TDR Targets

Basic information

Technical information

TDR Targets ID: 1074419
Name: 4-methyl-6-phenyl-3,6-dihydro-1H-pyrimidine-2 -thione
MW: 204.291 | Formula: C11H12N2S
H donors: 2 H acceptors: 0 LogP: 2.04 Rotable bonds: 1
Rule of 5 violations (Lipinski): 1
SMILES: S=C1NC(=CC(N1)c1ccccc1)C
InChi: 1S/C11H12N2S/c1-8-7-10(13-11(14)12-8)9-5-3-2-4-6-9/h2-7,10H,1H3,(H2,12,13,14)
InChiKey: KHCZLACEZABOFR-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

6-Methyl-4-phenyl-3,4-dihydro-1H-pyrimidine-2-thione
BAS 00428710
MLS000561814
SMR000174974
6-Methyl-4-phenyl-3,4-dihydro-2(1H)-pyrimidinethione
Pyrimidin-2(1H)-thione, 3,4-dihydro-6-methyl-4-phenyl-

Targets

Known targets for this compound

Species	Target name	Source	Bibliographic reference
Bacillus subtilis	4'-phosphopantetheinyl transferase ffp	Starlite/ChEMBL	No references
Homo sapiens	aldehyde dehydrogenase 1 family, member A1	Starlite/ChEMBL	No references
Homo sapiens	polo-like kinase 1	Starlite/ChEMBL	No references
Homo sapiens	hydroxyprostaglandin dehydrogenase 15-(NAD)	Starlite/ChEMBL	No references
Mus musculus	RAR-related orphan receptor gamma	Starlite/ChEMBL	No references

Predicted pathogen targets for this compound

By orthology

Species	Potential target	Known druggable target/s	Ortholog Group
Schistosoma japonicum	Serine/threonine-protein kinase PLK1, putative	Get druggable targets OG5_127396	All targets in OG5_127396
Mycobacterium ulcerans	aldehyde dehydrogenase	Get druggable targets OG5_126638	All targets in OG5_126638
Mycobacterium ulcerans	aldehyde dehydrogenase	Get druggable targets OG5_126638	All targets in OG5_126638
Echinococcus granulosus	aldehyde dehydrogenase mitochondrial	Get druggable targets OG5_126638	All targets in OG5_126638
Schistosoma japonicum	expressed protein	Get druggable targets OG5_129301	All targets in OG5_129301
Giardia lamblia	Kinase, PLK	Get druggable targets OG5_127396	All targets in OG5_127396
Onchocerca volvulus	Serine\/threonine kinase homolog	Get druggable targets OG5_127396	All targets in OG5_127396
Candida albicans	Mitochondrial aldehyde dehydrogenase	Get druggable targets OG5_126638	All targets in OG5_126638
Leishmania braziliensis	aldehyde dehydrogenase, mitochondrial precursor	Get druggable targets OG5_126638	All targets in OG5_126638
Leishmania major	aldehyde dehydrogenase, mitochondrial precursor	Get druggable targets OG5_126638	All targets in OG5_126638
Leishmania mexicana	protein kinase, putative,polo-like protein kinase, putative	Get druggable targets OG5_127396	All targets in OG5_127396
Trypanosoma cruzi	polo-like protein kinase, putative	Get druggable targets OG5_127396	All targets in OG5_127396
Trypanosoma brucei	polo-like protein kinase	Get druggable targets OG5_127396	All targets in OG5_127396
Trichomonas vaginalis	CAMK family protein kinase	Get druggable targets OG5_127396	All targets in OG5_127396
Trypanosoma cruzi	polo-like protein kinase, putative	Get druggable targets OG5_127396	All targets in OG5_127396
Loa Loa (eye worm)	PLK/PLK1 protein kinase	Get druggable targets OG5_127396	All targets in OG5_127396
Schistosoma mansoni	aminoadipate-semialdehyde dehydrogenase	Get druggable targets OG5_129301	All targets in OG5_129301
Schistosoma japonicum	Aldehyde dehydrogenase, mitochondrial precursor, putative	Get druggable targets OG5_126638	All targets in OG5_126638
Schistosoma japonicum	Aldehyde dehydrogenase X, mitochondrial precursor, putative	Get druggable targets OG5_126638	All targets in OG5_126638
Leishmania infantum	protein kinase, putative,polo-like protein kinase, putative	Get druggable targets OG5_127396	All targets in OG5_127396
Schistosoma mansoni	serine/threonine protein kinase	Get druggable targets OG5_127396	All targets in OG5_127396
Echinococcus multilocularis	aldehyde dehydrogenase, mitochondrial	Get druggable targets OG5_126638	All targets in OG5_126638
Onchocerca volvulus		Get druggable targets OG5_129301	All targets in OG5_129301
Echinococcus granulosus	L aminoadipate semialdehyde	Get druggable targets OG5_129301	All targets in OG5_129301
Trichomonas vaginalis	CAMK family protein kinase	Get druggable targets OG5_127396	All targets in OG5_127396
Brugia malayi	serine/threonine-protein kinase plk-2	Get druggable targets OG5_127396	All targets in OG5_127396
Trypanosoma brucei gambiense	polo-like protein kinase,protein kinase	Get druggable targets OG5_127396	All targets in OG5_127396
Schistosoma japonicum	ko:K00128 aldehyde dehydrogenase (NAD+) [EC1.2.1.3], putative	Get druggable targets OG5_126638	All targets in OG5_126638
Candida albicans	aldehyde dehydrogenase	Get druggable targets OG5_126638	All targets in OG5_126638
Cryptosporidium hominis	proteinx0005	Get druggable targets OG5_129301	All targets in OG5_129301
Trichomonas vaginalis	CAMK family protein kinase	Get druggable targets OG5_127396	All targets in OG5_127396
Schistosoma japonicum	ko:K00142 aminoadipate-semialdehyde dehydrogenase [EC1.2.1.31], putative	Get druggable targets OG5_129301	All targets in OG5_129301
Trichomonas vaginalis	CAMK family protein kinase	Get druggable targets OG5_127396	All targets in OG5_127396
Leishmania braziliensis	protein kinase, putative,polo-like protein kinase, putative	Get druggable targets OG5_127396	All targets in OG5_127396
Schistosoma japonicum	ko:K06631 polo-like kinase 1, putative	Get druggable targets OG5_127396	All targets in OG5_127396
Leishmania major	protein kinase, putative,polo-like protein kinase, putative	Get druggable targets OG5_127396	All targets in OG5_127396
Trichomonas vaginalis	CAMK family protein kinase	Get druggable targets OG5_127396	All targets in OG5_127396
Leishmania infantum	aldehyde dehydrogenase, mitochondrial precursor	Get druggable targets OG5_126638	All targets in OG5_126638
Echinococcus granulosus	serine:threonine protein kinase PLK1	Get druggable targets OG5_127396	All targets in OG5_127396
Leishmania mexicana	aldehyde dehydrogenase, mitochondrial precursor	Get druggable targets OG5_126638	All targets in OG5_126638
Schistosoma japonicum	Retinal dehydrogenase 1, putative	Get druggable targets OG5_126638	All targets in OG5_126638
Loa Loa (eye worm)	hypothetical protein	Get druggable targets OG5_129301	All targets in OG5_129301
Candida albicans	protein serine/threonine kinase	Get druggable targets OG5_127396	All targets in OG5_127396
Leishmania donovani	aldehyde dehydrogenase, mitochondrial precursor	Get druggable targets OG5_126638	All targets in OG5_126638
Brugia malayi	aminoadipate-semialdehyde dehydrogenase-phosphopantetheinyl transferase	Get druggable targets OG5_129301	All targets in OG5_129301
Trichomonas vaginalis	CAMK family protein kinase	Get druggable targets OG5_127396	All targets in OG5_127396
Echinococcus multilocularis	L aminoadipate semialdehyde	Get druggable targets OG5_129301	All targets in OG5_129301
Trichomonas vaginalis	CAMK family protein kinase	Get druggable targets OG5_127396	All targets in OG5_127396
Trichomonas vaginalis	CAMK family protein kinase	Get druggable targets OG5_127396	All targets in OG5_127396
Neospora caninum	hypothetical protein	Get druggable targets OG5_126638	All targets in OG5_126638
Schistosoma mansoni	aldehyde dehydrogenase	Get druggable targets OG5_126638	All targets in OG5_126638
Candida albicans	protein serine/threonine kinase	Get druggable targets OG5_127396	All targets in OG5_127396
Cryptosporidium parvum	phosphopantetheinyl transferase	Get druggable targets OG5_129301	All targets in OG5_129301
Candida albicans	Mitochondrial aldehyde dehydrogenase	Get druggable targets OG5_126638	All targets in OG5_126638
Toxoplasma gondii	aldehyde dehydrogenase	Get druggable targets OG5_126638	All targets in OG5_126638
Mycobacterium tuberculosis	Probable aldehyde dehydrogenase	Get druggable targets OG5_126638	All targets in OG5_126638
Candida albicans	aldehyde dehydrogenase	Get druggable targets OG5_126638	All targets in OG5_126638
Schistosoma mansoni	aldehyde dehydrogenase	Get druggable targets OG5_126638	All targets in OG5_126638
Trichomonas vaginalis	CAMK family protein kinase	Get druggable targets OG5_127396	All targets in OG5_127396
Echinococcus multilocularis	serine:threonine protein kinase PLK1	Get druggable targets OG5_127396	All targets in OG5_127396
Entamoeba histolytica	serine/threonine protein kinase, putative	Get druggable targets OG5_127396	All targets in OG5_127396
Mycobacterium ulcerans	aldehyde dehydrogenase	Get druggable targets OG5_126638	All targets in OG5_126638
Trypanosoma congolense	protein kinase, putative	Get druggable targets OG5_127396	All targets in OG5_127396

By sequence similarity to non orthologous known druggable targets

Species	Potential target	Known druggable target	Length	Alignment span	Identity
Candida albicans	aminoadipate-semialdehyde dehydrogenase small subunit	4'-phosphopantetheinyl transferase ffp	224 aa	183 aa	27.3 %
Plasmodium falciparum	steroid dehydrogenase, putative	hydroxyprostaglandin dehydrogenase 15-(NAD)	266 aa	216 aa	22.2 %
Mycobacterium tuberculosis	Succinate-semialdehyde dehydrogenase [NADP+] dependent (SSDH) GabD1	aldehyde dehydrogenase 1 family, member A1	501 aa	456 aa	33.3 %
Onchocerca volvulus		4'-phosphopantetheinyl transferase ffp	224 aa	186 aa	26.3 %
Entamoeba histolytica	hypothetical protein	4'-phosphopantetheinyl transferase ffp	224 aa	198 aa	28.3 %
Trichomonas vaginalis	conserved hypothetical protein	4'-phosphopantetheinyl transferase ffp	224 aa	197 aa	22.3 %
Candida albicans	aminoadipate-semialdehyde dehydrogenase small subunit	4'-phosphopantetheinyl transferase ffp	224 aa	183 aa	27.3 %

Ranking Plot

Putative Targets List

Species	Potential target	Raw	Global	Species
Echinococcus multilocularis	peptide (allatostatin:somatostatin)	0.0021	0.082	0.0876
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0021	0.082	0.0876
Echinococcus granulosus	growth hormone secretagogue receptor type 1	0.0021	0.082	0.0876
Onchocerca volvulus		0.0021	0.082	0.0876
Echinococcus granulosus	rhodopsin orphan GPCR	0.0021	0.082	0.0876
Loa Loa (eye worm)	follicle stimulating hormone receptor	0.0021	0.082	0.0876
Loa Loa (eye worm)	hypothetical protein	0.0021	0.082	0.0876
Loa Loa (eye worm)	hypothetical protein	0.0017	0.0515	0.0432
Trichomonas vaginalis	CAMK family protein kinase	0.0114	0.7096	1
Onchocerca volvulus		0.0021	0.082	0.0876
Echinococcus multilocularis	pyroglutamylated rfamide peptide receptor	0.0021	0.082	0.0876
Schistosoma mansoni	ubiquitously transcribed sex (X/Y) chromosome tetratricopeptide repeat protein-related	0.0017	0.0515	0.0432
Schistosoma mansoni	growth hormone secretagogue receptor	0.0021	0.082	0.0876
Schistosoma mansoni	opsin-like receptor	0.0021	0.082	0.0876
Echinococcus granulosus	dro:myosuppressin receptor	0.0021	0.082	0.0876
Echinococcus granulosus	rhodopsin orphan GPCR	0.0021	0.082	0.0876
Giardia lamblia	Kinase, PLK	0.0114	0.7096	0.5
Echinococcus granulosus	Transcription factor JmjC domain containing protein	0.0062	0.3597	0.4913
Loa Loa (eye worm)	hypothetical protein	0.0021	0.082	0.0876
Loa Loa (eye worm)	hypothetical protein	0.0021	0.082	0.0876
Schistosoma mansoni	jumonji domain containing protein	0.0062	0.3597	0.4913
Leishmania major	phosphopantetheinyl transferase-like protein	0.0028	0.1301	0.1194
Schistosoma mansoni	peptide (FMRFamide/somatostatin)-like receptor	0.0021	0.082	0.0876
Brugia malayi	sulfakinin receptor protein	0.0021	0.082	0.0876
Brugia malayi	Serotonin/octopamine receptor family protein 7	0.0021	0.082	0.0876
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0048	0.2663	0.3555
Chlamydia trachomatis	holo [acyl-carrier protein] synthase	0.0028	0.1301	0.5
Echinococcus multilocularis	G-protein coupled receptor, putative	0.0021	0.082	0.0876
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0021	0.082	0.0876
Echinococcus granulosus	neuropeptide receptor A26	0.0021	0.082	0.0876
Loa Loa (eye worm)	hypothetical protein	0.0021	0.082	0.0876
Loa Loa (eye worm)	hypothetical protein	0.0021	0.082	0.0876
Brugia malayi	AKH receptor	0.0021	0.082	0.0876
Echinococcus granulosus	fmrfamide receptor	0.0021	0.082	0.0876
Loa Loa (eye worm)	hypothetical protein	0.0021	0.082	0.0876
Echinococcus multilocularis	orexin receptor type 2	0.0021	0.082	0.0876
Schistosoma mansoni	peptide (allatostatin/somatostatin)-like receptor	0.0021	0.082	0.0876
Loa Loa (eye worm)	G-protein coupled receptor	0.0021	0.082	0.0876
Onchocerca volvulus		0.0021	0.082	0.0876
Echinococcus granulosus	rhodopsin orphan GPCR	0.0021	0.082	0.0876
Schistosoma mansoni	neuropeptide receptor	0.0021	0.082	0.0876
Loa Loa (eye worm)	hypothetical protein	0.0021	0.082	0.0876
Brugia malayi	Dopamine receptor protein 1, putative (partial)	0.0021	0.082	0.0876
Echinococcus granulosus	serine:threonine protein kinase PLK1	0.0114	0.7096	1
Schistosoma mansoni	hypothetical protein	0.0021	0.082	0.0876
Echinococcus multilocularis	Jumonji, AT rich interactive domain 1B	0.0017	0.0515	0.0432
Loa Loa (eye worm)	hypothetical protein	0.0021	0.082	0.0876
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0048	0.2663	0.3555
Toxoplasma gondii	4'-phosphopantetheinyl transferase superfamily protein	0.0028	0.1301	0.2051
Echinococcus multilocularis	neuropeptide receptor	0.0021	0.082	0.0876
Onchocerca volvulus		0.0021	0.082	0.0876
Schistosoma mansoni	neuropeptide F-like receptor	0.0021	0.082	0.0876
Schistosoma mansoni	serine/threonine protein kinase	0.0114	0.7096	1
Schistosoma mansoni	thyrotropin-releasing hormone receptor	0.0021	0.082	0.0876
Plasmodium falciparum	holo-[acyl-carrier-protein] synthase, putative	0.0028	0.1301	1
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0021	0.082	0.0876
Loa Loa (eye worm)	hypothetical protein	0.0021	0.082	0.0876
Echinococcus multilocularis	Transcription factor, JmjC domain containing protein	0.0062	0.3597	0.4913
Loa Loa (eye worm)	5-hydroxytryptamine 2C receptor	0.0021	0.082	0.0876
Echinococcus granulosus	g protein linked acetylcholine receptor gar 2a	0.0021	0.082	0.0876
Echinococcus granulosus	rhodopsin orphan GPCR	0.0021	0.082	0.0876
Echinococcus granulosus	neuropeptides capa receptor	0.0021	0.082	0.0876
Onchocerca volvulus		0.01	0.6173	0.8658
Echinococcus granulosus	tm gpcr rhodopsin	0.0021	0.082	0.0876
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0021	0.082	0.0876
Loa Loa (eye worm)	hypothetical protein	0.0021	0.082	0.0876
Schistosoma mansoni	neuropeptide receptor	0.0021	0.082	0.0876
Trichomonas vaginalis	CAMK family protein kinase	0.0114	0.7096	1
Echinococcus multilocularis	neuropeptide receptor A26	0.0021	0.082	0.0876
Echinococcus granulosus	peptide allatostatin:somatostatin	0.0021	0.082	0.0876
Echinococcus multilocularis	g protein coupled receptor	0.0021	0.082	0.0876
Brugia malayi	Tachykinin-like peptides receptor 99D	0.0021	0.082	0.0876
Brugia malayi	jmjC domain containing protein	0.0017	0.0515	0.0432
Brugia malayi	Serotonin receptor	0.0021	0.082	0.0876
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0021	0.082	0.0876
Schistosoma mansoni	amine GPCR	0.0021	0.082	0.0876
Echinococcus multilocularis	jumonji domain containing 1A	0.0017	0.0515	0.0432
Brugia malayi	hypothetical protein	0.0021	0.082	0.0876
Loa Loa (eye worm)	hypothetical protein	0.01	0.6173	0.8658
Echinococcus multilocularis	neuropeptide receptor	0.0021	0.082	0.0876
Brugia malayi	ORL1-like opioid receptor	0.0021	0.082	0.0876
Echinococcus multilocularis	serotonin receptor	0.0021	0.082	0.0876
Schistosoma mansoni	biogenic amine receptor	0.0021	0.082	0.0876
Mycobacterium ulcerans	phosphopantetheinyl transferase, PptII	0.0028	0.1301	0.1301
Echinococcus granulosus	sex peptide receptor	0.0021	0.082	0.0876
Brugia malayi	RE15519p	0.0021	0.082	0.0876
Schistosoma mansoni	peptide (FMRFamide/neurokinin-3)-like receptor	0.0021	0.082	0.0876
Loa Loa (eye worm)	hypothetical protein	0.0021	0.082	0.0876
Onchocerca volvulus		0.0021	0.082	0.0876
Schistosoma mansoni	hypothetical protein	0.0021	0.082	0.0876
Echinococcus granulosus	phd:f box containing protein	0.0017	0.0515	0.0432
Schistosoma mansoni	phosphatidylserine receptor	0.0017	0.0515	0.0432
Schistosoma mansoni	biogenic amine (5HT) receptor	0.0021	0.082	0.0876
Loa Loa (eye worm)	hypothetical protein	0.0021	0.082	0.0876
Loa Loa (eye worm)	hypothetical protein	0.0021	0.082	0.0876
Loa Loa (eye worm)	hypothetical protein	0.0021	0.082	0.0876
Brugia malayi	putative neuropeptide receptor	0.0021	0.082	0.0876
Echinococcus granulosus	g protein coupled receptor	0.0021	0.082	0.0876
Echinococcus multilocularis	G protein coupled 5 hydroxytryptamine receptor	0.0021	0.082	0.0876
Schistosoma mansoni	opsin-like receptor	0.0021	0.082	0.0876
Brugia malayi	follicle stimulating hormone receptor	0.0021	0.082	0.0876
Schistosoma mansoni	protein phosphatase 2C	0.0017	0.0515	0.0432
Echinococcus multilocularis	lysine specific demethylase 5A	0.0062	0.3597	0.4913
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0048	0.2663	0.3555
Brugia malayi	G protein-coupled receptor F59B2.13	0.0021	0.082	0.0876
Onchocerca volvulus		0.0021	0.082	0.0876
Echinococcus multilocularis	phd:f box containing protein	0.0017	0.0515	0.0432
Loa Loa (eye worm)	hypothetical protein	0.0021	0.082	0.0876
Echinococcus granulosus	g protein linked acetylcholine receptor gar 2a	0.0021	0.082	0.0876
Echinococcus granulosus	biogenic amine 5HT receptor	0.0021	0.082	0.0876
Brugia malayi	Serotonin receptor	0.0021	0.082	0.0876
Echinococcus granulosus	7TM GPCR rhodopsin	0.0021	0.082	0.0876
Echinococcus multilocularis	fmrfamide receptor	0.0021	0.082	0.0876
Loa Loa (eye worm)	jmjC domain-containing protein	0.0062	0.3597	0.4913
Echinococcus multilocularis	g protein coupled receptor	0.0021	0.082	0.0876
Schistosoma mansoni	myosin xvIII	0.0021	0.082	0.0876
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0021	0.082	0.0876
Mycobacterium ulcerans	aldehyde dehydrogenase	0.0073	0.4345	0.4345
Brugia malayi	GnHR receptor homolog	0.0021	0.082	0.0876
Echinococcus multilocularis	JmjC domain containing protein 4	0.0017	0.0515	0.0432
Loa Loa (eye worm)	G-protein-linked acetylcholine receptor protein 2	0.0021	0.082	0.0876
Echinococcus granulosus	neuropeptide Y receptor	0.0021	0.082	0.0876
Brugia malayi	hypothetical protein	0.0021	0.082	0.0876
Echinococcus granulosus	lysine specific demethylase 6a	0.0017	0.0515	0.0432
Onchocerca volvulus		0.0021	0.082	0.0876
Schistosoma mansoni	histamine h1 receptor	0.0021	0.082	0.0876
Loa Loa (eye worm)	hypothetical protein	0.0021	0.082	0.0876
Brugia malayi	Melatonin receptor type 1A	0.0021	0.082	0.0876
Schistosoma mansoni	peptide (allatostatin)-like receptor	0.0021	0.082	0.0876
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0048	0.2663	0.3555
Schistosoma mansoni	biogenic amine (octopamine/dopamine) receptor	0.0021	0.082	0.0876
Schistosoma mansoni	aminoadipate-semialdehyde dehydrogenase	0.01	0.6173	0.8658
Brugia malayi	hypothetical protein	0.0021	0.082	0.0876
Loa Loa (eye worm)	hypothetical protein	0.0021	0.082	0.0876
Brugia malayi	jmjC domain containing protein	0.0017	0.0515	0.0432
Loa Loa (eye worm)	hypothetical protein	0.0021	0.082	0.0876
Plasmodium vivax	holo-[acyl-carrier-protein] synthase, putative	0.0028	0.1301	1
Echinococcus multilocularis	g protein linked acetylcholine receptor gar 2a	0.0021	0.082	0.0876
Brugia malayi	G-protein-linked acetylcholine receptor protein 2, putative	0.0021	0.082	0.0876
Echinococcus granulosus	hypothetical protein	0.0021	0.082	0.0876
Loa Loa (eye worm)	hypothetical protein	0.0021	0.082	0.0876
Schistosoma mansoni	jumonji/arid domain-containing protein	0.0062	0.3597	0.4913
Echinococcus granulosus	g protein coupled receptor	0.0021	0.082	0.0876
Trichomonas vaginalis	CAMK family protein kinase	0.0114	0.7096	1
Loa Loa (eye worm)	hypothetical protein	0.0021	0.082	0.0876
Echinococcus granulosus	pyroglutamylated rfamide peptide receptor	0.0021	0.082	0.0876
Echinococcus granulosus	rhodopsin orphan GPCR	0.0021	0.082	0.0876
Treponema pallidum	4'-phosphopantetheinyl transferase	0.0028	0.1301	0.5
Echinococcus multilocularis	g-protein coupled receptor	0.0021	0.082	0.0876
Onchocerca volvulus		0.0021	0.082	0.0876
Trichomonas vaginalis	CAMK family protein kinase	0.0114	0.7096	1
Leishmania major	protein kinase, putative,polo-like protein kinase, putative	0.0114	0.7096	1
Echinococcus multilocularis	serotonin receptor	0.0021	0.082	0.0876
Trypanosoma cruzi	polo-like protein kinase, putative	0.0114	0.7096	1
Schistosoma mansoni	jumonji/arid domain-containing protein	0.0062	0.3597	0.4913
Schistosoma mansoni	ancient conserved domain protein 2 (cyclin m2)	0.0021	0.082	0.0876
Schistosoma mansoni	opsin-like receptor	0.0021	0.082	0.0876
Schistosoma mansoni	biogenic amine (dopamine) receptor	0.0021	0.082	0.0876
Loa Loa (eye worm)	jmjC domain-containing protein	0.0017	0.0515	0.0432
Schistosoma mansoni	biogenic amine receptor	0.0021	0.082	0.0876
Brugia malayi	Dopamine receptor protein 2	0.0021	0.082	0.0876
Loa Loa (eye worm)	hypothetical protein	0.0017	0.0515	0.0432
Echinococcus multilocularis	tachykinin peptides receptor 99D	0.0021	0.082	0.0876
Mycobacterium tuberculosis	Probable aldehyde dehydrogenase	0.0073	0.4345	0.4345
Echinococcus granulosus	alpha 1A adrenergic receptor	0.0021	0.082	0.0876
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0048	0.2663	0.3555
Echinococcus granulosus	g protein coupled receptor	0.0021	0.082	0.0876
Schistosoma mansoni	amine GPCR	0.0021	0.082	0.0876
Trichomonas vaginalis	CAMK family protein kinase	0.0114	0.7096	1
Brugia malayi	neuropeptide F receptor	0.0021	0.082	0.0876
Loa Loa (eye worm)	gonadotropin-releasing hormone receptor 2	0.0021	0.082	0.0876
Schistosoma mansoni	muscarinic acetylcholine (GAR) receptor	0.0021	0.082	0.0876
Brugia malayi	neuropeptide F receptor	0.0021	0.082	0.0876
Loa Loa (eye worm)	hypothetical protein	0.0021	0.082	0.0876
Loa Loa (eye worm)	hypothetical protein	0.0021	0.082	0.0876
Brugia malayi	hypothetical protein	0.0021	0.082	0.0876
Echinococcus granulosus	lysine specific demethylase 5A	0.0062	0.3597	0.4913
Toxoplasma gondii	4'-phosphopantetheinyl transferase domain-containing protein	0.0028	0.1301	0.2051
Onchocerca volvulus		0.0021	0.082	0.0876
Echinococcus granulosus	JmjC domain containing protein 4	0.0017	0.0515	0.0432
Loa Loa (eye worm)	hypothetical protein	0.0021	0.082	0.0876
Loa Loa (eye worm)	G-protein coupled receptor	0.0021	0.082	0.0876
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0021	0.082	0.0876
Brugia malayi	G protein-coupled receptor	0.0021	0.082	0.0876
Brugia malayi	jmjC domain containing protein	0.0062	0.3597	0.4913
Onchocerca volvulus		0.0021	0.082	0.0876
Brugia malayi	hypothetical protein	0.0021	0.082	0.0876
Echinococcus granulosus	somatostatin receptor	0.0021	0.082	0.0876
Loa Loa (eye worm)	hypothetical protein	0.0021	0.082	0.0876
Mycobacterium ulcerans	aldehyde dehydrogenase	0.0073	0.4345	0.4345
Schistosoma mansoni	hypothetical protein	0.0021	0.082	0.0876
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0021	0.082	0.0876
Echinococcus granulosus	allatostatin A receptor	0.0021	0.082	0.0876
Brugia malayi	Dopamine receptor	0.0021	0.082	0.0876
Echinococcus granulosus	7tm_1 domain containing protein	0.0021	0.082	0.0876
Mycobacterium tuberculosis	holo-[acyl-carrier protein] synthase AcpS (holo-ACP synthase) (CoA:APO-[ACP]pantetheinephosphotransferase) (CoA:APO-[acyl-carrie	0.0028	0.1301	0.1301
Echinococcus multilocularis	alpha 1A adrenergic receptor	0.0021	0.082	0.0876
Echinococcus multilocularis	growth hormone secretagogue receptor type 1	0.0021	0.082	0.0876
Onchocerca volvulus		0.0021	0.082	0.0876
Loa Loa (eye worm)	hypothetical protein	0.0021	0.082	0.0876
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0021	0.082	0.0876
Loa Loa (eye worm)	hypothetical protein	0.0021	0.082	0.0876
Loa Loa (eye worm)	unidentified vitellogenin-linked transcript protein 6	0.0021	0.082	0.0876
Echinococcus granulosus	serotonin receptor	0.0021	0.082	0.0876
Onchocerca volvulus		0.0021	0.082	0.0876
Brugia malayi	Unidentified vitellogenin-linked transcript protein 6, putative	0.0021	0.082	0.0876
Loa Loa (eye worm)	hypothetical protein	0.0021	0.082	0.0876
Trypanosoma brucei	polo-like protein kinase	0.0114	0.7096	1
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0021	0.082	0.0876
Onchocerca volvulus		0.0021	0.082	0.0876
Echinococcus granulosus	jumonji domain containing 1A	0.0017	0.0515	0.0432
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0021	0.082	0.0876
Loa Loa (eye worm)	GTP-binding regulatory protein Gs alpha-S chain	0.0048	0.2663	0.3555
Onchocerca volvulus		0.0021	0.082	0.0876
Echinococcus multilocularis	tm gpcr rhodopsin gpcr rhodopsin superfamily	0.0021	0.082	0.0876
Echinococcus granulosus	neuropeptide Y receptor	0.0021	0.082	0.0876
Echinococcus granulosus	orexin receptor type 2	0.0021	0.082	0.0876
Brugia malayi	GTP-binding regulatory protein Gs alpha-S chain, putative	0.0048	0.2663	0.3555
Echinococcus multilocularis	L aminoadipate semialdehyde	0.01	0.6173	0.8658
Brugia malayi	serine/threonine-protein kinase plk-2	0.0114	0.7096	1
Mycobacterium ulcerans	4'-phosphopantetheinyl transferase	0.0028	0.1301	0.1301
Schistosoma mansoni	amine GPCR	0.0021	0.082	0.0876
Echinococcus multilocularis	biogenic amine (5HT) receptor	0.0021	0.082	0.0876
Loa Loa (eye worm)	hypothetical protein	0.0021	0.082	0.0876
Onchocerca volvulus	Serine\/threonine kinase homolog	0.0114	0.7096	1
Loa Loa (eye worm)	hypothetical protein	0.0021	0.082	0.0876
Loa Loa (eye worm)	jmjC domain-containing protein	0.0017	0.0515	0.0432
Brugia malayi	putative neuropeptide receptor NPR1	0.0021	0.082	0.0876
Echinococcus multilocularis	tm gpcr rhodopsin gpcr rhodopsin superfamily	0.0021	0.082	0.0876
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0048	0.2663	0.3555
Schistosoma mansoni	neuropeptide receptor	0.0021	0.082	0.0876
Echinococcus multilocularis	lysine specific demethylase 6a	0.0017	0.0515	0.0432
Brugia malayi	larval opioid receptor	0.0021	0.082	0.0876
Schistosoma mansoni	kinase	0.0058	0.3308	0.4493
Loa Loa (eye worm)	hypothetical protein	0.0021	0.082	0.0876
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0021	0.082	0.0876
Loa Loa (eye worm)	jmjC domain-containing protein	0.0017	0.0515	0.0432
Loa Loa (eye worm)	neuropeptide F receptor	0.0021	0.082	0.0876
Echinococcus granulosus	G protein coupled 5 hydroxytryptamine receptor	0.0021	0.082	0.0876
Schistosoma mansoni	aldehyde dehydrogenase	0.0073	0.4345	0.6
Echinococcus multilocularis	tm gpcr rhodopsin gpcr rhodopsin superfamily	0.0021	0.082	0.0876
Echinococcus granulosus	neuropeptide receptor	0.0021	0.082	0.0876
Trypanosoma brucei	hypothetical protein, conserved	0.0028	0.1301	0.1194
Loa Loa (eye worm)	TYRA-2 protein	0.0021	0.082	0.0876
Loa Loa (eye worm)	hypothetical protein	0.0021	0.082	0.0876
Brugia malayi	Dopamine receptor protein 1	0.0021	0.082	0.0876
Loa Loa (eye worm)	hypothetical protein	0.0021	0.082	0.0876
Schistosoma mansoni	peptide (FMRFamide/somatostatin)-like receptor	0.0021	0.082	0.0876
Loa Loa (eye worm)	hypothetical protein	0.0021	0.082	0.0876
Mycobacterium ulcerans	aldehyde dehydrogenase	0.0073	0.4345	0.4345
Onchocerca volvulus	Neuropeptide F receptor homolog	0.0021	0.082	0.0876
Schistosoma mansoni	adenoreceptor	0.0021	0.082	0.0876
Schistosoma mansoni	biogenic amine receptor	0.0021	0.082	0.0876
Echinococcus granulosus	biogenic amine 5HT receptor	0.0021	0.082	0.0876
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0021	0.082	0.0876
Toxoplasma gondii	aldehyde dehydrogenase	0.0073	0.4345	1
Echinococcus multilocularis	g protein coupled receptor	0.0021	0.082	0.0876
Brugia malayi	hypothetical protein	0.0021	0.082	0.0876
Brugia malayi	G-protein coupled receptor	0.0021	0.082	0.0876
Schistosoma mansoni	phd/f-box containing protein	0.0017	0.0515	0.0432
Loa Loa (eye worm)	melatonin receptor type 1A	0.0021	0.082	0.0876
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0021	0.082	0.0876
Brugia malayi	hypothetical protein	0.0021	0.082	0.0876
Entamoeba histolytica	serine/threonine protein kinase, putative	0.0114	0.7096	1
Trypanosoma cruzi	polo-like protein kinase, putative	0.0114	0.7096	1
Echinococcus granulosus	neuropeptide s receptor	0.0021	0.082	0.0876
Brugia malayi	G-protein coupled receptor	0.0021	0.082	0.0876
Schistosoma mansoni	biogenic amine (dopamine) receptor	0.0021	0.082	0.0876
Loa Loa (eye worm)	neuropeptide F receptor	0.0021	0.082	0.0876
Echinococcus multilocularis	neuropeptides capa receptor	0.0021	0.082	0.0876
Echinococcus granulosus	rhodopsin orphan GPCR	0.0021	0.082	0.0876
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0021	0.082	0.0876
Onchocerca volvulus		0.0021	0.082	0.0876
Echinococcus granulosus	neuropeptides capa receptor	0.0021	0.082	0.0876
Brugia malayi	gonadotropin-releasing hormone receptor 2	0.0021	0.082	0.0876
Brugia malayi	hypothetical protein	0.0021	0.082	0.0876
Schistosoma mansoni	biogenic amine (5HT) receptor	0.0021	0.082	0.0876
Echinococcus granulosus	G protein coupled receptor 139	0.0021	0.082	0.0876
Brugia malayi	jmjC domain containing protein	0.0017	0.0515	0.0432
Echinococcus multilocularis	neuropeptide FF receptor 2	0.0021	0.082	0.0876
Loa Loa (eye worm)	hypothetical protein	0.0021	0.082	0.0876
Leishmania major	aldehyde dehydrogenase, mitochondrial precursor	0.0073	0.4345	0.582
Echinococcus multilocularis	neuropeptides capa receptor	0.0021	0.082	0.0876
Echinococcus granulosus	neuropeptide FF receptor 2	0.0021	0.082	0.0876
Schistosoma mansoni	alpha-1 adrenergic receptor	0.0021	0.082	0.0876
Brugia malayi	aminoadipate-semialdehyde dehydrogenase-phosphopantetheinyl transferase	0.01	0.6173	0.8658
Onchocerca volvulus		0.0021	0.082	0.0876
Echinococcus multilocularis	allatostatin A receptor	0.0021	0.082	0.0876
Brugia malayi	hypothetical protein	0.0021	0.082	0.0876
Loa Loa (eye worm)	hypothetical protein	0.0021	0.082	0.0876
Loa Loa (eye worm)	hypothetical protein	0.0021	0.082	0.0876
Loa Loa (eye worm)	hypothetical protein	0.0021	0.082	0.0876
Echinococcus granulosus	neuropeptide receptor	0.0021	0.082	0.0876
Echinococcus granulosus	rhodopsin orphan GPCR	0.0021	0.082	0.0876
Schistosoma mansoni	neuropeptide receptor	0.0021	0.082	0.0876
Loa Loa (eye worm)	PLK/PLK1 protein kinase	0.0114	0.7096	1
Echinococcus multilocularis	neuropeptide Y receptor	0.0021	0.082	0.0876
Schistosoma mansoni	amine GPCR	0.0021	0.082	0.0876
Trichomonas vaginalis	CAMK family protein kinase	0.0114	0.7096	1
Loa Loa (eye worm)	hypothetical protein	0.0021	0.082	0.0876
Schistosoma mansoni	neuropeptide F-like receptor	0.0021	0.082	0.0876
Schistosoma mansoni	neuropeptide f receptor 76f	0.0021	0.082	0.0876
Onchocerca volvulus		0.0021	0.082	0.0876
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0048	0.2663	0.3555
Schistosoma mansoni	biogenic amine (dopamine) receptor	0.0021	0.082	0.0876
Echinococcus granulosus	L aminoadipate semialdehyde	0.01	0.6173	0.8658
Schistosoma mansoni	amine GPCR	0.0021	0.082	0.0876
Echinococcus multilocularis	g protein linked acetylcholine receptor gar 2a	0.0021	0.082	0.0876
Echinococcus multilocularis	thyrotropin releasing hormone receptor	0.0021	0.082	0.0876
Schistosoma mansoni	hypothetical protein	0.0021	0.082	0.0876
Loa Loa (eye worm)	hypothetical protein	0.0021	0.082	0.0876
Schistosoma mansoni	aldehyde dehydrogenase	0.0073	0.4345	0.6
Trichomonas vaginalis	CAMK family protein kinase	0.0114	0.7096	1
Loa Loa (eye worm)	hypothetical protein	0.0021	0.082	0.0876
Mycobacterium leprae	conserved hypothetical protein	0.0028	0.1301	1
Echinococcus multilocularis	neuropeptide s receptor	0.0021	0.082	0.0876
Loa Loa (eye worm)	hypothetical protein	0.0021	0.082	0.0876
Echinococcus granulosus	Jumonji AT rich interactive domain 1B	0.0017	0.0515	0.0432
Echinococcus multilocularis	somatostatin receptor	0.0021	0.082	0.0876
Echinococcus multilocularis	serine:threonine protein kinase PLK1	0.0114	0.7096	1
Echinococcus multilocularis	7TM GPCR, rhodopsin	0.0021	0.082	0.0876
Echinococcus multilocularis	dro:myosuppressin receptor	0.0021	0.082	0.0876
Echinococcus granulosus	thyrotropin releasing hormone receptor	0.0021	0.082	0.0876
Echinococcus multilocularis	G protein coupled receptor 139	0.0021	0.082	0.0876
Echinococcus multilocularis	fmrfamide receptor	0.0021	0.082	0.0876
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0021	0.082	0.0876
Echinococcus granulosus	tachykinin peptides receptor 99D	0.0021	0.082	0.0876
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0021	0.082	0.0876
Loa Loa (eye worm)	hypothetical protein	0.0021	0.082	0.0876
Echinococcus granulosus	tm gpcr rhodopsin	0.0021	0.082	0.0876
Wolbachia endosymbiont of Brugia malayi	4'-phosphopantetheinyl transferase	0.0028	0.1301	0.5
Loa Loa (eye worm)	hypothetical protein	0.0021	0.082	0.0876
Loa Loa (eye worm)	hypothetical protein	0.0017	0.0515	0.0432
Echinococcus multilocularis	aldehyde dehydrogenase, mitochondrial	0.0073	0.4345	0.6
Echinococcus granulosus	g-protein coupled receptor	0.0021	0.082	0.0876
Onchocerca volvulus	Dopamine\/Ecdysteroid receptor homolog	0.0021	0.082	0.0876
Echinococcus multilocularis	neuropeptide Y receptor	0.0021	0.082	0.0876
Brugia malayi	jmjC domain containing protein	0.0062	0.3597	0.4913
Echinococcus granulosus	aldehyde dehydrogenase mitochondrial	0.0073	0.4345	0.6
Echinococcus multilocularis	sex peptide receptor	0.0021	0.082	0.0876
Loa Loa (eye worm)	hypothetical protein	0.0021	0.082	0.0876
Schistosoma mansoni	histamine-responsive GPCR (AAF21638)	0.0021	0.082	0.0876
Brugia malayi	hypothetical protein	0.0021	0.082	0.0876
Loa Loa (eye worm)	hypothetical protein	0.0021	0.082	0.0876
Brugia malayi	jmjC domain containing protein	0.0017	0.0515	0.0432
Echinococcus granulosus	tm gpcr rhodopsin	0.0021	0.082	0.0876
Schistosoma mansoni	jumonji domain containing protein	0.0017	0.0515	0.0432

Activities

Activity type	Activity value	Assay description	Source	Reference
Activity (functional)	= 130 %	Analgesic activity in Webster mouse assessed as normal reaction time at 5 mg/kg, sc after 10-120 mins by hot plate assay relative to valdecoxib	ChEMBL.	19682771
Activity (functional)	= 1.3 s	Analgesic activity in Webster mouse assessed as normal reaction time at 5 mg/kg, sc after 10 mins by hot plate assay relative to valdecoxib	ChEMBL.	19682771
Activity (functional)	= 1.39 s	Analgesic activity in Webster mouse assessed as normal reaction time at 5 mg/kg, sc after 45 mins by hot plate assay relative to valdecoxib	ChEMBL.	19682771
Activity (functional)	= 1.39 s	Analgesic activity in Webster mouse assessed as normal reaction time at 5 mg/kg, sc after 90 mins by hot plate assay relative to valdecoxib	ChEMBL.	19682771
Activity (functional)	= 1.4 s	Analgesic activity in Webster mouse assessed as normal reaction time at 5 mg/kg, sc after 30 mins by hot plate assay relative to valdecoxib	ChEMBL.	19682771
Activity (functional)	= 1.4 s	Analgesic activity in Webster mouse assessed as normal reaction time at 5 mg/kg, sc after 120 mins by hot plate assay relative to valdecoxib	ChEMBL.	19682771
Activity (functional)	= 1.41 s	Analgesic activity in Webster mouse assessed as normal reaction time at 5 mg/kg, sc after 20 mins by hot plate assay relative to valdecoxib	ChEMBL.	19682771
Activity (functional)	= 1.41 s	Analgesic activity in Webster mouse assessed as normal reaction time at 5 mg/kg, sc after 60 mins by hot plate assay relative to valdecoxib	ChEMBL.	19682771
ED50 (functional)	= 32 mg kg-1	Anticonvulsant activity in Webster mouse assessed as protection against yohimbine-HCl-induced clonic seizure at 5 mg/kg, ip administered 30 mins before yohimbine-HCl challenge	ChEMBL.	19682771
Inhibition (binding)		Inhibition of rat seminal vesicles COX-1 using arachidonic acid as substrate at 50 ug/ml preincubated for 5 mins followed by substrate addition after 20 mins by competitive PGE2 EIA method	ChEMBL.	26197159
Inhibition (binding)		Inhibition of sheep placental cotyledons COX-2 using arachidonic acid as substrate at 50 ug/ml preincubated for 5 mins followed by substrate addition after 20 mins by competitive PGE2 EIA method	ChEMBL.	26197159
Inhibition (binding)		Inhibition of COX2 in differentiated human THP1 cells assessed as induction of LPS-induced COX2 gene expression at 50 ug/ml preincubated for 1 hr followed by LPS induction measured after 3 hrs by real-time PCR analysis	ChEMBL.	26197159
Potency (functional)	4.1475 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)	= 7.0795 um	PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Aldehyde Dehydrogenase 1 (ALDH1A1). (Class of assay: confirmatory) [Related pubchem assays: 1030 (qHTS Validation Assay for Inhibitors of aldehyde dehydrogenase 1 (ALDH1A1))]	ChEMBL.	No reference
Potency (functional)	= 11.2202 um	PUBCHEM_BIOASSAY: qHTS for inhibitors of ROR gamma transcriptional activity. (Class of assay: confirmatory)	ChEMBL.	No reference
Potency (functional)	11.9173 uM	PubChem BioAssay. qHTS for Inhibitors of PLK1-PDB (polo-like kinase 1 - polo-box domain): Primary Screen. (Class of assay: confirmatory)	ChEMBL.	No reference
Potency (functional)	= 12.5893 um	PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of HPGD (15-Hydroxyprostaglandin Dehydrogenase). (Class of assay: confirmatory) [Related pubchem assays: 2429 (Confirmation qHTS Assay for Inhibitors of HPGD (15-Hydroxyprostaglandin Dehydrogenase)), 2407 (Probe Development Summary for Inhibitors of HPGD (15-Hydroxyprostaglandin Dehydrogenase)), 2427 (Thermal Shift Assay for Inhibitors of HPGD (15-Hydroxyprostaglandin Dehydrogenase))]	ChEMBL.	No reference
Potency (functional)	= 17.7828 um	PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Bacillus subtilis Sfp phosphopantetheinyl transferase (PPTase). (Class of assay: confirmatory)	ChEMBL.	No reference
Potency (functional)	= 22.3872 um	PUBCHEM_BIOASSAY: qHTS Assay for Identifying the Cell-Membrane Permeable IMPase Inhibitors: Potentiation with Lithium. (Class of assay: confirmatory) [Related pubchem assays: 901 ]	ChEMBL.	No reference
Potency (functional)	= 35.4813 um	PUBCHEM_BIOASSAY: VP16 counterscreen qHTS for inhibitors of ROR gamma transcriptional activity. (Class of assay: confirmatory)	ChEMBL.	No reference
Potency (functional)	= 39.8107 um	PUBCHEM_BIOASSAY: qHTS Assay for Agonists of the Relaxin Receptor RXFP1. (Class of assay: confirmatory)	ChEMBL.	No reference
Potency (functional)	70.7946 uM	PubChem BioAssay. qHTS for Inhibitors of WRN Helicase. (Class of assay: confirmatory)	ChEMBL.	No reference
Potency (functional)	79.4328 uM	PUBCHEM_BIOASSAY: Inhibitors of the vitamin D receptor (VDR): qHTS. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID504855]	ChEMBL.	No reference

Phenotypes

Whole-cell/tissue/organism interactions

Species name	Source	Reference	Is orphan
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: CHEMBL572806

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 1074419