TDR Targets

Basic information

Technical information

TDR Targets ID: 1411790
Name: 1-[(2-dimethylamino-1,3-thiazol-5-yl)methyl]- N-(4-pyrazol-1-ylphenyl)piperidine-4-carboxam ide
MW: 410.536 | Formula: C21H26N6OS
H donors: 1 H acceptors: 3 LogP: 2.58 Rotable bonds: 7
Rule of 5 violations (Lipinski): 1
SMILES: O=C(C1CCN(CC1)Cc1cnc(s1)N(C)C)Nc1ccc(cc1)n1cccn1
InChi: 1S/C21H26N6OS/c1-25(2)21-22-14-19(29-21)15-26-12-8-16(9-13-26)20(28)24-17-4-6-18(7-5-17)27-11-3-10-23-27/h3-7,10-11,14,16H,8-9,12-13,15H2,1-2H3,(H,24,28)
InChiKey: UCDXGSCAWRKUEU-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

1-[(2-dimethylaminothiazol-5-yl)methyl]-N-(4-pyrazol-1-ylphenyl)piperidine-4-carboxamide
1-[(2-dimethylamino-5-thiazolyl)methyl]-N-[4-(1-pyrazolyl)phenyl]-4-piperidinecarboxamide
1-[(2-dimethylaminothiazol-5-yl)methyl]-N-(4-pyrazol-1-ylphenyl)isonipecotamide

Targets

Known targets for this compound

Species	Target name	Source	Bibliographic reference
Homo sapiens	GNAS complex locus	Starlite/ChEMBL	No references
Homo sapiens	lysine (K)-specific methyltransferase 2A	Starlite/ChEMBL	No references
Homo sapiens	SMAD family member 2	Starlite/ChEMBL	No references

Predicted pathogen targets for this compound

By orthology

Species	Potential target	Known druggable target/s	Ortholog Group
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	Get druggable targets OG5_131088	All targets in OG5_131088
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	Get druggable targets OG5_131088	All targets in OG5_131088
Brugia malayi	MH2 domain containing protein	Get druggable targets OG5_131716	All targets in OG5_131716
Schistosoma japonicum	ko:K04632 guanine nucleotide binding protein (G protein), alpha stimulating, putative	Get druggable targets OG5_131088	All targets in OG5_131088
Schistosoma japonicum	ko:K09188 myeloid/lymphoid or mixed-lineage leukemia protein 3, putative	Get druggable targets OG5_130642	All targets in OG5_130642
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	Get druggable targets OG5_131088	All targets in OG5_131088
Brugia malayi	GTP-binding regulatory protein Gs alpha-S chain, putative	Get druggable targets OG5_131088	All targets in OG5_131088
Neospora caninum	Multidomain chromatinic protein with the following architecture: 3x PHD-bromo-3xPHD-SET domain and associated cysteine cluster a	Get druggable targets OG5_130642	All targets in OG5_130642
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	Get druggable targets OG5_131088	All targets in OG5_131088
Loa Loa (eye worm)	GTP-binding regulatory protein Gs alpha-S chain	Get druggable targets OG5_131088	All targets in OG5_131088
Schistosoma mansoni	mixed-lineage leukemia protein mll	Get druggable targets OG5_130642	All targets in OG5_130642
Loa Loa (eye worm)	MH2 domain-containing protein	Get druggable targets OG5_131716	All targets in OG5_131716
Toxoplasma gondii	histone lysine methyltransferase SET1	Get druggable targets OG5_130642	All targets in OG5_130642
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	Get druggable targets OG5_131088	All targets in OG5_131088
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	Get druggable targets OG5_131088	All targets in OG5_131088
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	Get druggable targets OG5_131088	All targets in OG5_131088
Loa Loa (eye worm)	transcription factor SMAD2	Get druggable targets OG5_131716	All targets in OG5_131716

By sequence similarity to non orthologous known druggable targets

Species	Potential target	Known druggable target	Length	Alignment span	Identity
Schistosoma mansoni	GTP-binding protein alpha subunit gna	GNAS complex locus	394 aa	450 aa	28.7 %
Brugia malayi	MH2 domain containing protein	SMAD family member 2	467 aa	405 aa	31.6 %

Ranking Plot

Putative Targets List

Species	Potential target	Raw	Global	Species
Brugia malayi	Nuclear hormone receptor-like 1	0.0026	0.1495	0.1466
Brugia malayi	Ligand-binding domain of nuclear hormone receptor family protein	0.0049	0.3148	0.3125
Brugia malayi	conserved hypotetical protein	0.0023	0.1296	0.1267
Echinococcus granulosus	Nuclear hormone receptor family member nhr 41	0.0049	0.3148	0.8618
Schistosoma mansoni	cpg binding protein	0.0035	0.2134	0.4331
Loa Loa (eye worm)	hypothetical protein	0.0049	0.3148	0.3125
Loa Loa (eye worm)	DR-78	0.0023	0.1296	0.1267
Brugia malayi	hypothetical protein	0.0026	0.1495	0.1466
Echinococcus granulosus	Nuclear hormone receptor HR96	0.0023	0.1296	0.3089
Schistosoma mansoni	photoreceptor-specific nuclear receptor related	0.0049	0.3148	0.6389
Loa Loa (eye worm)	nuclear hormone receptor-like 1	0.0026	0.1495	0.1466
Echinococcus multilocularis	Nuclear hormone receptor family member nhr 41	0.0049	0.3148	0.8618
Schistosoma mansoni	nuclear receptor nhr-48	0.0023	0.1296	0.2631
Brugia malayi	MH1 domain containing protein	0.001	0.0348	0.0316
Trichomonas vaginalis	chromodomain-helicase-DNA-binding protein, putative	0.0008	0.0207	0.5
Trichomonas vaginalis	chromodomain helicase DNA binding protein, putative	0.0008	0.0207	0.5
Echinococcus granulosus	nuclear receptor subfamily 4 group A	0.0023	0.1296	0.3089
Brugia malayi	Nuclear hormone receptor-like 1	0.0049	0.3148	0.3125
Loa Loa (eye worm)	nuclear Hormone Receptor family member	0.0049	0.3148	0.3125
Trichomonas vaginalis	chromodomain helicase DNA binding protein, putative	0.0008	0.0207	0.5
Brugia malayi	nuclear receptor NHR-88	0.0023	0.1296	0.1267
Echinococcus granulosus	nuclear receptor 2DBD gamma	0.0023	0.1296	0.3089
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0055	0.3611	1
Loa Loa (eye worm)	hypothetical protein	0.0023	0.1296	0.1267
Trichomonas vaginalis	chromodomain helicase DNA binding protein, putative	0.0008	0.0207	0.5
Schistosoma mansoni	nuclear receptor 2DBD-gamma	0.0049	0.3148	0.6389
Loa Loa (eye worm)	hypothetical protein	0.0023	0.1296	0.1267
Echinococcus multilocularis	retinoic acid receptor rxr beta a retinoic acid receptor rxr alpha a retinoic acid receptor rxr alpha	0.0023	0.1296	0.3089
Loa Loa (eye worm)	hypothetical protein	0.0023	0.1296	0.1267
Brugia malayi	steroid hormone receptor	0.0049	0.3148	0.3125
Schistosoma mansoni	nuclear hormone receptor nor-1/nor-2	0.0049	0.3148	0.6389
Echinococcus granulosus	nuclear receptor nhr 48	0.0023	0.1296	0.3089
Echinococcus multilocularis	Smad4	0.001	0.0348	0.0259
Echinococcus granulosus	mothers against decapentaplegic 5	0.001	0.0348	0.0259
Echinococcus granulosus	nuclear receptor 2DBD gamma	0.0049	0.3148	0.8618
Loa Loa (eye worm)	hypothetical protein	0.0049	0.3148	0.3125
Brugia malayi	photoreceptor-specific nuclear receptor	0.0049	0.3148	0.3125
Brugia malayi	hypothetical protein	0.0026	0.1495	0.1466
Schistosoma mansoni	nuclear hormone receptor	0.0023	0.1296	0.2631
Trichomonas vaginalis	conserved hypothetical protein	0.0008	0.0207	0.5
Trichomonas vaginalis	conserved hypothetical protein	0.0008	0.0207	0.5
Echinococcus multilocularis	FTZ F1 alpha	0.0049	0.3148	0.8618
Loa Loa (eye worm)	hypothetical protein	0.0049	0.3148	0.3125
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-40	0.0049	0.3148	0.3125
Brugia malayi	Nuclear hormone receptor family member nhr-49	0.0049	0.3148	0.3125
Echinococcus multilocularis	ecdysone induced protein 78C	0.0049	0.3148	0.8618
Echinococcus multilocularis	nuclear receptor subfamily 1 group D	0.0026	0.1495	0.3681
Brugia malayi	nuclear hormone receptor	0.0049	0.3148	0.3125
Loa Loa (eye worm)	hypothetical protein	0.0023	0.1296	0.1267
Brugia malayi	nuclear receptor RXR	0.0023	0.1296	0.1267
Onchocerca volvulus	Steroid hormone receptor family member cnr14 homolog	0.0049	0.3148	1
Brugia malayi	orphan nuclear receptor NR2E1	0.0023	0.1296	0.1267
Brugia malayi	Nuclear hormone receptor-like 1	0.0026	0.1495	0.1466
Schistosoma mansoni	TGF-beta signal transducer Smad2	0.001	0.0348	0.0707
Loa Loa (eye worm)	hypothetical protein	0.0023	0.1296	0.1267
Brugia malayi	ecdysteroid receptor	0.0049	0.3148	0.3125
Trichomonas vaginalis	conserved hypothetical protein	0.0008	0.0207	0.5
Brugia malayi	nuclear receptor NHR-67	0.0023	0.1296	0.1267
Loa Loa (eye worm)	hypothetical protein	0.0023	0.1296	0.1267
Brugia malayi	hypothetical protein	0.0023	0.1296	0.1267
Schistosoma mansoni	hepatocyte nuclear factor 4-alpha (hnf-4-alpha)	0.0023	0.1296	0.2631
Echinococcus multilocularis	cpg binding protein	0.0037	0.2276	0.6015
Brugia malayi	hypothetical protein	0.0023	0.1296	0.1267
Schistosoma mansoni	ecdysone-induced protein 78c (dr-78)	0.0026	0.1495	0.3033
Echinococcus granulosus	FTZ F1 nuclear receptor protein	0.0049	0.3148	0.8618
Loa Loa (eye worm)	hypothetical protein	0.0023	0.1296	0.1267
Schistosoma mansoni	cpg binding protein	0.0037	0.2276	0.4619
Schistosoma mansoni	Tr4/Tr2 (homologue)	0.0049	0.3148	0.6389
Loa Loa (eye worm)	hypothetical protein	0.0049	0.3148	0.3125
Brugia malayi	Nuclear hormone receptor family member nhr-40	0.0049	0.3148	0.3125
Loa Loa (eye worm)	MH2 domain-containing protein	0.0144	1	1
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0055	0.3611	1
Echinococcus granulosus	TGF beta signal transducer SmadC	0.001	0.0348	0.0259
Brugia malayi	CXXC zinc finger family protein	0.0035	0.2134	0.2108
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-41	0.0049	0.3148	0.3125
Loa Loa (eye worm)	GTP-binding regulatory protein Gs alpha-S chain	0.0055	0.3611	0.359
Loa Loa (eye worm)	hypothetical protein	0.0049	0.3148	0.3125
Trichomonas vaginalis	conserved hypothetical protein	0.0008	0.0207	0.5
Echinococcus granulosus	COUP TF:Svp nuclear hormone receptor	0.0049	0.3148	0.8618
Echinococcus granulosus	cpg binding protein	0.0037	0.2276	0.6015
Brugia malayi	Nuclear hormone receptor E75	0.0023	0.1296	0.1267
Echinococcus granulosus	Nuclear hormone receptor HR96	0.0023	0.1296	0.3089
Loa Loa (eye worm)	hypothetical protein	0.0049	0.3148	0.3125
Echinococcus multilocularis	nuclear receptor subfamily 4 group A	0.0023	0.1296	0.3089
Schistosoma mansoni	smad	0.001	0.0348	0.0707
Schistosoma mansoni	nuclear receptor	0.0023	0.1296	0.2631
Schistosoma mansoni	smad1 5 8 and	0.001	0.0348	0.0707
Trichomonas vaginalis	conserved hypothetical protein	0.0008	0.0207	0.5
Schistosoma mansoni	smad1 5 8 and	0.001	0.0348	0.0707
Echinococcus multilocularis	histone lysine N methyltransferase MLL3	0.0011	0.0414	0.0453
Schistosoma mansoni	retinoid-x-receptor (RXR)	0.0049	0.3148	0.6389
Trichomonas vaginalis	chromodomain helicase DNA binding protein, putative	0.0008	0.0207	0.5
Echinococcus granulosus	histone lysine N methyltransferase MLL3	0.0011	0.0414	0.0453
Loa Loa (eye worm)	hypothetical protein	0.0049	0.3148	0.3125
Loa Loa (eye worm)	nuclear receptor NHR-67	0.0023	0.1296	0.1267
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0055	0.3611	0.7328
Echinococcus multilocularis	FTZ F1 nuclear receptor protein	0.0049	0.3148	0.8618
Brugia malayi	Nuclear hormone receptor family member nhr-19	0.0049	0.3148	0.3125
Brugia malayi	tailless protein	0.0023	0.1296	0.1267
Trichomonas vaginalis	helicase, putative	0.0008	0.0207	0.5
Brugia malayi	Ligand-binding domain of nuclear hormone receptor family protein	0.0049	0.3148	0.3125
Brugia malayi	nuclear receptor RXR	0.0026	0.1495	0.1466
Echinococcus multilocularis	nuclear receptor nhr 48	0.0023	0.1296	0.3089
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-14	0.0049	0.3148	0.3125
Schistosoma mansoni	cpg binding protein	0.0037	0.2276	0.4619
Loa Loa (eye worm)	hypothetical protein	0.0049	0.3148	0.3125
Loa Loa (eye worm)	nuclear receptor nhr-7B	0.0023	0.1296	0.1267
Loa Loa (eye worm)	hypothetical protein	0.0026	0.1495	0.1466
Echinococcus multilocularis	mothers against decapentaplegic 5	0.001	0.0348	0.0259
Loa Loa (eye worm)	hypothetical protein	0.0023	0.1296	0.1267
Loa Loa (eye worm)	nuclear hormone receptor	0.0023	0.1296	0.1267
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-1	0.0049	0.3148	0.3125
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-31	0.0049	0.3148	0.3125
Loa Loa (eye worm)	CXXC zinc finger family protein	0.0035	0.2134	0.2108
Schistosoma mansoni	thyroid hormone receptor	0.0049	0.3148	0.6389
Echinococcus multilocularis	thyroid hormone receptor alpha	0.0049	0.3148	0.8618
Onchocerca volvulus	Protein ultraspiracle homolog	0.0049	0.3148	1
Echinococcus multilocularis	Nuclear hormone receptor HR96	0.0023	0.1296	0.3089
Brugia malayi	Nuclear hormone receptor family member nhr-25	0.0049	0.3148	0.3125
Brugia malayi	ecdysone receptor	0.0023	0.1296	0.1267
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-49	0.0049	0.3148	0.3125
Brugia malayi	F/Y-rich N-terminus family protein	0.0011	0.0404	0.0372
Trichomonas vaginalis	chromodomain helicase DNA binding protein, putative	0.0008	0.0207	0.5
Schistosoma mansoni	mixed-lineage leukemia protein mll	0.0074	0.4928	1
Loa Loa (eye worm)	steroid hormone receptor	0.0049	0.3148	0.3125
Brugia malayi	nuclear receptor subfamily 1, group D, member 1, putative	0.0023	0.1296	0.1267
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0055	0.3611	1
Schistosoma mansoni	steroid hormone receptor ad4bp	0.0049	0.3148	0.6389
Schistosoma mansoni	thyroid hormone receptor	0.0049	0.3148	0.6389
Echinococcus multilocularis	smad	0.001	0.0348	0.0259
Loa Loa (eye worm)	hypothetical protein	0.0026	0.1495	0.1466
Onchocerca volvulus	Bile acid receptor homolog	0.0049	0.3148	1
Brugia malayi	Nuclear hormone receptor E75	0.0023	0.1296	0.1267
Brugia malayi	Nuclear hormone receptor family member nhr-31	0.0049	0.3148	0.3125
Trichomonas vaginalis	conserved hypothetical protein	0.0008	0.0207	0.5
Loa Loa (eye worm)	MH1 domain-containing protein	0.001	0.0348	0.0316
Brugia malayi	GTP-binding regulatory protein Gs alpha-S chain, putative	0.0055	0.3611	0.359
Trichomonas vaginalis	conserved hypothetical protein	0.0008	0.0207	0.5
Loa Loa (eye worm)	hypothetical protein	0.0023	0.1296	0.1267
Echinococcus multilocularis	nuclear receptor 2DBD gamma	0.0049	0.3148	0.8618
Echinococcus multilocularis	nuclear receptor 2DBD gamma	0.0049	0.3148	0.8618
Loa Loa (eye worm)	Smad1	0.001	0.0348	0.0316
Loa Loa (eye worm)	MH2 domain-containing protein	0.001	0.0348	0.0316
Brugia malayi	Nuclear hormone receptor family member nhr-19	0.0049	0.3148	0.3125
Loa Loa (eye worm)	hypothetical protein	0.0023	0.1296	0.1267
Schistosoma mansoni	nuclear hormone receptor superfamily protein-related	0.0023	0.1296	0.2631
Schistosoma mansoni	retinoic acid receptor RXR	0.0049	0.3148	0.6389
Schistosoma mansoni	zinc finger protein	0.0023	0.1296	0.2631
Schistosoma mansoni	nuclear hormone receptor	0.0049	0.3148	0.6389
Brugia malayi	nuclear hormone receptor family member odr-7	0.0023	0.1296	0.1267
Loa Loa (eye worm)	transcription factor SMAD2	0.0144	1	1
Brugia malayi	MH1 domain containing protein	0.001	0.0348	0.0316
Loa Loa (eye worm)	hypothetical protein	0.0023	0.1296	0.1267
Schistosoma mansoni	nuclear hormone receptor	0.0023	0.1296	0.2631
Schistosoma mansoni	Smad4	0.001	0.0348	0.0707
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0055	0.3611	1
Loa Loa (eye worm)	hypothetical protein	0.0026	0.1495	0.1466
Echinococcus multilocularis	COUP TF:Svp nuclear hormone receptor	0.0049	0.3148	0.8618
Echinococcus granulosus	ecdysone induced protein 78C	0.0049	0.3148	0.8618
Toxoplasma gondii	histone lysine methyltransferase SET1	0.0066	0.4363	0.5
Schistosoma mansoni	FTZ-F1 nuclear receptor-like protein	0.0049	0.3148	0.6389
Brugia malayi	Nuclear hormone receptor family member nhr-1	0.0049	0.3148	0.3125
Echinococcus granulosus	Smad4	0.001	0.0348	0.0259
Brugia malayi	nuclear receptor NHR-88	0.0049	0.3148	0.3125
Echinococcus granulosus	smad	0.001	0.0348	0.0259
Brugia malayi	MH2 domain containing protein	0.001	0.0348	0.0316
Loa Loa (eye worm)	hypothetical protein	0.0026	0.1495	0.1466
Echinococcus granulosus	retinoic acid receptor rxr beta a	0.0049	0.3148	0.8618
Echinococcus granulosus	nuclear receptor 2DBD gamma	0.0049	0.3148	0.8618
Loa Loa (eye worm)	histone methyltransferase	0.0011	0.0414	0.0382
Echinococcus multilocularis	nuclear receptor 2DBD gamma	0.0023	0.1296	0.3089
Echinococcus granulosus	FTZ F1 alpha	0.0049	0.3148	0.8618
Onchocerca volvulus		0.0035	0.2134	0.4525
Trichomonas vaginalis	conserved hypothetical protein	0.0008	0.0207	0.5
Loa Loa (eye worm)	hypothetical protein	0.0023	0.1296	0.1267
Onchocerca volvulus		0.0049	0.3148	1
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0055	0.3611	0.7328
Schistosoma mansoni	coup transcription factor	0.0049	0.3148	0.6389
Brugia malayi	nuclear hormone receptor family member nhr-6	0.0023	0.1296	0.1267
Echinococcus granulosus	thyroid hormone receptor alpha	0.0023	0.1296	0.3089
Loa Loa (eye worm)	hypothetical protein	0.0026	0.1495	0.1466
Brugia malayi	Nuclear hormone receptor family member nhr-14	0.0049	0.3148	0.3125
Trichomonas vaginalis	conserved hypothetical protein	0.0008	0.0207	0.5
Brugia malayi	Nuclear hormone receptor family member nhr-41	0.0049	0.3148	0.3125
Trichomonas vaginalis	chromodomain-helicase-DNA-binding protein, putative	0.0008	0.0207	0.5
Loa Loa (eye worm)	hypothetical protein	0.0023	0.1296	0.1267
Brugia malayi	nuclear hormone receptor	0.0023	0.1296	0.1267
Schistosoma mansoni	mixed-lineage leukemia protein mll	0.0009	0.0262	0.0531
Brugia malayi	Nuclear hormone receptor family member nhr-25	0.0049	0.3148	0.3125
Schistosoma mansoni	RAR-like nuclear receptor	0.0049	0.3148	0.6389
Brugia malayi	Nuclear hormone receptor family member nhr-3	0.0049	0.3148	0.3125
Echinococcus granulosus	nuclear receptor subfamily 1 group D	0.0026	0.1495	0.3681
Brugia malayi	Smad1	0.001	0.0348	0.0316
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0055	0.3611	0.7328
Echinococcus multilocularis	TGF beta signal transducer SmadC	0.001	0.0348	0.0259
Brugia malayi	Steroid receptor seven-up type 2	0.0049	0.3148	0.3125
Trichomonas vaginalis	chromodomain helicase DNA binding protein, putative	0.0008	0.0207	0.5
Brugia malayi	MH2 domain containing protein	0.001	0.0348	0.0316
Schistosoma mansoni	nuclear receptor	0.0023	0.1296	0.2631
Echinococcus granulosus	hepatocyte nuclear factor 4 alpha	0.0049	0.3148	0.8618
Schistosoma mansoni	smad1 5 8 and	0.001	0.0348	0.0707
Echinococcus multilocularis	Nuclear hormone receptor HR96	0.0023	0.1296	0.3089
Echinococcus multilocularis	hepatocyte nuclear factor 4 alpha	0.0049	0.3148	0.8618
Schistosoma mansoni	retinoid-x-receptor (RXR)	0.0026	0.1495	0.3033

Activities

Activity type	Activity value	Assay description	Source	Reference
Potency (functional)	2.6169 uM	PUBCHEM_BIOASSAY: Primary qHTS for delayed death inhibitors of the malarial parasite plastid, 48 hour incubation. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488752, AID488774, AID504848, AID504850]	ChEMBL.	No reference
Potency (functional)	3.1623 uM	PUBCHEM_BIOASSAY: qHTS for Inhibitors of TGF-b. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID588856, AID588860]	ChEMBL.	No reference
Potency (functional)	= 7.9433 um	PUBCHEM_BIOASSAY: qHTS Fluorescence Polarization Assay for Inhibitors of MLL CXXC domain - DNA interaction. (Class of assay: confirmatory) [Related pubchem assays: 2698 (Summary assay.)]	ChEMBL.	No reference
Potency (functional)	11.2202 uM	PubChem BioAssay. qHTS for Agonist of gsp, the Etiologic Mutation Responsible for Fibrous Dysplasia/McCune-Albright Syndrome: qHTS. (Class of assay: confirmatory)	ChEMBL.	No reference
Potency (functional)	100 uM	PUBCHEM_BIOASSAY: qHTS for Inhibitors of Polymerase Iota. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID588623]	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: CHEMBL1548905

Bibliographic References

No literature references available for this target.

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Detailed information for compound 1411790