0295	0.1935
Schistosoma mansoni	neuropeptide F-like receptor	0.0051	0.0547	0.3582
Trypanosoma brucei	target of rapamycin kinase 3, putative	0.0069	0.0828	0.7487
Plasmodium falciparum	calcium-dependent protein kinase 1	0.0035	0.0289	0.0232
Trypanosoma cruzi	hexose transporter, putative	0.0019	0.0044	0.0401
Echinococcus granulosus	g protein coupled receptor	0.0051	0.0547	0.0547
Toxoplasma gondii	cell-cycle-associated protein kinase MAPK, putative	0.0183	0.2625	0.5488
Loa Loa (eye worm)	hypothetical protein	0.0051	0.0547	0.065
Toxoplasma gondii	prolyl-tRNA synthetase (ProRS)	0.004	0.0366	0.0765
Loa Loa (eye worm)	G-protein-linked acetylcholine receptor protein 2	0.0051	0.0547	0.065
Echinococcus multilocularis	survival motor neuron protein 1	0.0457	0.6921	0.6921
Brugia malayi	Dopamine receptor protein 1	0.0551	0.8405	1
Brugia malayi	Phosphatidylinositol 3- and 4-kinase family protein	0.0087	0.1106	0.1316
Trypanosoma cruzi	lysyl-tRNA synthetase, putative	0.0025	0.014	0.1267
Leishmania major	target of rapamycin (TOR) kinase 2, putative	0.0087	0.1106	1
Schistosoma mansoni	hypothetical protein	0.0033	0.0255	0.167
Trichomonas vaginalis	lysyl-tRNA synthetase, putative	0.0025	0.014	0.0919
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0087	0.1106	0.7249
Leishmania major	prolyl-tRNA synthetase, putative,bifunctional aminoacyl-tRNA synthetase, putative	0.004	0.0366	0.2483
Brugia malayi	putative neuropeptide receptor	0.0051	0.0547	0.065
Trypanosoma brucei	glucose transporter 1E	0.0035	0.0295	0.2669
Echinococcus multilocularis	Basic leucine zipper (bZIP) transcription	0.0035	0.0293	0.0293
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0069	0.0827	0.542
Schistosoma mansoni	hypothetical protein	0.0093	0.1206	0.7904
Schistosoma mansoni	amine GPCR	0.0051	0.0547	0.3582
Toxoplasma gondii	facilitative glucose transporter GT1	0.0114	0.1526	0.3191
Brugia malayi	hypothetical protein	0.0457	0.6921	0.8235
Schistosoma mansoni	hypothetical protein	0.0051	0.0547	0.3582
Loa Loa (eye worm)	hypothetical protein	0.0024	0.0121	0.0144
Loa Loa (eye worm)	hypothetical protein	0.0051	0.0547	0.065
Echinococcus multilocularis	General substrate transporter	0.0098	0.1275	0.1275
Brugia malayi	hypothetical protein	0.0051	0.0547	0.065
Brugia malayi	hypothetical protein	0.0051	0.0547	0.065
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0065	0.0757	0.4958
Echinococcus multilocularis	somatostatin receptor	0.0051	0.0547	0.0547
Loa Loa (eye worm)	hypothetical protein	0.0051	0.0547	0.065
Toxoplasma gondii	calcium-dependent protein kinase CDPK2A	0.0035	0.0289	0.0603
Echinococcus multilocularis	neuropeptide s receptor	0.0051	0.0547	0.0547
Schistosoma mansoni	alpha-1 adrenergic receptor	0.0051	0.0547	0.3582
Schistosoma mansoni	biogenic amine (dopamine) receptor	0.0051	0.0547	0.3582
Echinococcus granulosus	growth hormone secretagogue receptor type 1	0.0051	0.0547	0.0547
Leishmania major	target of rapamycin kinase (TOR) kinase 3	0.0069	0.0828	0.7177
Toxoplasma gondii	target of rapamycin (TOR), putative	0.0065	0.0757	0.1582
Plasmodium falciparum	mitogen-activated protein kinase 2	0.0183	0.2625	0.3481
Brugia malayi	Phosphatidylinositol 3- and 4-kinase family protein	0.0029	0.0199	0.0237
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0047	0.0478	0.3129
Schistosoma mansoni	glutamyl-tRNA synthetase cytoplasmic (glutamate--tRNA ligase) (glurs)	0.0034	0.0277	0.1816
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0074	0.0907	0.5942
Toxoplasma gondii	calcium-dependent protein kinase CDPK2B	0.0035	0.0289	0.0603
Loa Loa (eye worm)	hypothetical protein	0.0051	0.0547	0.065
Echinococcus multilocularis	phosphatidylinositol 3 and 4 kinase	0.0029	0.0199	0.0199
Schistosoma mansoni	biogenic amine receptor	0.0051	0.0547	0.3582
Entamoeba histolytica	hypothetical protein	0.0035	0.0293	0.2645
Entamoeba histolytica	hypothetical protein	0.0035	0.0293	0.2645
Echinococcus multilocularis	sex peptide receptor	0.0051	0.0547	0.0547
Brugia malayi	Sugar transporter family protein	0.0114	0.1526	0.1816
Mycobacterium leprae	Probable prolyl tRNA synthetase ProS	0.0034	0.0277	1
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0023	0.0108	0.0708
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0051	0.0547	0.0547
Schistosoma mansoni	serine/threonine protein kinase	0.0035	0.0288	0.1889
Echinococcus granulosus	rhodopsin orphan GPCR	0.0051	0.0547	0.0547
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0069	0.0827	0.542
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0051	0.0547	0.3582
Loa Loa (eye worm)	hypothetical protein	0.0051	0.0547	0.065
Echinococcus granulosus	rhodopsin orphan GPCR	0.0051	0.0547	0.0547
Echinococcus granulosus	biogenic amine 5HT receptor	0.0051	0.0547	0.0547
Brugia malayi	ORL1-like opioid receptor	0.0051	0.0547	0.065
Echinococcus granulosus	Basic leucine zipper bZIP transcription	0.0035	0.0293	0.0293
Trypanosoma brucei	THT1 - hexose transporter, putative	0.0035	0.0295	0.2669
Loa Loa (eye worm)	hypothetical protein	0.0051	0.0547	0.065
Plasmodium vivax	proline--tRNA ligase, putative	0.004	0.0366	0.034
Schistosoma mansoni	peptide (allatostatin)-like receptor	0.0051	0.0547	0.3582
Brugia malayi	Bifunctional aminoacyl-tRNA synthetase	0.0034	0.0277	0.033
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0047	0.0479	0.3137
Trichomonas vaginalis	conserved hypothetical protein	0.0114	0.1526	1
Schistosoma mansoni	muscarinic acetylcholine (GAR) receptor	0.0051	0.0547	0.3582
Brugia malayi	neuropeptide F receptor	0.0051	0.0547	0.065
Echinococcus granulosus	g protein linked acetylcholine receptor gar 2a	0.0051	0.0547	0.0547
Echinococcus multilocularis	solute carrier family 2 facilitated glucose	0.0114	0.1526	0.1526
Schistosoma mansoni	opsin-like receptor	0.0051	0.0547	0.3582
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0087	0.1106	0.7249
Echinococcus multilocularis	G protein coupled 5 hydroxytryptamine receptor	0.0051	0.0547	0.0547
Echinococcus granulosus	G protein coupled receptor 139	0.0051	0.0547	0.0547
Loa Loa (eye worm)	hypothetical protein	0.0457	0.6921	0.8235
Entamoeba histolytica	FKBP-rapamycin associated protein (FRAP), putative	0.0087	0.1106	1
Echinococcus multilocularis	calcium:calmodulin dependent protein kinase type	0.0035	0.0288	0.0288
Loa Loa (eye worm)	hypothetical protein	0.0051	0.0547	0.065
Echinococcus granulosus	calcium:calmodulin dependent protein kinase type	0.0035	0.0288	0.0288
Brugia malayi	follicle stimulating hormone receptor	0.0051	0.0547	0.065
Loa Loa (eye worm)	CAMK/CAMK2 protein kinase	0.0035	0.0288	0.0343
Echinococcus multilocularis	7TM GPCR, rhodopsin	0.0051	0.0547	0.0547
Schistosoma mansoni	thyrotropin-releasing hormone receptor	0.0051	0.0547	0.3582
Brugia malayi	Tachykinin-like peptides receptor 99D	0.0051	0.0547	0.065
Echinococcus granulosus	alpha 1A adrenergic receptor	0.0051	0.0547	0.0547
Entamoeba histolytica	hypothetical protein	0.0025	0.014	0.1267
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0058	0.0657	0.4306
Echinococcus granulosus	g protein coupled receptor	0.0051	0.0547	0.0547
Trypanosoma cruzi	target of rapamycin kinase 3	0.0069	0.0828	0.7487
Schistosoma mansoni	hypothetical protein	0.0114	0.1526	1
Loa Loa (eye worm)	phosphatidylinositol 3	0.0029	0.0199	0.0237
Schistosoma mansoni	hypothetical protein	0.0051	0.0547	0.3582
Echinococcus granulosus	orexin receptor type 2	0.0051	0.0547	0.0547
Loa Loa (eye worm)	melatonin receptor type 1A	0.0051	0.0547	0.065
Trypanosoma cruzi	hexose transporter, putative	0.0035	0.0295	0.2669
Echinococcus granulosus	rhodopsin orphan GPCR	0.0051	0.0547	0.0547
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0047	0.0479	0.3137
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0069	0.0827	0.542
Echinococcus granulosus	solute carrier family 2 facilitated glucose	0.0114	0.1526	0.1526
Trypanosoma cruzi	hexose transporter, putative	0.0035	0.0295	0.2669
Schistosoma mansoni	protein kinase	0.0035	0.0288	0.1889
Loa Loa (eye worm)	hypothetical protein	0.0051	0.0547	0.065
Trichomonas vaginalis	conserved hypothetical protein	0.0035	0.0295	0.1935
Loa Loa (eye worm)	5-hydroxytryptamine 2C receptor	0.0051	0.0547	0.065
Giardia lamblia	Prolyl-tRNA synthetase	0.0034	0.0277	0.1418
Trypanosoma brucei	glucose transporter, putative	0.0035	0.0295	0.2669
Brugia malayi	larval opioid receptor	0.0051	0.0547	0.065
Loa Loa (eye worm)	transcription factor SMAD2	0.0114	0.1539	0.1831
Trypanosoma brucei	glucose transporter, putative	0.0035	0.0295	0.2669
Loa Loa (eye worm)	hypothetical protein	0.0051	0.0547	0.065
Brugia malayi	Cam kinase protein 1	0.0035	0.0288	0.0343
Echinococcus multilocularis	G protein coupled receptor 139	0.0051	0.0547	0.0547
Leishmania major	phosphatidylinositol 3-related kinase, putative	0.0029	0.0199	0.0793
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0051	0.0547	0.3582
Loa Loa (eye worm)	hypothetical protein	0.0051	0.0547	0.065
Echinococcus granulosus	tm gpcr rhodopsin	0.0051	0.0547	0.0547
Echinococcus granulosus	FKBP12 rapamycin complex associated protein	0.0087	0.1106	0.1106
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0065	0.0757	0.4958
Loa Loa (eye worm)	hypothetical protein	0.0051	0.0547	0.065
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0047	0.0478	0.3129
Schistosoma mansoni	biogenic amine receptor	0.0051	0.0547	0.3582
Schistosoma mansoni	survival motor neuron protein	0.0093	0.1206	0.7904
Echinococcus granulosus	neuropeptides capa receptor	0.0051	0.0547	0.0547
Loa Loa (eye worm)	hypothetical protein	0.0051	0.0547	0.065
Loa Loa (eye worm)	hypothetical protein	0.0051	0.0547	0.065
Brugia malayi	hypothetical protein	0.0051	0.0547	0.065
Schistosoma mansoni	neuropeptide f receptor 76f	0.0051	0.0547	0.3582
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0029	0.0199	0.1307
Trichomonas vaginalis	sugar transporter, putative	0.0035	0.0295	0.1935
Brugia malayi	hypothetical protein	0.0051	0.0547	0.065
Echinococcus multilocularis	solute carrier family 2 facilitated glucose	0.0114	0.1526	0.1526
Schistosoma mansoni	peptide (allatostatin/somatostatin)-like receptor	0.0051	0.0547	0.3582
Trypanosoma brucei	glucose transporter, putative	0.0035	0.0295	0.2669
Schistosoma mansoni	histamine h1 receptor	0.0051	0.0547	0.3582
Mycobacterium ulcerans	lysyl-tRNA synthetase	0.0025	0.014	0.5
Echinococcus granulosus	allatostatin A receptor	0.0051	0.0547	0.0547
Brugia malayi	G-protein coupled receptor	0.0051	0.0547	0.065
Trypanosoma brucei	phosphatidylinositol 3-kinase tor, putative	0.0041	0.0387	0.35
Schistosoma mansoni	amine GPCR	0.0051	0.0547	0.3582
Echinococcus granulosus	neuropeptide Y receptor	0.0051	0.0547	0.0547
Schistosoma mansoni	peptide (FMRFamide/somatostatin)-like receptor	0.0051	0.0547	0.3582
Echinococcus granulosus	neuropeptide receptor	0.0051	0.0547	0.0547
Mycobacterium tuberculosis	Lysyl-tRNA synthetase 1 LysS (lysine--tRNA ligase 1) (LysRS 1) (lysine translase)	0.0022	0.008	0.5
Loa Loa (eye worm)	hypothetical protein	0.0051	0.0547	0.065
Brugia malayi	sulfakinin receptor protein	0.0051	0.0547	0.065
Schistosoma mansoni	myosin xvIII	0.0051	0.0547	0.3582
Loa Loa (eye worm)	phosphatidylinositol 3	0.0087	0.1106	0.1316
Brugia malayi	Serotonin receptor	0.0051	0.0547	0.065
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0087	0.1106	0.7249
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0051	0.0547	0.3582
Leishmania major	lysyl-tRNA synthetase, putative	0.0025	0.014	0.0191
Echinococcus multilocularis	g-protein coupled receptor	0.0051	0.0547	0.0547
Echinococcus multilocularis	lysyl tRNA synthetase	0.0025	0.014	0.014
Brugia malayi	putative neuropeptide receptor NPR1	0.0051	0.0547	0.065
Plasmodium falciparum	calcium-dependent protein kinase 2	0.0035	0.0289	0.0232
Echinococcus granulosus	7TM GPCR rhodopsin	0.0051	0.0547	0.0547
Loa Loa (eye worm)	hypothetical protein	0.0051	0.0547	0.065
Brugia malayi	hypothetical protein	0.0051	0.0547	0.065
Brugia malayi	Iron-sulfur cluster assembly accessory protein	0.0093	0.1206	0.1435
Echinococcus multilocularis	calcium:calmodulin dependent protein kinase type	0.0035	0.0288	0.0288
Loa Loa (eye worm)	sugar transporter	0.0114	0.1526	0.1816
Loa Loa (eye worm)	neuropeptide F receptor	0.0051	0.0547	0.065
Entamoeba histolytica	phosphatidylinositol3-kinaseTor2, putative	0.0087	0.1106	1
Echinococcus granulosus	neuropeptide receptor A26	0.0051	0.0547	0.0547
Schistosoma mansoni	biogenic amine (5HT) receptor	0.0051	0.0547	0.3582
Trypanosoma brucei	Phosphatidylinositol 3-kinase tor1	0.0087	0.1106	1
Loa Loa (eye worm)	G-protein coupled receptor	0.0051	0.0547	0.065
Schistosoma mansoni	lysyl-tRNA synthetase	0.0025	0.014	0.0919
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0051	0.0547	0.0547
Plasmodium falciparum	proline--tRNA ligase	0.004	0.0366	0.034
Toxoplasma gondii	LsmAD domain-containing protein	0.0024	0.0121	0.0254
Echinococcus multilocularis	neuropeptide receptor A26	0.0051	0.0547	0.0547
Brugia malayi	RE15519p	0.0051	0.0547	0.065
Echinococcus multilocularis	tm gpcr rhodopsin gpcr rhodopsin superfamily	0.0051	0.0547	0.0547
Echinococcus multilocularis	neuropeptide receptor	0.0051	0.0547	0.0547
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0051	0.0547	0.3582
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0052	0.0557	0.3651
Echinococcus granulosus	g protein linked acetylcholine receptor gar 2a	0.0051	0.0547	0.0547
Loa Loa (eye worm)	unidentified vitellogenin-linked transcript protein 6	0.0051	0.0547	0.065
Trichomonas vaginalis	glucose transporter, putative	0.0035	0.0295	0.1935
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0051	0.0547	0.3582
Echinococcus granulosus	tm gpcr rhodopsin	0.0051	0.0547	0.0547
Trypanosoma brucei	phosphatidylinositol 3-kinase, putative	0.0029	0.0199	0.1803
Plasmodium vivax	calcium-dependent protein kinase 4, putative	0.0035	0.0289	0.0232
Echinococcus multilocularis	g protein coupled receptor	0.0051	0.0547	0.0547
Echinococcus granulosus	hypothetical protein	0.0051	0.0547	0.0547
Toxoplasma gondii	calcium-dependent protein kinase CDPK3	0.0035	0.0289	0.0603
Schistosoma mansoni	biogenic amine (dopamine) receptor	0.0051	0.0547	0.3582
Echinococcus multilocularis	neuropeptides capa receptor	0.0051	0.0547	0.0547
Brugia malayi	latrophilin 2 splice variant baaae	0.0033	0.0255	0.0303
Schistosoma mansoni	biogenic amine (dopamine) receptor	0.0051	0.0547	0.3582
Brugia malayi	AKH receptor	0.0051	0.0547	0.065
Echinococcus granulosus	pyroglutamylated rfamide peptide receptor	0.0051	0.0547	0.0547
Schistosoma mansoni	hypothetical protein	0.0051	0.0547	0.3582
Loa Loa (eye worm)	calcium/calmodulin-dependent protein kinase ID	0.0035	0.0288	0.0343
Echinococcus multilocularis	calcium dependent protein kinase	0.0033	0.0254	0.0254
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0047	0.0479	0.3137
Plasmodium vivax	calcium-dependent protein kinase, putative	0.0035	0.0289	0.0232
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0051	0.0549	0.3598
Echinococcus multilocularis	allatostatin A receptor	0.0051	0.0547	0.0547
Echinococcus granulosus	calcium dependent protein kinase	0.0033	0.0254	0.0254
Loa Loa (eye worm)	hypothetical protein	0.0051	0.0547	0.065
Loa Loa (eye worm)	hypothetical protein	0.0051	0.0547	0.065
Schistosoma mansoni	hypothetical protein	0.0035	0.0293	0.1918
Echinococcus granulosus	fmrfamide receptor	0.0051	0.0547	0.0547
Entamoeba histolytica	prolyl-tRNA synthetase, putative	0.0034	0.0277	0.2506
Trypanosoma cruzi	phosphatidylinositol 3-related kinase, putative	0.0029	0.0199	0.1803
Brugia malayi	Dopamine receptor protein 1, putative (partial)	0.0051	0.0547	0.065
Brugia malayi	G protein-coupled receptor F59B2.13	0.0051	0.0547	0.065
Entamoeba histolytica	hypothetical protein	0.0035	0.0293	0.2645
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0069	0.0827	0.542
Brugia malayi	Corticotropin releasing factor receptor 2 precursor, putative	0.0048	0.0492	0.0586
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0047	0.0479	0.3137
Echinococcus multilocularis	alpha 1A adrenergic receptor	0.0051	0.0547	0.0547
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0051	0.0547	0.3582
Onchocerca volvulus		0.0093	0.1206	0.9466
Echinococcus multilocularis	G-protein coupled receptor, putative	0.0051	0.0547	0.0547
Schistosoma mansoni	opsin-like receptor	0.0051	0.0547	0.3582
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0051	0.0547	0.0547
Echinococcus granulosus	solute carrier family 2 facilitated glucose	0.0114	0.1526	0.1526
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0056	0.0628	0.4113
Trichomonas vaginalis	lysyl-tRNA synthetase, putative	0.0022	0.0091	0.0597
Echinococcus granulosus	serotonin receptor	0.0051	0.0547	0.0547
Schistosoma mansoni	transcription factor LCR-F1	0.0035	0.0293	0.1918
Echinococcus granulosus	g protein coupled receptor	0.0051	0.0547	0.0547
Loa Loa (eye worm)	hypothetical protein	0.0051	0.0547	0.065
Echinococcus granulosus	7tm_1 domain containing protein	0.0051	0.0547	0.0547
Echinococcus granulosus	glutamyl tRNA synthetase cytoplasmic	0.0034	0.0277	0.0277
Loa Loa (eye worm)	hypothetical protein	0.0051	0.0547	0.065
Loa Loa (eye worm)	hypothetical protein	0.0025	0.014	0.0167
Echinococcus multilocularis	g protein linked acetylcholine receptor gar 2a	0.0051	0.0547	0.0547
Echinococcus multilocularis	g protein linked acetylcholine receptor gar 2a	0.0051	0.0547	0.0547
Schistosoma mansoni	biogenic amine (octopamine/dopamine) receptor	0.0051	0.0547	0.3582
Loa Loa (eye worm)	hypothetical protein	0.0051	0.0547	0.065

Activities

Activity type	Activity value	Assay description	Source	Reference
Activity (functional)	0	Activity at dopamine D1 receptor by cAMP assay	ChEMBL.	16809034
AUC (ADMET)	= 2656 ng.hr/ml	AUC in Sprague-Dawley rat plasma at 10 mg/kg, po	ChEMBL.	16809034
Cmax (ADMET)	= 821 ng/ml	Cmax in Sprague-Dawley rat plasma at 10 mg/kg, po	ChEMBL.	16809034
Kb (functional)	= 2.8 nM	Activity at dopamine D1 receptor by cAMP assay	ChEMBL.	16809034
Kb (functional)	= 2.8 nM	Activity at dopamine D1 receptor by cAMP assay	ChEMBL.	16809034
Ki (binding)	= 1 nM	Binding affinity at 5HT2A receptor	ChEMBL.	16809034
Ki (binding)	= 1 nM	Binding affinity at 5HT2A receptor	ChEMBL.	16809034
Ki (binding)	= 4 nM	Displacement of [3H]SCH 23390 from human dopamine D1 receptor expressed in CHO cells	ChEMBL.	16809034
Ki (binding)	= 4 nM	Displacement of [3H]SCH 23390 from human dopamine D1 receptor expressed in CHO cells	ChEMBL.	16809034
Ki (binding)	= 4.1 nM	Displacement of [3H]SCH 23390 from dopamine D1 receptor expressed in CHO cells	ChEMBL.	16806922
Ki (binding)	= 4.1 nM	Displacement of [3H]SCH 23390 from dopamine D1 receptor expressed in CHO cells	ChEMBL.	16806922
Ki (binding)	= 73 nM	Binding affinity at dopamine D5 receptor	ChEMBL.	16809034
Ki (binding)	= 73 nM	Binding affinity at dopamine D5 receptor	ChEMBL.	16809034
Ki (binding)	= 181 nM	Displacement of [3H]methylspiperone from human dopamine D2 receptor expressed in CHO cells	ChEMBL.	16809034
Ki (binding)	= 181 nM	Binding affinity at dopamine D2 receptor	ChEMBL.	16809034
Ki (binding)	= 181 nM	Displacement of [3H]methylspiperone from dopamine D2 receptor expressed in CHO cells	ChEMBL.	16806922
Ki (binding)	= 181 nM	Displacement of [3H]methylspiperone from human dopamine D2 receptor expressed in CHO cells	ChEMBL.	16809034
Ki (binding)	= 181 nM	Binding affinity at dopamine D2 receptor	ChEMBL.	16809034
Ki (binding)	= 181 nM	Displacement of [3H]methylspiperone from dopamine D2 receptor expressed in CHO cells	ChEMBL.	16806922
Ki (binding)	= 455 nM	Binding affinity at adrenergic alpha2A receptor	ChEMBL.	16809034
Ki (binding)	= 455 nM	Binding affinity at adrenergic alpha2A receptor	ChEMBL.	16809034
Ki (binding)	= 870 nM	Binding affinity at dopamine D4 receptor	ChEMBL.	16809034
Ki (binding)	= 870 nM	Binding affinity at dopamine D4 receptor	ChEMBL.	16809034
Ratio Ki (binding)	= 44	Selectivity for D1 receptor over D2 receptor	ChEMBL.	16806922
Ratio Ki (binding)	= 45	Selectivity for D1 receptor over D2 receptor	ChEMBL.	16809034
Tmax (ADMET)	= 1 hr	Tmax in Sprague-Dawley rat plasma at 10 mg/kg, po	ChEMBL.	16809034

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: CHEMBL212912
PubChem: 16007117

Bibliographic References

2 literature references were collected for this gene.

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Detailed information for compound 370311