TDR Targets

Basic information

Technical information

TDR Targets ID: 1278076
Name: 4-[4-[(3-chloro1-benzothiophene-2-carbonyl)am ino]pyrazol-1-yl]butanoic acid
MW: 363.819 | Formula: C16H14ClN3O3S
H donors: 2 H acceptors: 4 LogP: 2.84 Rotable bonds: 7
Rule of 5 violations (Lipinski): 1
SMILES: OC(=O)CCCn1ncc(c1)NC(=O)c1sc2c(c1Cl)cccc2
InChi: 1S/C16H14ClN3O3S/c17-14-11-4-1-2-5-12(11)24-15(14)16(23)19-10-8-18-20(9-10)7-3-6-13(21)22/h1-2,4-5,8-9H,3,6-7H2,(H,19,23)(H,21,22)
InChiKey: FCVCYIHSMRGXBN-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

4-[4-[(3-chlorobenzothiophene-2-carbonyl)amino]pyrazol-1-yl]butanoic acid
4-[4-[[(3-chloro-2-benzothiophenyl)-oxomethyl]amino]-1-pyrazolyl]butanoic acid
4-[4-[(3-chlorobenzothiophene-2-carbonyl)amino]pyrazol-1-yl]butyric acid
4-[4-[(3-chloro-1-benzothiophen-2-yl)carbonylamino]pyrazol-1-yl]butanoic acid
A3562/0151081

Targets

Known targets for this compound

Species	Target name	Source	Bibliographic reference
Homo sapiens	glucagon-like peptide 1 receptor	Starlite/ChEMBL	No references
Mus musculus	RAR-related orphan receptor gamma	Starlite/ChEMBL	No references

Predicted pathogen targets for this compound

By orthology

No druggable targets predicted by orthology data

By sequence similarity to non orthologous known druggable targets

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

Ranking Plot

Putative Targets List

Species	Potential target	Raw	Global	Species
Echinococcus granulosus	neuropeptide FF receptor 2	0.0039	0.0319	0.0224
Toxoplasma gondii	isocitrate dehydrogenase	0.005	0.0602	1
Brugia malayi	Hypothetical UPF0028 protein ZK370.4 in chromosome III, putative	0.0034	0.0182	0.0182
Brugia malayi	Latrophilin receptor protein 2	0.0123	0.2563	0.2563
Schistosoma mansoni	hypothetical protein	0.0039	0.0319	0.0203
Schistosoma mansoni	voltage-gated potassium channel	0.0075	0.1286	0.1643
Echinococcus granulosus	thyrotropin releasing hormone receptor	0.0039	0.0319	0.0224
Loa Loa (eye worm)	hypothetical protein	0.0039	0.0319	0.0319
Echinococcus granulosus	neuropeptides capa receptor	0.0039	0.0319	0.0224
Echinococcus granulosus	somatostatin receptor	0.0039	0.0319	0.0224
Trypanosoma cruzi	Flagellar Member 6	0.0034	0.0182	0.3028
Echinococcus granulosus	potassium voltage gated channel subfamily H	0.026	0.626	1
Schistosoma mansoni	hypothetical protein	0.0265	0.6398	0.9249
Schistosoma mansoni	cyclic-nucleotide-gated cation channel	0.0051	0.0643	0.0686
Trypanosoma brucei	isocitrate dehydrogenase [NADP], mitochondrial precursor, putative	0.005	0.0602	1
Onchocerca volvulus		0.0039	0.0319	0.0388
Brugia malayi	Corticotropin releasing factor receptor 2 precursor, putative	0.0388	0.9703	0.9703
Loa Loa (eye worm)	hypothetical protein	0.0039	0.0319	0.0319
Loa Loa (eye worm)	hypothetical protein	0.0034	0.0182	0.0182
Loa Loa (eye worm)	G-protein coupled receptor	0.0039	0.0319	0.0319
Brugia malayi	ORL1-like opioid receptor	0.0039	0.0319	0.0319
Brugia malayi	cAMP-dependent protein kinase regulatory chain, putative	0.0034	0.0182	0.0182
Echinococcus multilocularis	NADP dependent isocitrate dehydrogenase	0.005	0.0602	0.0691
Echinococcus multilocularis	isocitrate dehydrogenase 2 (NADP+)	0.005	0.0602	0.0691
Loa Loa (eye worm)	hypothetical protein	0.0039	0.0319	0.0319
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0039	0.0319	0.0224
Echinococcus multilocularis	alpha 1A adrenergic receptor	0.0039	0.0319	0.0224
Echinococcus multilocularis	neuropeptide Y receptor	0.0039	0.0319	0.0224
Loa Loa (eye worm)	hypothetical protein	0.0039	0.0319	0.0319
Loa Loa (eye worm)	neuropeptide F receptor	0.0039	0.0319	0.0319
Schistosoma mansoni	tar DNA-binding protein	0.0203	0.4729	0.6765
Brugia malayi	larval opioid receptor	0.0039	0.0319	0.0319
Brugia malayi	hypothetical protein	0.0039	0.0319	0.0319
Plasmodium vivax	isocitrate dehydrogenase [NADP], mitochondrial, putative	0.005	0.0602	1
Echinococcus multilocularis	cyclic nucleotide gated cation channel alpha 3	0.0051	0.0643	0.0758
Loa Loa (eye worm)	transcription factor SMAD2	0.0399	1	1
Schistosoma mansoni	tar DNA-binding protein	0.0203	0.4729	0.6765
Brugia malayi	Voltage-gated potassium channel, HERG (KCNH2)-related. C. elegans unc-103 ortholog	0.026	0.626	0.626
Onchocerca volvulus		0.0039	0.0319	0.0388
Echinococcus granulosus	sex peptide receptor	0.0039	0.0319	0.0224
Trypanosoma cruzi	cyclic nucleotide-binding domain containing protein, putative	0.0034	0.0182	0.3028
Echinococcus multilocularis	neuropeptides capa receptor	0.0039	0.0319	0.0224
Onchocerca volvulus		0.0039	0.0319	0.0388
Echinococcus multilocularis	g protein linked acetylcholine receptor gar 2a	0.0039	0.0319	0.0224
Trypanosoma cruzi	cAMP response protein 1, putative	0.0034	0.0182	0.3028
Loa Loa (eye worm)	hypothetical protein	0.0039	0.0319	0.0319
Toxoplasma gondii	cyclic nucleotide-binding domain-containing protein	0.0034	0.0182	0.3028
Onchocerca volvulus	Neuropeptide F receptor homolog	0.0039	0.0319	0.0388
Loa Loa (eye worm)	cyclic-nucleotide gated cation channel	0.0051	0.0643	0.0643
Echinococcus multilocularis	dro:myosuppressin receptor	0.0039	0.0319	0.0224
Trichomonas vaginalis	voltage and ligand gated potassium channel, putative	0.0243	0.5799	1
Echinococcus granulosus	alpha 1A adrenergic receptor	0.0039	0.0319	0.0224
Treponema pallidum	catabolite gene activator	0.0034	0.0182	0.5
Brugia malayi	G-protein coupled receptor	0.0039	0.0319	0.0319
Loa Loa (eye worm)	hypothetical protein	0.0265	0.6398	0.6398
Leishmania major	hypothetical protein, unknown function	0.0034	0.0182	0.3028
Echinococcus multilocularis	tm gpcr rhodopsin gpcr rhodopsin superfamily	0.0039	0.0319	0.0224
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0039	0.0319	0.0203
Echinococcus multilocularis	fmrfamide receptor	0.0039	0.0319	0.0224
Loa Loa (eye worm)	G-protein coupled receptor	0.0039	0.0319	0.0319
Echinococcus multilocularis	g-protein coupled receptor	0.0039	0.0319	0.0224
Loa Loa (eye worm)	hypothetical protein	0.0039	0.0319	0.0319
Leishmania major	isocitrate dehydrogenase [NADP], mitochondrial precursor, putative	0.005	0.0602	1
Echinococcus granulosus	rhodopsin orphan GPCR	0.0039	0.0319	0.0224
Leishmania major	cyclic nucleotide-binding protein-like protein	0.0034	0.0182	0.3028
Loa Loa (eye worm)	G-protein-linked acetylcholine receptor protein 2	0.0039	0.0319	0.0319
Echinococcus granulosus	NADP dependent isocitrate dehydrogenase	0.005	0.0602	0.0691
Chlamydia trachomatis	cAMP-dependent protein kinase regulatory subunit	0.0034	0.0182	0.5
Brugia malayi	putative neuropeptide receptor	0.0039	0.0319	0.0319
Leishmania major	protein kinase A regulatory subunit, putative	0.0034	0.0182	0.3028
Echinococcus multilocularis	biogenic amine (5HT) receptor	0.0039	0.0319	0.0224
Trypanosoma brucei	cAMP response protein 1, putative	0.0034	0.0182	0.3028
Loa Loa (eye worm)	unidentified vitellogenin-linked transcript protein 6	0.0039	0.0319	0.0319
Loa Loa (eye worm)	hypothetical protein	0.0123	0.2563	0.2563
Brugia malayi	Serotonin receptor	0.0039	0.0319	0.0319
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0039	0.0319	0.0203
Loa Loa (eye worm)	5-hydroxytryptamine 2C receptor	0.0039	0.0319	0.0319
Treponema pallidum	catabolite gene activator (Crp)	0.0034	0.0182	0.5
Brugia malayi	Serotonin receptor	0.0039	0.0319	0.0319
Onchocerca volvulus	Dopamine\/Ecdysteroid receptor homolog	0.0039	0.0319	0.0388
Mycobacterium ulcerans	hypothetical protein	0.0034	0.0182	0.5
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0039	0.0319	0.0203
Schistosoma mansoni	tar DNA-binding protein	0.0203	0.4729	0.6765
Loa Loa (eye worm)	hypothetical protein	0.0034	0.0182	0.0182
Trypanosoma cruzi	isocitrate dehydrogenase, putative	0.005	0.0602	1
Loa Loa (eye worm)	hypothetical protein	0.0039	0.0319	0.0319
Echinococcus granulosus	g protein linked acetylcholine receptor gar 2a	0.0039	0.0319	0.0224
Brugia malayi	Dopamine receptor protein 1, putative (partial)	0.0039	0.0319	0.0319
Leishmania major	hypothetical protein, conserved	0.0034	0.0182	0.3028
Brugia malayi	G-protein-linked acetylcholine receptor protein 2, putative	0.0039	0.0319	0.0319
Schistosoma mansoni	myosin xvIII	0.0039	0.0319	0.0203
Schistosoma mansoni	biogenic amine (dopamine) receptor	0.0039	0.0319	0.0203
Echinococcus multilocularis	neuropeptide Y receptor	0.0039	0.0319	0.0224
Mycobacterium ulcerans	regulatory protein	0.0034	0.0182	0.5
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0145	0.3171	0.4918
Schistosoma mansoni	opsin-like receptor	0.0039	0.0319	0.0203
Brugia malayi	RE15519p	0.0039	0.0319	0.0319
Echinococcus granulosus	peptide allatostatin:somatostatin	0.0039	0.0319	0.0224
Echinococcus multilocularis	growth hormone secretagogue receptor type 1	0.0039	0.0319	0.0224
Echinococcus granulosus	hyperpolarization activated cyclic	0.0051	0.0643	0.0758
Schistosoma mansoni	neuropeptide F-like receptor	0.0039	0.0319	0.0203
Echinococcus multilocularis	neuropeptide s receptor	0.0039	0.0319	0.0224
Loa Loa (eye worm)	hypothetical protein	0.0039	0.0319	0.0319
Schistosoma mansoni	voltage-gated potassium channel	0.0041	0.0362	0.0267
Onchocerca volvulus		0.0039	0.0319	0.0388
Onchocerca volvulus		0.0039	0.0319	0.0388
Loa Loa (eye worm)	hypothetical protein	0.0388	0.9703	0.9703
Mycobacterium tuberculosis	Probable isocitrate dehydrogenase [NADP] Icd1 (oxalosuccinate decarboxylase) (IDH) (NADP+-specific ICDH) (IDP)	0.005	0.0602	1
Echinococcus multilocularis	serotonin receptor	0.0039	0.0319	0.0224
Echinococcus multilocularis	g protein linked acetylcholine receptor gar 2a	0.0039	0.0319	0.0224
Loa Loa (eye worm)	cAMP-dependent protein kinase regulatory subunit	0.0034	0.0182	0.0182
Echinococcus multilocularis	G protein coupled 5 hydroxytryptamine receptor	0.0039	0.0319	0.0224
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0145	0.3171	0.4918
Loa Loa (eye worm)	hypothetical protein	0.0039	0.0319	0.0319
Brugia malayi	neuropeptide F receptor	0.0039	0.0319	0.0319
Loa Loa (eye worm)	hypothetical protein	0.0039	0.0319	0.0319
Brugia malayi	isocitrate dehydrogenase	0.005	0.0602	0.0602
Brugia malayi	Cyclic-nucleotide gated cation channel, C. elegans tax-4 ortholog	0.0034	0.0182	0.0182
Echinococcus granulosus	tachykinin peptides receptor 99D	0.0039	0.0319	0.0224
Toxoplasma gondii	isocitrate dehydrogenase	0.005	0.0602	1
Schistosoma mansoni	hyperpolarization activated cyclic nucleotide-gated potassium channel	0.0051	0.0643	0.0686
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0039	0.0319	0.0224
Echinococcus multilocularis	allatostatin A receptor	0.0039	0.0319	0.0224
Echinococcus granulosus	hypothetical protein	0.0039	0.0319	0.0224
Toxoplasma gondii	protein kinase G AGC kinase family member PKG	0.0034	0.0182	0.3028
Brugia malayi	TAR-binding protein	0.0203	0.4729	0.4729
Schistosoma mansoni	amine GPCR	0.0039	0.0319	0.0203
Brugia malayi	Dopamine receptor	0.0039	0.0319	0.0319
Loa Loa (eye worm)	hypothetical protein	0.0039	0.0319	0.0319
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0145	0.3171	0.4447
Brugia malayi	calcium-independent alpha-latrotoxin receptor 2, putative	0.0123	0.2563	0.2563
Brugia malayi	RNA recognition motif domain containing protein	0.0203	0.4729	0.4729
Loa Loa (eye worm)	hypothetical protein	0.0051	0.0643	0.0643
Loa Loa (eye worm)	hypothetical protein	0.0039	0.0319	0.0319
Loa Loa (eye worm)	hypothetical protein	0.0039	0.0319	0.0319
Loa Loa (eye worm)	hypothetical protein	0.0039	0.0319	0.0319
Schistosoma mansoni	biogenic amine (dopamine) receptor	0.0039	0.0319	0.0203
Echinococcus granulosus	g protein coupled receptor	0.0039	0.0319	0.0224
Loa Loa (eye worm)	gonadotropin-releasing hormone receptor 2	0.0039	0.0319	0.0319
Loa Loa (eye worm)	hypothetical protein	0.0039	0.0319	0.0319
Trypanosoma brucei	cyclic nucleotide-binding domain containing protein, putative	0.0034	0.0182	0.3028
Onchocerca volvulus		0.0039	0.0319	0.0388
Loa Loa (eye worm)	hypothetical protein	0.0039	0.0319	0.0319
Trichomonas vaginalis	voltage and ligand gated potassium channel, putative	0.0051	0.0643	0.082
Loa Loa (eye worm)	TAR-binding protein	0.0203	0.4729	0.4729
Echinococcus multilocularis	NADP dependent isocitrate dehydrogenase	0.005	0.0602	0.0691
Loa Loa (eye worm)	hypothetical protein	0.0039	0.0319	0.0319
Echinococcus multilocularis	potassium voltage gated channel subfamily H	0.0075	0.1286	0.1816
Schistosoma mansoni	peptide (allatostatin)-like receptor	0.0039	0.0319	0.0203
Onchocerca volvulus		0.0039	0.0319	0.0388
Echinococcus granulosus	diuretic hormone 44 receptor GPRdih2	0.0123	0.2563	0.3917
Giardia lamblia	CAMP-dependent protein kinase regulatory chain	0.0034	0.0182	0.5
Treponema pallidum	cyclic nucleotide binding protein	0.0034	0.0182	0.5
Loa Loa (eye worm)	hypothetical protein	0.0039	0.0319	0.0319
Echinococcus granulosus	serotonin receptor	0.0039	0.0319	0.0224
Echinococcus granulosus	voltage gated potassium channel	0.0075	0.1286	0.1816
Brugia malayi	putative neuropeptide receptor NPR1	0.0039	0.0319	0.0319
Schistosoma mansoni	neuropeptide f receptor 76f	0.0039	0.0319	0.0203
Loa Loa (eye worm)	hypothetical protein	0.0039	0.0319	0.0319
Brugia malayi	hypothetical protein	0.0039	0.0319	0.0319
Brugia malayi	latrophilin 2 splice variant baaae	0.0265	0.6398	0.6398
Onchocerca volvulus		0.0039	0.0319	0.0388
Brugia malayi	hypothetical protein	0.0165	0.3693	0.3693
Loa Loa (eye worm)	hypothetical protein	0.0039	0.0319	0.0319
Brugia malayi	hypothetical protein	0.0039	0.0319	0.0319
Onchocerca volvulus		0.0165	0.3693	1
Brugia malayi	hypothetical protein	0.0039	0.0319	0.0319
Leishmania major	hypothetical protein, conserved	0.0034	0.0182	0.3028
Echinococcus multilocularis	orexin receptor type 2	0.0039	0.0319	0.0224
Loa Loa (eye worm)	hypothetical protein	0.0039	0.0319	0.0319
Echinococcus multilocularis	G-protein coupled receptor, putative	0.0039	0.0319	0.0224
Onchocerca volvulus		0.0039	0.0319	0.0388
Mycobacterium leprae	Conserved hypothetical protein	0.0034	0.0182	0.5
Brugia malayi	Calcitonin receptor-like protein seb-1	0.0388	0.9703	0.9703
Loa Loa (eye worm)	hypothetical protein	0.0039	0.0319	0.0319
Echinococcus multilocularis	potassium:sodium hyperpolarization activated	0.0051	0.0643	0.0758
Brugia malayi	Unidentified vitellogenin-linked transcript protein 6, putative	0.0039	0.0319	0.0319
Schistosoma mansoni	opsin-like receptor	0.0039	0.0319	0.0203
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0039	0.0319	0.0203
Trypanosoma brucei	cyclic nucleotide-binding domain containing protein, putative	0.0034	0.0182	0.3028
Echinococcus granulosus	g-protein coupled receptor	0.0039	0.0319	0.0224
Trypanosoma cruzi	protein kinase A regulatory subunit	0.0034	0.0182	0.3028
Leishmania major	regulatory subunit of protein kinase a-like protein	0.0034	0.0182	0.3028
Schistosoma mansoni	neuropeptide receptor	0.0039	0.0319	0.0203
Onchocerca volvulus		0.0039	0.0319	0.0388
Loa Loa (eye worm)	melatonin receptor type 1A	0.0039	0.0319	0.0319
Trypanosoma cruzi	cAMP response protein 1	0.0034	0.0182	0.3028
Echinococcus granulosus	7TM GPCR rhodopsin	0.0039	0.0319	0.0224
Toxoplasma gondii	cAMP-dependent protein kinase regulatory subunit	0.0034	0.0182	0.3028
Schistosoma mansoni	opsin-like receptor	0.0039	0.0319	0.0203
Echinococcus granulosus	dro:myosuppressin receptor	0.0039	0.0319	0.0224
Echinococcus multilocularis	diuretic hormone 44 receptor GPRdih2	0.0123	0.2563	0.3917
Echinococcus granulosus	tar DNA binding protein	0.0203	0.4729	0.7481
Mycobacterium ulcerans	transcriptional regulatory protein	0.0034	0.0182	0.5
Schistosoma mansoni	NADP-specific isocitrate dehydrogenase	0.005	0.0602	0.0625
Loa Loa (eye worm)	hypothetical protein	0.0039	0.0319	0.0319
Schistosoma mansoni	hypothetical protein	0.0123	0.2563	0.3542
Loa Loa (eye worm)	hypothetical protein	0.0039	0.0319	0.0319
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0145	0.3171	0.4918
Echinococcus granulosus	cyclic nucleotide gated cation channel alpha 3	0.0051	0.0643	0.0758
Echinococcus granulosus	rhodopsin orphan GPCR	0.0039	0.0319	0.0224
Mycobacterium ulcerans	hypothetical protein	0.0034	0.0182	0.5
Brugia malayi	hypothetical protein	0.0039	0.0319	0.0319
Brugia malayi	neuropeptide F receptor	0.0039	0.0319	0.0319
Loa Loa (eye worm)	RNA recognition domain-containing protein domain-containing protein	0.0203	0.4729	0.4729
Loa Loa (eye worm)	hypothetical protein	0.0039	0.0319	0.0319
Schistosoma mansoni	peptide (FMRFamide/somatostatin)-like receptor	0.0039	0.0319	0.0203
Schistosoma mansoni	amine GPCR	0.0039	0.0319	0.0203
Onchocerca volvulus		0.0039	0.0319	0.0388
Brugia malayi	hypothetical protein	0.0039	0.0319	0.0319
Loa Loa (eye worm)	hypothetical protein	0.0039	0.0319	0.0319
Onchocerca volvulus		0.0039	0.0319	0.0388
Echinococcus granulosus	potassium:sodium hyperpolarization activated	0.0051	0.0643	0.0758
Loa Loa (eye worm)	hypothetical protein	0.0039	0.0319	0.0319
Echinococcus multilocularis	tm gpcr rhodopsin gpcr rhodopsin superfamily	0.0039	0.0319	0.0224
Onchocerca volvulus		0.0039	0.0319	0.0388
Brugia malayi	follicle stimulating hormone receptor	0.0039	0.0319	0.0319
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0039	0.0319	0.0203
Schistosoma mansoni	peptide (FMRFamide/neurokinin-3)-like receptor	0.0039	0.0319	0.0203
Loa Loa (eye worm)	hypothetical protein	0.0165	0.3693	0.3693
Schistosoma mansoni	peptide (FMRFamide/somatostatin)-like receptor	0.0039	0.0319	0.0203
Schistosoma mansoni	hypothetical protein	0.0123	0.2563	0.3542
Echinococcus granulosus	neuropeptide Y receptor	0.0039	0.0319	0.0224
Schistosoma mansoni	neuropeptide receptor	0.0039	0.0319	0.0203
Loa Loa (eye worm)	follicle stimulating hormone receptor	0.0039	0.0319	0.0319
Echinococcus granulosus	rhodopsin orphan GPCR	0.0039	0.0319	0.0224
Echinococcus multilocularis	g protein coupled receptor	0.0039	0.0319	0.0224
Loa Loa (eye worm)	MH2 domain-containing protein	0.0399	1	1
Schistosoma mansoni	amine GPCR	0.0039	0.0319	0.0203
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0039	0.0319	0.0224
Loa Loa (eye worm)	TYRA-2 protein	0.0039	0.0319	0.0319
Brugia malayi	GnHR receptor homolog	0.0039	0.0319	0.0319
Schistosoma mansoni	biogenic amine receptor	0.0039	0.0319	0.0203
Loa Loa (eye worm)	hypothetical protein	0.0039	0.0319	0.0319
Echinococcus multilocularis	peptide (allatostatin:somatostatin)	0.0039	0.0319	0.0224
Echinococcus multilocularis	neuropeptide receptor A26	0.0039	0.0319	0.0224
Trypanosoma cruzi	isocitrate dehydrogenase [NADP], mitochondrial precursor, putative	0.005	0.0602	1
Echinococcus granulosus	biogenic amine 5HT receptor	0.0039	0.0319	0.0224
Brugia malayi	RNA binding protein	0.0203	0.4729	0.4729
Schistosoma mansoni	adenoreceptor	0.0039	0.0319	0.0203
Loa Loa (eye worm)	hypothetical protein	0.0039	0.0319	0.0319
Echinococcus granulosus	hyperpolarization activated cyclic	0.0051	0.0643	0.0758
Schistosoma mansoni	neuropeptide receptor	0.0039	0.0319	0.0203
Onchocerca volvulus		0.0039	0.0319	0.0388
Echinococcus multilocularis	GPCR, family 2	0.0123	0.2563	0.3917
Loa Loa (eye worm)	AGC/PKG protein kinase	0.0034	0.0182	0.0182
Leishmania major	protein kinase, putative	0.0034	0.0182	0.3028
Leishmania major	protein kinase, putative	0.0034	0.0182	0.3028
Schistosoma mansoni	neuropeptide F-like receptor	0.0039	0.0319	0.0203
Schistosoma mansoni	tar DNA-binding protein	0.0203	0.4729	0.6765
Echinococcus granulosus	biogenic amine 5HT receptor	0.0039	0.0319	0.0224
Echinococcus multilocularis	NADP dependent isocitrate dehydrogenase	0.005	0.0602	0.0691
Brugia malayi	Melatonin receptor type 1A	0.0039	0.0319	0.0319
Onchocerca volvulus		0.0039	0.0319	0.0388
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0039	0.0319	0.0224
Loa Loa (eye worm)	hypothetical protein	0.0039	0.0319	0.0319
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0145	0.3171	0.4447
Brugia malayi	hypothetical protein	0.0039	0.0319	0.0319
Leishmania major	hypothetical protein, conserved	0.0034	0.0182	0.3028
Loa Loa (eye worm)	hypothetical protein	0.0039	0.0319	0.0319
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0039	0.0319	0.0224
Loa Loa (eye worm)	latrophilin receptor protein 2	0.0123	0.2563	0.2563
Echinococcus granulosus	neuropeptides capa receptor	0.0039	0.0319	0.0224
Echinococcus multilocularis	pyroglutamylated rfamide peptide receptor	0.0039	0.0319	0.0224
Schistosoma mansoni	alpha-1 adrenergic receptor	0.0039	0.0319	0.0203
Echinococcus granulosus	allatostatin A receptor	0.0039	0.0319	0.0224
Brugia malayi	hypothetical protein	0.0039	0.0319	0.0319
Brugia malayi	Tachykinin-like peptides receptor 99D	0.0039	0.0319	0.0319
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0145	0.3171	0.4918
Echinococcus granulosus	potassium voltage gated channel subfamily H	0.0075	0.1286	0.1816
Echinococcus granulosus	neuropeptide s receptor	0.0039	0.0319	0.0224
Echinococcus granulosus	neuropeptide receptor	0.0192	0.4425	0.6981
Echinococcus multilocularis	voltage gated potassium channel	0.0075	0.1286	0.1816
Echinococcus granulosus	g protein linked acetylcholine receptor gar 2a	0.0039	0.0319	0.0224
Trypanosoma brucei	isocitrate dehydrogenase, putative	0.005	0.0602	1
Mycobacterium ulcerans	transmembrane transport protein	0.0034	0.0182	0.5
Trichomonas vaginalis	voltage and ligand gated potassium channel, putative	0.0051	0.0643	0.082
Schistosoma mansoni	histamine h1 receptor	0.0039	0.0319	0.0203
Echinococcus multilocularis	cyclic nucleotide gated cation channel	0.0051	0.0643	0.0758
Echinococcus granulosus	growth hormone secretagogue receptor type 1	0.0039	0.0319	0.0224
Schistosoma mansoni	growth hormone secretagogue receptor	0.0039	0.0319	0.0203
Onchocerca volvulus		0.0039	0.0319	0.0388
Loa Loa (eye worm)	hypothetical protein	0.0226	0.5335	0.5335
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0039	0.0319	0.0224
Echinococcus multilocularis	hyperpolarization activated cyclic	0.0051	0.0643	0.0758
Loa Loa (eye worm)	hypothetical protein	0.0039	0.0319	0.0319
Echinococcus granulosus	neuropeptide receptor A26	0.0039	0.0319	0.0224
Treponema pallidum	cyclic nucleotide binding protein	0.0034	0.0182	0.5
Echinococcus granulosus	orexin receptor type 2	0.0039	0.0319	0.0224
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0039	0.0319	0.0224
Plasmodium vivax	rap guanine nucleotide exchange factor, putative	0.0034	0.0182	0.3028
Echinococcus granulosus	7tm_1 domain containing protein	0.0039	0.0319	0.0224
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0039	0.0319	0.0203
Trypanosoma cruzi	cAMP binding protein, putative	0.0034	0.0182	0.3028
Echinococcus multilocularis	neuropeptide FF receptor 2	0.0039	0.0319	0.0224
Echinococcus granulosus	cadherin EGF LAG seven pass G type receptor	0.0123	0.2563	0.3917
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0039	0.0319	0.0203
Schistosoma mansoni	neuropeptide receptor	0.0192	0.4425	0.6313
Loa Loa (eye worm)	hypothetical protein	0.0039	0.0319	0.0319
Echinococcus granulosus	cyclic nucleotide gated cation channel	0.0051	0.0643	0.0758
Loa Loa (eye worm)	hypothetical protein	0.0039	0.0319	0.0319
Trypanosoma cruzi	regulatory subunit of protein kinase a-like protein, putative	0.0034	0.0182	0.3028
Schistosoma mansoni	histamine-responsive GPCR (AAF21638)	0.0039	0.0319	0.0203
Toxoplasma gondii	cyclic nucleotide-binding domain-containing protein	0.0034	0.0182	0.3028
Loa Loa (eye worm)	hypothetical protein	0.0039	0.0319	0.0319
Loa Loa (eye worm)	hypothetical protein	0.0039	0.0319	0.0319
Echinococcus multilocularis	g protein coupled receptor	0.0039	0.0319	0.0224
Echinococcus granulosus	tm gpcr rhodopsin	0.0039	0.0319	0.0224
Echinococcus granulosus	G protein coupled receptor 139	0.0039	0.0319	0.0224
Echinococcus multilocularis	cadherin EGF LAG seven pass G type receptor	0.0123	0.2563	0.3917
Echinococcus multilocularis	potassium voltage gated channel subfamily H	0.026	0.626	1
Brugia malayi	G protein-coupled receptor F59B2.13	0.0039	0.0319	0.0319
Schistosoma mansoni	biogenic amine (5HT) receptor	0.0039	0.0319	0.0203
Toxoplasma gondii	cyclic nucleotide-binding domain-containing protein	0.0034	0.0182	0.3028
Echinococcus granulosus	rhodopsin orphan GPCR	0.0039	0.0319	0.0224
Echinococcus granulosus	rhodopsin orphan GPCR	0.0039	0.0319	0.0224
Schistosoma mansoni	thyrotropin-releasing hormone receptor	0.0039	0.0319	0.0203
Echinococcus multilocularis	7TM GPCR, rhodopsin	0.0039	0.0319	0.0224
Loa Loa (eye worm)	neuropeptide F receptor	0.0039	0.0319	0.0319
Schistosoma mansoni	biogenic amine receptor	0.0039	0.0319	0.0203
Loa Loa (eye worm)	GTP-binding regulatory protein Gs alpha-S chain	0.0145	0.3171	0.3171
Brugia malayi	Cyclic-nucleotide gated cation channel	0.0051	0.0643	0.0643
Loa Loa (eye worm)	hypothetical protein	0.0039	0.0319	0.0319
Trypanosoma brucei	Flagellar Member 6	0.0034	0.0182	0.3028
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0039	0.0319	0.0203
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0145	0.3171	0.4447
Echinococcus granulosus	neuropeptide receptor	0.0039	0.0319	0.0224
Loa Loa (eye worm)	hypothetical protein	0.0039	0.0319	0.0319
Schistosoma mansoni	biogenic amine (dopamine) receptor	0.0039	0.0319	0.0203
Schistosoma mansoni	hypothetical protein	0.0039	0.0319	0.0203
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0039	0.0319	0.0203
Plasmodium falciparum	cAMP-dependent protein kinase regulatory subunit	0.0034	0.0182	0.3028
Brugia malayi	hypothetical protein	0.0039	0.0319	0.0319
Schistosoma mansoni	biogenic amine (5HT) receptor	0.0039	0.0319	0.0203
Echinococcus granulosus	rhodopsin orphan GPCR	0.0039	0.0319	0.0224
Schistosoma mansoni	peptide (allatostatin/somatostatin)-like receptor	0.0039	0.0319	0.0203
Loa Loa (eye worm)	hypothetical protein	0.0039	0.0319	0.0319
Echinococcus multilocularis	somatostatin receptor	0.0039	0.0319	0.0224
Loa Loa (eye worm)	pigment dispersing factor receptor c	0.0388	0.9703	0.9703
Plasmodium falciparum	isocitrate dehydrogenase [NADP], mitochondrial	0.005	0.0602	1
Brugia malayi	Voltage-gated potassium channel, EAG (KCNH1)-related. C. elegans egl-2 ortholog	0.0075	0.1286	0.1286
Schistosoma mansoni	voltage-gated potassium channel	0.0051	0.0643	0.0686
Schistosoma mansoni	voltage-gated potassium channel	0.0284	0.6903	1
Echinococcus multilocularis	fmrfamide receptor	0.0039	0.0319	0.0224
Echinococcus granulosus	neuropeptide Y receptor	0.0039	0.0319	0.0224
Echinococcus multilocularis	tar DNA binding protein	0.0203	0.4729	0.7481
Plasmodium vivax	CAMP-dependent protein kinase regulatory subunit, putative	0.0034	0.0182	0.3028
Echinococcus multilocularis	tm gpcr rhodopsin gpcr rhodopsin superfamily	0.0039	0.0319	0.0224
Trichomonas vaginalis	voltage and ligand gated potassium channel, putative	0.0243	0.5799	1
Echinococcus multilocularis	neuropeptide receptor	0.0192	0.4425	0.6981
Loa Loa (eye worm)	hypothetical protein	0.0039	0.0319	0.0319
Echinococcus granulosus	cyclic nucleotide gated cation channel	0.0051	0.0643	0.0758
Brugia malayi	Egg laying defective protein 4	0.0034	0.0182	0.0182
Echinococcus granulosus	pyroglutamylated rfamide peptide receptor	0.0039	0.0319	0.0224
Schistosoma mansoni	amine GPCR	0.0039	0.0319	0.0203
Brugia malayi	Dopamine receptor protein 1	0.0039	0.0319	0.0319
Schistosoma mansoni	hypothetical protein	0.0039	0.0319	0.0203
Onchocerca volvulus		0.0039	0.0319	0.0388
Echinococcus granulosus	fmrfamide receptor	0.0039	0.0319	0.0224
Schistosoma mansoni	muscarinic acetylcholine (GAR) receptor	0.0039	0.0319	0.0203
Echinococcus granulosus	GPCR family 2	0.0123	0.2563	0.3917
Echinococcus multilocularis	g protein coupled receptor	0.0039	0.0319	0.0224
Brugia malayi	G protein-coupled receptor	0.0039	0.0319	0.0319
Plasmodium falciparum	cGMP-dependent protein kinase	0.0034	0.0182	0.3028
Schistosoma mansoni	amine GPCR	0.0039	0.0319	0.0203
Trypanosoma brucei	protein kinase A regulatory subunit	0.0034	0.0182	0.3028
Brugia malayi	GTP-binding regulatory protein Gs alpha-S chain, putative	0.0145	0.3171	0.3171
Schistosoma mansoni	hypothetical protein	0.0039	0.0319	0.0203
Schistosoma mansoni	hypothetical protein	0.0123	0.2563	0.3542
Echinococcus multilocularis	serotonin receptor	0.0039	0.0319	0.0224
Mycobacterium ulcerans	hypothetical protein	0.0034	0.0182	0.5
Loa Loa (eye worm)	hypothetical protein	0.0039	0.0319	0.0319
Trypanosoma brucei	cAMP binding protein, putative	0.0034	0.0182	0.3028
Loa Loa (eye worm)	isocitrate dehydrogenase	0.005	0.0602	0.0602
Schistosoma mansoni	biogenic amine (octopamine/dopamine) receptor	0.0039	0.0319	0.0203
Echinococcus multilocularis	G protein coupled receptor 139	0.0192	0.4425	0.6981
Loa Loa (eye worm)	hypothetical protein	0.0039	0.0319	0.0319
Echinococcus multilocularis	hyperpolarization activated cyclic	0.0051	0.0643	0.0758
Mycobacterium ulcerans	hypothetical protein	0.0034	0.0182	0.5
Schistosoma mansoni	tar DNA-binding protein	0.0203	0.4729	0.6765
Echinococcus granulosus	g protein coupled receptor	0.0039	0.0319	0.0224
Echinococcus granulosus	tm gpcr rhodopsin	0.0039	0.0319	0.0224
Echinococcus multilocularis	sex peptide receptor	0.0039	0.0319	0.0224
Loa Loa (eye worm)	cyclic-nucleotide gated cation channel	0.0051	0.0643	0.0643
Echinococcus granulosus	tm gpcr rhodopsin	0.0039	0.0319	0.0224
Toxoplasma gondii	cyclic nucleotide-binding domain-containing protein	0.0034	0.0182	0.3028
Echinococcus granulosus	G protein coupled 5 hydroxytryptamine receptor	0.0039	0.0319	0.0224
Schistosoma mansoni	voltage-gated potassium channel	0.0284	0.6903	1
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0039	0.0319	0.0224
Loa Loa (eye worm)	hypothetical protein	0.0039	0.0319	0.0319
Schistosoma mansoni	hyperpolarization activated cyclic nucleotide-gated potassium channel	0.0051	0.0643	0.0686
Loa Loa (eye worm)	voltage and ligand gated potassium channel	0.026	0.626	0.626
Echinococcus granulosus	g protein coupled receptor	0.0039	0.0319	0.0224
Brugia malayi	AKH receptor	0.0039	0.0319	0.0319
Brugia malayi	Dopamine receptor protein 2	0.0039	0.0319	0.0319
Echinococcus multilocularis	thyrotropin releasing hormone receptor	0.0039	0.0319	0.0224
Schistosoma mansoni	hypothetical protein	0.0123	0.2563	0.3542
Brugia malayi	N-terminal motif family protein	0.0034	0.0182	0.0182
Brugia malayi	sulfakinin receptor protein	0.0039	0.0319	0.0319
Schistosoma mansoni	60S ribosomal protein L21	0.0041	0.0362	0.0267
Loa Loa (eye worm)	hypothetical protein	0.0039	0.0319	0.0319
Brugia malayi	Isocitrate dehydrogenase	0.005	0.0602	0.0602
Echinococcus multilocularis	neuropeptide receptor	0.0039	0.0319	0.0224
Trypanosoma cruzi	hypothetical protein, conserved	0.0034	0.0182	0.3028
Schistosoma mansoni	voltage-gated potassium channel	0.0075	0.1286	0.1643
Trypanosoma cruzi	regulatory subunit of protein kinase a-like protein, putative	0.0034	0.0182	0.3028
Brugia malayi	Serotonin/octopamine receptor family protein 7	0.0039	0.0319	0.0319
Echinococcus multilocularis	isocitrate dehydrogenase	0.005	0.0602	0.0691
Schistosoma mansoni	biogenic amine receptor	0.0039	0.0319	0.0203
Echinococcus multilocularis	tachykinin peptides receptor 99D	0.0039	0.0319	0.0224
Schistosoma mansoni	ancient conserved domain protein 2 (cyclin m2)	0.0039	0.0319	0.0203
Schistosoma mansoni	cyclic-nucleotide-gated cation channel	0.0051	0.0643	0.0686
Loa Loa (eye worm)	hypothetical protein	0.0075	0.1286	0.1286
Schistosoma mansoni	cyclic-nucleotide-gated cation channel	0.0051	0.0643	0.0686
Brugia malayi	G-protein coupled receptor	0.0039	0.0319	0.0319
Brugia malayi	gonadotropin-releasing hormone receptor 2	0.0039	0.0319	0.0319
Loa Loa (eye worm)	RNA binding protein	0.0203	0.4729	0.4729
Brugia malayi	hypothetical protein	0.0039	0.0319	0.0319
Echinococcus granulosus	rhodopsin orphan GPCR	0.0039	0.0319	0.0224
Echinococcus multilocularis	neuropeptides capa receptor	0.0039	0.0319	0.0224
Loa Loa (eye worm)	hypothetical protein	0.0039	0.0319	0.0319

Activities

Activity type	Activity value	Assay description	Source	Reference
Potency (functional)	= 5.0119 um	PUBCHEM_BIOASSAY: VP16 counterscreen qHTS for inhibitors of ROR gamma transcriptional activity. (Class of assay: confirmatory)	ChEMBL.	No reference
Potency (functional)	12.5893 uM	PubChem BioAssay. qHTS of GLP-1 Receptor Inverse Agonists (Inhibition Mode). (Class of assay: confirmatory)	ChEMBL.	No reference
Potency (functional)	= 14.1254 um	PUBCHEM_BIOASSAY: qHTS for inhibitors of ROR gamma transcriptional activity. (Class of assay: confirmatory)	ChEMBL.	No reference
Potency (functional)	26.8545 uM	PUBCHEM_BIOASSAY: qHTS profiling assay for firefly luciferase inhibitor/activator using purified enzyme and Km concentrations of substrates (counterscreen for miR-21 project). (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID2288, AID2289, AID2598, AID411]	ChEMBL.	No reference
Potency (functional)	= 39.8107 um	PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of DNA Polymerase Beta. (Class of assay: confirmatory)	ChEMBL.	No reference
Potency (functional)	100 uM	PUBCHEM_BIOASSAY: HTS for Inhibitors of HP1-beta Chromodomain Interactions with Methylated Histone Tails. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488962]	ChEMBL.	No reference

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: CHEMBL1387595

Bibliographic References

No literature references available for this target.

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Detailed information for compound 1278076