TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 322.444 | Formula: C21H26N2O
H donors: 0 H acceptors: 1 LogP: 3.49 Rotable bonds: 6
Rule of 5 violations (Lipinski): 1
SMILES: CCN1CCN(CC1)C(=O)C(c1ccccc1)Cc1ccccc1
InChi: 1S/C21H26N2O/c1-2-22-13-15-23(16-14-22)21(24)20(19-11-7-4-8-12-19)17-18-9-5-3-6-10-18/h3-12,20H,2,13-17H2,1H3
InChiKey: BHAGRCJVSXEBFH-UHFFFAOYSA-N

Network

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Target Layer

Model Organisms

Species	Viewmode
Arabidopsis thaliana
Caenorhabditis elegans
Dictyostelium discoideum
Drosophila melanogaster
Escherichia coli
Homo sapiens
Mus musculus
Oryza sativa
Saccharomyces cerevisiae
Schmidtea mediterranea
Other organisms

TDR Pathogens:

Species	Viewmode
Brugia malayi
Chlamydia trachomatis
Echinococcus granulosus
Entamoeba histolytica
Echinococcus multilocularis
Giardia lamblia
Leishmania major
Loa Loa (eye worm)
Mycobacterium leprae
Mycobacterium tuberculosis
Mycobacterium ulcerans
Onchocerca volvulus
Plasmodium falciparum
Plasmodium vivax
Schistosoma mansoni
Trypanosoma brucei
Trypanosoma cruzi
Toxoplasma gondii
Treponema pallidum
Trichomonas vaginalis
Wolbachia endosymbiont of Brugia malayi

Other Pathogens:

Species	Viewmode
Babesia bovis
Candida albicans
Cryptosporidium hominis
Cryptosporidium parvum
Leishmania braziliensis
Leishmania donovani
Leishmania infantum
Leishmania mexicana
Neospora caninum
Plasmodium berghei
Plasmodium knowlesi
Plasmodium yoelii
Schistosoma japonicum
Trypanosoma brucei gambiense
Trypanosoma congolense
Theileria parva

Compound Layer

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Clustering layers

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Synonyms

No synonyms found for this compound

Targets

Known targets for this compound

Species	Target name	Source	Bibliographic reference
Homo sapiens	cholinergic receptor, muscarinic 1	Starlite/ChEMBL	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

No druggable targets predicted by sequence similarity

Ranking Plot

Putative Targets List

Species	Potential target	Raw	Global	Species
Plasmodium vivax	DNA gyrase subunit B, putative	0.0035	0.0076	1
Trichomonas vaginalis	RNA polymerase II ctd phosphatase, putative	0.002	0.0012	0.0056
Brugia malayi	hypothetical protein	0.0465	0.1825	0.7241
Echinococcus multilocularis	Pyruvate dehydrogenase (lipoamide) kinase	0.0634	0.2516	0.2508
Schistosoma mansoni	heat shock protein	0.0035	0.0076	0.0257
Brugia malayi	Iron-sulfur cluster assembly accessory protein	0.0095	0.0318	0.1225
Onchocerca volvulus		0.0084	0.0275	0.8148
Loa Loa (eye worm)	TAR-binding protein	0.0063	0.019	0.0739
Loa Loa (eye worm)	hypothetical protein	0.002	0.0015	0.0043
Echinococcus multilocularis	Nuclear hormone receptor family member nhr 41	0.002	0.0015	0.0004
Toxoplasma gondii	ATPase/histidine kinase/DNA gyrase B/HSP90 domain-containing protein	0.0035	0.0076	0.0665
Schistosoma mansoni	hypothetical protein	0.0072	0.0225	0.0854
Toxoplasma gondii	heat shock protein 90, putative	0.0035	0.0076	0.0665
Trypanosoma cruzi	heat shock protein 85, putative	0.0035	0.0076	0.0257
Mycobacterium ulcerans	two component sensory transduction histidine kinase MtrB	0.0035	0.0076	1
Mycobacterium tuberculosis	Probable fatty-acid-CoA ligase FadD2 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase)	0.0024	0.0028	0.375
Trypanosoma brucei	heat shock protein, putative	0.0035	0.0076	0.0257
Plasmodium falciparum	AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative	0.0019	0.0011	0.1011
Mycobacterium ulcerans	long-chain-fatty-acid-CoA ligase	0.0024	0.0028	0.3406
Loa Loa (eye worm)	hypothetical protein	0.002	0.0012	0.0032
Mycobacterium ulcerans	long-chain-fatty-acid--CoA ligase	0.0024	0.0028	0.3406
Mycobacterium tuberculosis	Two component sensor histidine kinase TrcS	0.0035	0.0076	1
Trypanosoma cruzi	pyruvate dehydrogenase (lipoamide) kinase, putative	0.0222	0.0835	0.329
Echinococcus granulosus	Protein patched homolog 1	0.0042	0.0104	0.0346
Trypanosoma brucei	heat shock protein 90, putative	0.0035	0.0076	0.0257
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-49	0.002	0.0015	0.0043
Schistosoma mansoni	transcription factor LCR-F1	0.0072	0.0225	0.0854
Mycobacterium ulcerans	long-chain fatty-acid CoA ligase	0.0024	0.0028	0.3406
Echinococcus multilocularis	ecdysone induced protein 78C	0.002	0.0015	0.0004
Brugia malayi	Nuclear hormone receptor family member nhr-31	0.002	0.0015	0.0014
Entamoeba histolytica	hypothetical protein	0.002	0.0012	0.0027
Trypanosoma cruzi	hypothetical protein, conserved	0.002	0.0012	0.0003
Echinococcus granulosus	COUP TF:Svp nuclear hormone receptor	0.002	0.0015	0.0013
Mycobacterium tuberculosis	Fatty-acid-AMP ligase FadD30 (fatty-acid-AMP synthetase) (fatty-acid-AMP synthase)	0.0018	0.0004	0.0521
Loa Loa (eye worm)	hypothetical protein	0.0634	0.2516	1
Loa Loa (eye worm)	hypothetical protein	0.0465	0.1825	0.7249
Brugia malayi	Pax transcription activation domain interacting protein	0.002	0.0012	0.0003
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0046	0.0118	0.0107
Entamoeba histolytica	hypothetical protein	0.0072	0.0225	0.6652
Echinococcus granulosus	heat shock protein	0.0035	0.0076	0.0241
Mycobacterium leprae	PUTATIVE TWO COMPONENT SENSOR HISTIDINE KINASE SENX3	0.0035	0.0076	1
Echinococcus multilocularis	raf serine:threonine protein kinase	0.0254	0.0967	0.0957
Plasmodium falciparum	endoplasmin, putative	0.0035	0.0076	1
Brugia malayi	Nuclear hormone receptor family member nhr-14	0.002	0.0015	0.0014
Echinococcus multilocularis	hepatocyte nuclear factor 4 alpha	0.002	0.0015	0.0004
Schistosoma mansoni	topbp1	0.002	0.0012	0.0003
Echinococcus multilocularis	expressed conserved protein	0.0092	0.0308	0.0297
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-31	0.002	0.0015	0.0043
Brugia malayi	hypothetical protein	0.002	0.0012	0.0003
Plasmodium falciparum	DNA topoisomerase 2	0.0035	0.0076	1
Echinococcus granulosus	hepatocyte nuclear factor 4 alpha	0.002	0.0015	0.0013
Entamoeba histolytica	hypothetical protein	0.0072	0.0225	0.6652
Wolbachia endosymbiont of Brugia malayi	DNA gyrase, topoisomerase II, B subunit, GyrB	0.0035	0.0076	1
Trypanosoma cruzi	heat shock protein 85, putative	0.0035	0.0076	0.0257
Loa Loa (eye worm)	GTP-binding regulatory protein Gs alpha-S chain	0.0046	0.0118	0.0456
Brugia malayi	Raf kinase	0.0245	0.0931	0.3672
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0046	0.0118	0.0428
Leishmania major	heat shock protein 83-1	0.0035	0.0076	0.0257
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-41	0.002	0.0015	0.0043
Brugia malayi	nuclear receptor NHR-88	0.002	0.0015	0.0014
Schistosoma mansoni	niemann-pick C1 (NPC1)	0.01	0.0339	0.1308
Brugia malayi	Nuclear hormone receptor family member nhr-25	0.002	0.0015	0.0014
Entamoeba histolytica	acyl-CoA synthetase, putative	0.0024	0.0028	0.0534
Plasmodium vivax	hypothetical protein, conserved	0.0035	0.0076	1
Plasmodium vivax	AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative	0.0019	0.0011	0.1011
Brugia malayi	DNA gyrase/topoisomerase IV, A subunit family protein	0.0035	0.0076	0.0257
Trypanosoma cruzi	DNA topoisomerase II, putative	0.0035	0.0076	0.0257
Loa Loa (eye worm)	hypothetical protein	0.002	0.0015	0.0043
Trichomonas vaginalis	WD repeat domain, putative	0.0058	0.0167	1
Brugia malayi	RNA recognition motif domain containing protein	0.0063	0.019	0.0713
Leishmania major	heat shock protein 83-1	0.0035	0.0076	0.0257
Entamoeba histolytica	DNA topoisomerase II, putative	0.0035	0.0076	0.2003
Mycobacterium ulcerans	two component sensor kinase MprB	0.0035	0.0076	1
Trichomonas vaginalis	mismatch repair protein Mlh1C (mutL homolog)	0.0035	0.0076	0.4127
Trichomonas vaginalis	receptor histidine kinase, putative	0.0035	0.0076	0.4127
Entamoeba histolytica	acyl-CoA synthetase, putative	0.0024	0.0028	0.0534
Plasmodium falciparum	replication factor C subunit 1, putative	0.002	0.0012	0.1133
Mycobacterium tuberculosis	Probable chain -fatty-acid-CoA ligase FadD13 (fatty-acyl-CoA synthetase)	0.0024	0.0028	0.375
Leishmania major	heat shock protein 83-1	0.0035	0.0076	0.0257
Leishmania major	heat shock protein 83-1	0.0035	0.0076	0.0257
Loa Loa (eye worm)	TKL/RAF/RAF protein kinase	0.0144	0.0519	0.2049
Mycobacterium tuberculosis	holo-[acyl-carrier protein] synthase AcpS (holo-ACP synthase) (CoA:APO-[ACP]pantetheinephosphotransferase) (CoA:APO-[acyl-carrie	0.0024	0.0028	0.3753
Mycobacterium ulcerans	two component sensor histidine kinase DevS	0.0035	0.0076	1
Trichomonas vaginalis	sensor histidine kinase, putative	0.0035	0.0076	0.4127
Wolbachia endosymbiont of Brugia malayi	signal transduction histidine kinase and receiver	0.0035	0.0076	1
Loa Loa (eye worm)	hypothetical protein	0.002	0.0015	0.0043
Mycobacterium ulcerans	acyl-CoA synthetase	0.0024	0.0028	0.3406
Loa Loa (eye worm)	hypothetical protein	0.0052	0.0143	0.0552
Loa Loa (eye worm)	pigment dispersing factor receptor c	0.005	0.0135	0.0521
Schistosoma mansoni	nuclear hormone receptor	0.002	0.0015	0.0014
Loa Loa (eye worm)	protein-tyrosine phosphatase	0.037	0.144	0.5718
Schistosoma mansoni	endoplasmin	0.0035	0.0076	0.0257
Trichomonas vaginalis	sensory transduction histidine kinase, putative	0.0035	0.0076	0.4127
Brugia malayi	topoisomerase	0.002	0.0012	0.0003
Echinococcus granulosus	protein will die slowly	0.0058	0.0167	0.0583
Leishmania major	heat shock protein 83-1	0.0035	0.0076	0.0257
Mycobacterium ulcerans	two component system response phosphate sensor kinase, PhoR	0.0035	0.0076	1
Schistosoma mansoni	patched 1	0.0042	0.0104	0.037
Trypanosoma brucei	Heat shock protein 83, putative	0.0035	0.0076	0.0257
Plasmodium falciparum	DNA gyrase subunit B	0.0035	0.0076	1
Echinococcus granulosus	replication factor c subunit 1	0.002	0.0012	0.0003
Trypanosoma cruzi	developmentally regulated phosphoprotein, putative	0.0634	0.2516	1
Trypanosoma cruzi	Heat shock protein 83, putative	0.0035	0.0076	0.0257
Brugia malayi	Ligand-binding domain of nuclear hormone receptor family protein	0.002	0.0015	0.0014
Trichomonas vaginalis	conserved hypothetical protein	0.002	0.0012	0.0056
Schistosoma mansoni	DNA ligase IV	0.002	0.0012	0.0003
Onchocerca volvulus	Protein ultraspiracle homolog	0.002	0.0015	0.0082
Toxoplasma gondii	4'-phosphopantetheinyl transferase superfamily protein	0.0024	0.0028	0.0177
Brugia malayi	Nuclear hormone receptor family member nhr-19	0.002	0.0015	0.0014
Plasmodium vivax	endoplasmin, putative	0.0035	0.0076	1
Brugia malayi	AMP-binding enzyme family protein	0.0024	0.0028	0.0068
Toxoplasma gondii	poly(ADP-ribose) polymerase catalytic domain-containing protein	0.002	0.0012	0.0009
Toxoplasma gondii	ATPase/histidine kinase/DNA gyrase B/HSP90 domain-containing protein	0.0035	0.0076	0.0665
Trichomonas vaginalis	heat shock protein, putative	0.0035	0.0076	0.4127
Mycobacterium tuberculosis	Possible two component sensor kinase TcrY	0.0035	0.0076	1
Leishmania major	heat shock protein 83-1	0.0035	0.0076	0.0257
Onchocerca volvulus	Bile acid receptor homolog	0.002	0.0015	0.0082
Echinococcus granulosus	ecdysone induced protein 78C	0.002	0.0015	0.0013
Mycobacterium leprae	PROBABLE FATTY-ACID-CoA LIGASE FADD7 (FATTY-ACID-CoA SYNTHETASE) (FATTY-ACID-CoA SYNTHASE)	0.0024	0.0028	0.2564
Brugia malayi	Nuclear hormone receptor-like 1	0.002	0.0015	0.0014
Schistosoma mansoni	pyruvate dehydrogenase	0.0634	0.2516	1
Mycobacterium tuberculosis	Probable sensor protein KdpD	0.0035	0.0076	1
Schistosoma mansoni	DNA topoisomerase II	0.0035	0.0076	0.0257
Loa Loa (eye worm)	RNA binding protein	0.0063	0.019	0.0739
Trichomonas vaginalis	replication factor C large subunit, putative	0.002	0.0012	0.0056
Plasmodium falciparum	holo-[acyl-carrier-protein] synthase, putative	0.0024	0.0028	0.3409
Entamoeba histolytica	hypothetical protein	0.0072	0.0225	0.6652
Leishmania major	developmentally regulated phosphoprotein-like protein	0.0634	0.2516	1
Trichomonas vaginalis	sensory transduction histidine kinase bacterial, putative	0.0035	0.0076	0.4127
Brugia malayi	photoreceptor-specific nuclear receptor	0.002	0.0015	0.0014
Mycobacterium tuberculosis	Two component sensor kinase MprB	0.0035	0.0076	1
Echinococcus granulosus	tar DNA binding protein	0.0063	0.019	0.0668
Mycobacterium tuberculosis	Two component sensor histidine kinase PrrB	0.0035	0.0076	1
Brugia malayi	Nuclear hormone receptor family member nhr-41	0.002	0.0015	0.0014
Trypanosoma brucei	hypothetical protein, conserved	0.0024	0.0028	0.0069
Schistosoma mansoni	retinoid-x-receptor (RXR)	0.002	0.0015	0.0014
Trypanosoma brucei	BRCA1 C Terminus (BRCT) domain containing protein, putative	0.002	0.0012	0.0003
Loa Loa (eye worm)	heat shock protein 90	0.0035	0.0076	0.0285
Loa Loa (eye worm)	hypothetical protein	0.005	0.0135	0.0521
Mycobacterium ulcerans	4'-phosphopantetheinyl transferase	0.0024	0.0028	0.3409
Loa Loa (eye worm)	hypothetical protein	0.002	0.0012	0.0032
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0046	0.0118	0.0428
Schistosoma mansoni	coup transcription factor	0.002	0.0015	0.0014
Leishmania major	4-coumarate:coa ligase-like protein	0.0024	0.0028	0.0068
Loa Loa (eye worm)	abnormal chemotaxis protein 14	0.0042	0.0104	0.0398
Schistosoma mansoni	nuclear receptor 2DBD-gamma	0.002	0.0015	0.0014
Entamoeba histolytica	Activator 1 140 kDa subunit, putative	0.002	0.0012	0.0027
Schistosoma mansoni	endoplasmin	0.0035	0.0076	0.0257
Toxoplasma gondii	pyruvate dehydrogenase kinase, putative	0.0222	0.0835	0.8515
Onchocerca volvulus	Putative DNA topoisomerase 2, mitochondrial	0.0035	0.0076	0.1968
Trypanosoma brucei	DNA topoisomerase II beta, putative	0.0035	0.0076	0.0257
Echinococcus granulosus	FTZ F1 nuclear receptor protein	0.002	0.0015	0.0013
Leishmania major	4-coumarate:coa ligase-like protein	0.0024	0.0028	0.0068
Mycobacterium leprae	Probable two-component sensor kinase	0.0035	0.0076	1
Echinococcus multilocularis	Basic leucine zipper (bZIP) transcription	0.0072	0.0225	0.0214
Brugia malayi	CHE-14 protein	0.0042	0.0104	0.037
Trypanosoma brucei	heat shock protein, putative	0.0035	0.0076	0.0257
Brugia malayi	Calcitonin receptor-like protein seb-1	0.005	0.0135	0.0493
Brugia malayi	Steroid receptor seven-up type 2	0.002	0.0015	0.0014
Echinococcus multilocularis	tar DNA binding protein	0.0063	0.019	0.0179
Leishmania major	heat shock protein 83-1	0.0035	0.0076	0.0257
Schistosoma mansoni	hypothetical protein	0.0041	0.0098	0.0345
Leishmania major	heat shock protein 83-1	0.0035	0.0076	0.0257
Loa Loa (eye worm)	hypothetical protein	0.0098	0.0333	0.1308
Trichomonas vaginalis	RNA polymerase II ctd phosphatase, putative	0.002	0.0012	0.0056
Echinococcus granulosus	nuclear receptor 2DBD gamma	0.002	0.0015	0.0013
Echinococcus multilocularis	heat shock protein	0.0035	0.0076	0.0064
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0046	0.0118	0.0401
Toxoplasma gondii	DNA topoisomerase 2, putative	0.0035	0.0076	0.0665
Brugia malayi	Ligand-binding domain of nuclear hormone receptor family protein	0.002	0.0015	0.0014
Echinococcus multilocularis	thyroid hormone receptor alpha	0.002	0.0015	0.0004
Onchocerca volvulus		0.0058	0.0167	0.4807
Leishmania major	heat shock protein 83-1	0.0035	0.0076	0.0257
Echinococcus granulosus	nibrin	0.002	0.0012	0.0003
Brugia malayi	steroid hormone receptor	0.002	0.0015	0.0014
Schistosoma mansoni	FTZ-F1 nuclear receptor-like protein	0.002	0.0015	0.0014
Wolbachia endosymbiont of Brugia malayi	4'-phosphopantetheinyl transferase	0.0024	0.0028	0.2668
Brugia malayi	Will die slowly protein	0.0058	0.0167	0.0623
Loa Loa (eye worm)	hypothetical protein	0.0084	0.0275	0.1079
Leishmania major	phosphopantetheinyl transferase-like protein	0.0024	0.0028	0.0069
Schistosoma mansoni	tar DNA-binding protein	0.0063	0.019	0.0713
Trypanosoma cruzi	DNA topoisomerase II, putative	0.0035	0.0076	0.0257
Trypanosoma brucei	DNA topoisomerase II alpha, putative	0.0035	0.0076	0.0257
Trypanosoma brucei	pyruvate dehydrogenase (lipoamide) kinase, putative	0.0222	0.0835	0.329
Echinococcus granulosus	DNA topoisomerase 2 alpha	0.0035	0.0076	0.0241
Loa Loa (eye worm)	hypothetical protein	0.002	0.0015	0.0043
Loa Loa (eye worm)	hypothetical protein	0.002	0.0012	0.0032
Schistosoma mansoni	survival motor neuron protein	0.0095	0.0318	0.1225
Mycobacterium tuberculosis	Two component sensor kinase [second part]	0.0035	0.0076	1
Echinococcus multilocularis	protein will die slowly	0.0058	0.0167	0.0156
Schistosoma mansoni	aminoadipate-semialdehyde dehydrogenase	0.0084	0.0275	0.1054
Loa Loa (eye worm)	hypothetical protein	0.002	0.0015	0.0043
Loa Loa (eye worm)	hypothetical protein	0.0024	0.0028	0.0097
Brugia malayi	RNA binding protein	0.0063	0.019	0.0713
Brugia malayi	Protein-tyrosine phosphatase containing protein	0.037	0.144	0.5705
Plasmodium vivax	replication factor C subunit 1, putative	0.002	0.0012	0.1133
Trypanosoma cruzi	heat shock protein 85, putative	0.0035	0.0076	0.0257
Mycobacterium tuberculosis	Possible two component system response sensor kinase membrane associated PhoR	0.0035	0.0076	1
Onchocerca volvulus	DNA topoisomerase 2 homolog	0.0035	0.0076	0.1968
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-40	0.002	0.0015	0.0043
Mycobacterium tuberculosis	Two component sensor histidine kinase DosT	0.0035	0.0076	1
Brugia malayi	ATP dependent DNA ligase C terminal region family protein	0.002	0.0012	0.0003
Echinococcus granulosus	retinoic acid receptor rxr beta a	0.002	0.0015	0.0013
Loa Loa (eye worm)	hypothetical protein	0.002	0.0012	0.0032
Trichomonas vaginalis	chromosome transmission fidelity factor, putative	0.002	0.0012	0.0056
Giardia lamblia	Replication factor C, subunit 1	0.002	0.0012	0.0135
Loa Loa (eye worm)	hypothetical protein	0.002	0.0012	0.0032
Brugia malayi	Nuclear hormone receptor family member nhr-49	0.002	0.0015	0.0014
Mycobacterium tuberculosis	Conserved protein	0.0035	0.0076	1
Trichomonas vaginalis	sensory transduction histidine kinase bacterial, putative	0.0035	0.0076	0.4127
Brugia malayi	Nuclear hormone receptor family member nhr-40	0.002	0.0015	0.0014
Toxoplasma gondii	ATPase/histidine kinase/DNA gyrase B/HSP90 domain-containing protein	0.0257	0.0979	1
Loa Loa (eye worm)	hypothetical protein	0.0042	0.0104	0.0398
Mycobacterium tuberculosis	Probable two component sensor kinase	0.0035	0.0076	1
Brugia malayi	Nuclear hormone receptor family member nhr-1	0.002	0.0015	0.0014
Loa Loa (eye worm)	hypothetical protein	0.0024	0.0028	0.0097
Loa Loa (eye worm)	RNA recognition domain-containing protein domain-containing protein	0.0063	0.019	0.0739
Schistosoma mansoni	nuclear hormone receptor nor-1/nor-2	0.002	0.0015	0.0014
Schistosoma mansoni	photoreceptor-specific nuclear receptor related	0.002	0.0015	0.0014
Echinococcus granulosus	raf serine:threonine protein kinase	0.0254	0.0967	0.3575
Trichomonas vaginalis	conserved hypothetical protein	0.002	0.0012	0.0056
Leishmania major	4-coumarate:coa ligase-like protein	0.0024	0.0028	0.0068
Mycobacterium leprae	PROBABLE FATTY-ACID-CoA LIGASE FADD2 (FATTY-ACID-CoA SYNTHETASE) (FATTY-ACID-CoA SYNTHASE)	0.0024	0.0028	0.2564
Trypanosoma cruzi	FHA domain containing protein, putative	0.002	0.0012	0.0003
Schistosoma mansoni	tar DNA-binding protein	0.0063	0.019	0.0713
Echinococcus multilocularis	FTZ F1 alpha	0.002	0.0015	0.0004
Echinococcus multilocularis	protein patched	0.0042	0.0104	0.0093
Brugia malayi	DKFZp564C0469 protein	0.002	0.0012	0.0003
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-1	0.002	0.0015	0.0043
Entamoeba histolytica	heat shock protein 90, putative	0.0035	0.0076	0.2003
Loa Loa (eye worm)	hypothetical protein	0.0024	0.0028	0.0097
Leishmania major	heat shock protein 83-1	0.0035	0.0076	0.0257
Entamoeba histolytica	acyl-coA synthetase, putative	0.0024	0.0028	0.0534
Trypanosoma brucei	heat shock protein, putative	0.0035	0.0076	0.0257
Echinococcus granulosus	expressed conserved protein	0.0092	0.0308	0.1111
Brugia malayi	Nuclear hormone receptor family member nhr-19	0.002	0.0015	0.0014
Loa Loa (eye worm)	raf kinase	0.0253	0.0962	0.3814
Echinococcus multilocularis	replication factor c subunit 1	0.002	0.0012	0.0001
Trypanosoma cruzi	Histidine kinase-, DNA gyrase B-, and HSP90-like ATPase, putative	0.0035	0.0076	0.0257
Onchocerca volvulus		0.0024	0.0028	0.0505
Echinococcus multilocularis	nuclear receptor 2DBD gamma	0.002	0.0015	0.0004
Mycobacterium ulcerans	acyl-CoA synthetase	0.0024	0.0028	0.3406
Trypanosoma brucei	heat shock protein, putative	0.0035	0.0076	0.0257
Mycobacterium tuberculosis	Possible two component sensor kinase	0.0035	0.0076	1
Echinococcus multilocularis	tumor protein p63	0.0676	0.2686	0.2677
Leishmania major	DNA topoisomerase ii	0.0035	0.0076	0.0257
Onchocerca volvulus	Steroid hormone receptor family member cnr14 homolog	0.002	0.0015	0.0082
Echinococcus granulosus	Pyruvate dehydrogenase lipoamide kinase	0.0634	0.2516	0.9367
Brugia malayi	hypothetical protein	0.0072	0.0225	0.0854
Brugia malayi	Nuclear hormone receptor family member nhr-25	0.002	0.0015	0.0014
Toxoplasma gondii	heat shock protein HSP90	0.0035	0.0076	0.0665
Mycobacterium ulcerans	acyl-CoA synthetase	0.0024	0.0028	0.3406
Entamoeba histolytica	hypothetical protein	0.0072	0.0225	0.6652
Echinococcus granulosus	L aminoadipate semialdehyde	0.0084	0.0275	0.0987
Toxoplasma gondii	ATPase, AAA family protein	0.002	0.0012	0.0009
Brugia malayi	Endoplasmin precursor	0.0035	0.0076	0.0257
Treponema pallidum	DNA gyrase, subunit B (gyrB)	0.0035	0.0076	1
Trypanosoma cruzi	mitochondrial DNA topoisomerase II, putative	0.0035	0.0076	0.0257
Mycobacterium ulcerans	NAD-dependent DNA ligase LigA	0.002	0.0012	0.1132
Mycobacterium ulcerans	DNA gyrase subunit B	0.0035	0.0076	1
Echinococcus multilocularis	protein dispatched 1	0.0048	0.0128	0.0117
Loa Loa (eye worm)	hypothetical protein	0.0099	0.0335	0.1317
Loa Loa (eye worm)	exodeoxyribonuclease III family protein	0.0019	0.0011	0.0029
Mycobacterium ulcerans	two component sensor histidine kinase TrcS	0.0035	0.0076	1
Entamoeba histolytica	Niemann-Pick C1 protein, putative	0.0098	0.0333	1
Plasmodium vivax	heat shock protein 86, putative	0.0035	0.0076	1
Brugia malayi	latrophilin 2 splice variant baaae	0.0034	0.0071	0.0237
Mycobacterium ulcerans	two component system membrane associated sensor kinase	0.0035	0.0076	1
Trypanosoma brucei	developmentally regulated phosphoprotein	0.0634	0.2516	1
Plasmodium falciparum	heat shock protein 90	0.0035	0.0076	1
Echinococcus granulosus	survival motor neuron protein 1	0.0465	0.1825	0.6783
Leishmania major	heat shock protein 83-1	0.0035	0.0076	0.0257
Schistosoma mansoni	chromosome transmission fidelity factor	0.002	0.0012	0.0003
Echinococcus multilocularis	nibrin	0.002	0.0012	0.0001
Brugia malayi	ecdysteroid receptor	0.002	0.0015	0.0014
Trypanosoma cruzi	BRCA1 C Terminus (BRCT) domain containing protein, putative	0.002	0.0012	0.0003
Brugia malayi	hypothetical protein	0.002	0.0012	0.0003
Echinococcus granulosus	heat shock protein 90	0.0035	0.0076	0.0241
Schistosoma mansoni	tar DNA-binding protein	0.0063	0.019	0.0713
Echinococcus granulosus	Niemann Pick C1 protein	0.0141	0.0505	0.1845
Echinococcus multilocularis	Niemann Pick C1 protein	0.0098	0.0333	0.0322
Loa Loa (eye worm)	hypothetical protein	0.002	0.0015	0.0043
Chlamydia trachomatis	DNA gyrase subunit B	0.0035	0.0076	1
Schistosoma mansoni	hypothetical protein	0.0041	0.0098	0.0345
Plasmodium falciparum	DNA topoisomerase VI, b subunit, putative	0.0035	0.0076	1
Onchocerca volvulus		0.0099	0.0335	1
Plasmodium vivax	DNA topoisomerase II, putative	0.0035	0.0076	1
Mycobacterium ulcerans	two component regulator - sensor kinase	0.0035	0.0076	1
Schistosoma mansoni	thyroid hormone receptor	0.002	0.0015	0.0014
Trichomonas vaginalis	conserved hypothetical protein	0.002	0.0012	0.0056
Trichomonas vaginalis	conserved hypothetical protein	0.002	0.0012	0.0056
Schistosoma mansoni	tar DNA-binding protein	0.0063	0.019	0.0713
Schistosoma mansoni	tar DNA-binding protein	0.0063	0.019	0.0713
Chlamydia trachomatis	holo [acyl-carrier protein] synthase	0.0024	0.0028	0.3409
Leishmania major	heat shock protein 83-1	0.0035	0.0076	0.0257
Trypanosoma brucei	heat shock protein, putative	0.0035	0.0076	0.0257
Treponema pallidum	DNA ligase (lig)	0.002	0.0012	0.0135
Mycobacterium ulcerans	hypothetical protein	0.0024	0.0028	0.3406
Trypanosoma brucei	heat shock protein, putative	0.0035	0.0076	0.0257
Chlamydia trachomatis	two component regulatory system sensor histidine kinase	0.0035	0.0076	1
Trichomonas vaginalis	endoplasmin, putative	0.0035	0.0076	0.4127
Trypanosoma brucei	heat shock protein, putative	0.0035	0.0076	0.0257
Mycobacterium tuberculosis	DNA gyrase (subunit B) GyrB (DNA topoisomerase (ATP-hydrolysing)) (DNA topoisomerase II) (type II DNA topoisomerase)	0.0035	0.0076	1
Mycobacterium tuberculosis	Two component sensor histidine kinase DevS	0.0035	0.0076	1
Trichomonas vaginalis	conserved hypothetical protein	0.0042	0.0104	0.5937
Brugia malayi	Corticotropin releasing factor receptor 2 precursor, putative	0.005	0.0135	0.0493
Echinococcus granulosus	tumor protein p63	0.0676	0.2686	1
Leishmania major	heat shock protein 83-1	0.0035	0.0076	0.0257
Trypanosoma brucei	heat shock protein 90, putative	0.0035	0.0076	0.0257
Mycobacterium ulcerans	phosphopantetheinyl transferase, PptII	0.0024	0.0028	0.3409
Schistosoma mansoni	protein tyrosine phosphatase non-receptor type nt1	0.037	0.144	0.5705
Trypanosoma brucei	heat shock protein, putative	0.0035	0.0076	0.0257
Echinococcus multilocularis	nuclear receptor 2DBD gamma	0.002	0.0015	0.0004
Onchocerca volvulus		0.0095	0.0318	0.9477
Loa Loa (eye worm)	hypothetical protein	0.0035	0.0076	0.0285
Echinococcus granulosus	FTZ F1 alpha	0.002	0.0015	0.0013
Echinococcus granulosus	nuclear receptor 2DBD gamma	0.002	0.0015	0.0013
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0046	0.0118	0.0401
Schistosoma mansoni	retinoic acid receptor RXR	0.002	0.0015	0.0014
Leishmania major	heat shock protein 83-1	0.0035	0.0076	0.0257
Entamoeba histolytica	heat shock protein 90, putative	0.0035	0.0076	0.2003
Wolbachia endosymbiont of Brugia malayi	NAD-dependent DNA ligase, Lig	0.002	0.0012	0.0135
Mycobacterium ulcerans	fatty-acid-CoA ligase	0.0024	0.0028	0.3406
Schistosoma mansoni	topbp1	0.002	0.0012	0.0003
Trypanosoma cruzi	heat shock protein 90, putative	0.0035	0.0076	0.0257
Wolbachia endosymbiont of Brugia malayi	membrane associated signal transduction histidine kinase	0.0035	0.0076	1
Onchocerca volvulus		0.002	0.0015	0.0082
Loa Loa (eye worm)	endoplasmin	0.0035	0.0076	0.0285
Loa Loa (eye worm)	TOPoisomerase family member	0.0035	0.0076	0.0285
Schistosoma mansoni	hypothetical protein	0.0058	0.0167	0.0623
Echinococcus multilocularis	Pyruvate dehydrogenase (lipoamide) kinase	0.0634	0.2516	0.2508
Trichomonas vaginalis	conserved hypothetical protein	0.002	0.0012	0.0056
Echinococcus multilocularis	DNA topoisomerase 2 alpha	0.0035	0.0076	0.0064
Schistosoma mansoni	thyroid hormone receptor	0.002	0.0015	0.0014
Loa Loa (eye worm)	hypothetical protein	0.0034	0.0071	0.0265
Leishmania major	mitochondrial DNA topoisomerase II	0.0035	0.0076	0.0257
Brugia malayi	AMP-binding enzyme family protein	0.0024	0.0028	0.0068
Giardia lamblia	Pms1-like protein	0.0035	0.0076	1
Trichomonas vaginalis	DNA topoisomerase II, putative	0.0035	0.0076	0.4127
Schistosoma mansoni	hypothetical protein	0.0041	0.0098	0.0345
Echinococcus granulosus	Niemann Pick C1 protein	0.0098	0.0333	0.1202
Trichomonas vaginalis	receptor histidine kinase, putative	0.0035	0.0076	0.4127
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-14	0.002	0.0015	0.0043
Brugia malayi	TAR-binding protein	0.0063	0.019	0.0713
Echinococcus multilocularis	COUP TF:Svp nuclear hormone receptor	0.002	0.0015	0.0004
Schistosoma mansoni	pyruvate dehydrogenase	0.0599	0.2372	0.9426
Schistosoma mansoni	serine/threonine protein kinase	0.0254	0.0967	0.3816
Mycobacterium leprae	Probable two component sensor kinase MprB	0.0035	0.0076	1
Echinococcus multilocularis	tyrosine protein phosphatase non receptor type	0.037	0.144	0.1431
Trichomonas vaginalis	heat shock protein, putative	0.0035	0.0076	0.4127
Echinococcus granulosus	tyrosine protein phosphatase non receptor type	0.037	0.144	0.5344
Loa Loa (eye worm)	steroid hormone receptor	0.002	0.0015	0.0043
Loa Loa (eye worm)	hypothetical protein	0.002	0.0015	0.0043
Mycobacterium ulcerans	sensor kinase from two component regulatory system	0.0035	0.0076	1
Toxoplasma gondii	4'-phosphopantetheinyl transferase domain-containing protein	0.0024	0.0028	0.0177
Trypanosoma cruzi	hypothetical protein, conserved	0.002	0.0012	0.0003
Mycobacterium tuberculosis	Two component sensory transduction histidine kinase MtrB	0.0035	0.0076	1
Mycobacterium tuberculosis	Probable exodeoxyribonuclease III protein XthA (exonuclease III) (EXO III) (AP endonuclease VI)	0.0019	0.0011	0.148
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0046	0.0118	0.0107
Loa Loa (eye worm)	hypothetical protein	0.002	0.0012	0.0032
Schistosoma mansoni	pyruvate dehydrogenase	0.0599	0.2372	0.9426
Loa Loa (eye worm)	hypothetical protein	0.0035	0.0076	0.0285
Trichomonas vaginalis	chromosome transmission fidelity factor, putative	0.002	0.0012	0.0056
Trypanosoma brucei	DNA topoisomerase ii	0.0035	0.0076	0.0257
Treponema pallidum	4'-phosphopantetheinyl transferase	0.0024	0.0028	0.2668
Brugia malayi	Probable DNA topoisomerase II	0.0035	0.0076	0.0257
Brugia malayi	kinase, mitochondrial precursor	0.0634	0.2516	1
Leishmania major	heat shock protein 83-1	0.0035	0.0076	0.0257
Loa Loa (eye worm)	WD40 repeat protein	0.0058	0.0167	0.065
Echinococcus multilocularis	L aminoadipate semialdehyde	0.0084	0.0275	0.0264
Echinococcus multilocularis	FTZ F1 nuclear receptor protein	0.002	0.0015	0.0004
Giardia lamblia	Heat shock protein HSP 90-alpha	0.0035	0.0076	1
Leishmania major	heat shock protein 83-1	0.0035	0.0076	0.0257
Trypanosoma cruzi	mitochondrial DNA topoisomerase II, putative	0.0035	0.0076	0.0257
Mycobacterium leprae	TWO COMPONENT SENSOR HISTIDINE KINASE PRRB	0.0035	0.0076	1
Schistosoma mansoni	steroid hormone receptor ad4bp	0.002	0.0015	0.0014
Mycobacterium ulcerans	exodeoxyribonuclease III protein XthA	0.0019	0.0011	0.1011
Leishmania major	heat shock protein 83-1	0.0035	0.0076	0.0257
Echinococcus multilocularis	sterol regulatory element binding protein	0.0042	0.0104	0.0093
Echinococcus granulosus	sterol regulatory element binding protein	0.0042	0.0104	0.0346
Leishmania major	hypothetical protein, conserved	0.0035	0.0076	0.0257
Echinococcus multilocularis	Niemann Pick C1 protein	0.0141	0.0505	0.0494
Entamoeba histolytica	hypothetical protein	0.0024	0.0028	0.0534
Trypanosoma brucei	Histidine kinase-, DNA gyrase B-, and HSP90-like ATPase, putative	0.0035	0.0076	0.0257
Echinococcus granulosus	Nuclear hormone receptor family member nhr 41	0.002	0.0015	0.0013
Treponema pallidum	chemotaxis histidine kinase (cheA)	0.0035	0.0076	1
Leishmania major	pyruvate dehydrogenase (lipoamide) kinase, putative	0.0222	0.0835	0.329
Echinococcus multilocularis	heat shock protein 90	0.0035	0.0076	0.0064
Loa Loa (eye worm)	nuclear Hormone Receptor family member	0.002	0.0015	0.0043
Brugia malayi	DNA topoisomerase II, alpha isozyme	0.0035	0.0076	0.0257
Trichomonas vaginalis	two component sensor and regulator histidine kinase bacteria, putative	0.0035	0.0076	0.4127
Brugia malayi	Nuclear hormone receptor family member nhr-3	0.002	0.0015	0.0014
Mycobacterium leprae	conserved hypothetical protein	0.0024	0.0028	0.2568
Brugia malayi	AMP-binding enzyme family protein	0.0024	0.0028	0.0068
Brugia malayi	heat shock protein 90	0.0035	0.0076	0.0257
Schistosoma mansoni	hypothetical protein	0.0095	0.0318	0.1225
Brugia malayi	GTP-binding regulatory protein Gs alpha-S chain, putative	0.0046	0.0118	0.0428
Schistosoma mansoni	cellular tumor antigen P53	0.0099	0.0335	0.1292
Chlamydia trachomatis	DNA ligase	0.002	0.0012	0.1132
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0046	0.0118	0.0428
Echinococcus granulosus	Basic leucine zipper bZIP transcription	0.0072	0.0225	0.08
Schistosoma mansoni	hypothetical protein	0.0041	0.0098	0.0345
Schistosoma mansoni	hypothetical protein	0.0034	0.0071	0.0237
Trypanosoma cruzi	heat shock protein 90, putative	0.0035	0.0076	0.0257
Onchocerca volvulus	DNA topoisomerase 2 homolog	0.0035	0.0076	0.1968
Mycobacterium ulcerans	putative regultory protein	0.0035	0.0076	1
Schistosoma mansoni	Tr4/Tr2 (homologue)	0.002	0.0015	0.0014
Brugia malayi	aminoadipate-semialdehyde dehydrogenase-phosphopantetheinyl transferase	0.0084	0.0275	0.1054
Brugia malayi	Niemann-Pick C1 protein precursor	0.0098	0.0333	0.1283
Brugia malayi	nuclear hormone receptor	0.002	0.0015	0.0014
Mycobacterium ulcerans	two component sensor histidine kinase SenX3	0.0035	0.0076	1
Echinococcus multilocularis	survival motor neuron protein 1	0.0465	0.1825	0.1816
Schistosoma mansoni	heat shock protein	0.0035	0.0076	0.0257
Chlamydia trachomatis	DNA gyrase subunit B	0.0035	0.0076	1
Loa Loa (eye worm)	hypothetical protein	0.002	0.0015	0.0043
Schistosoma mansoni	RAR-like nuclear receptor	0.002	0.0015	0.0014
Mycobacterium ulcerans	two component sensor histidine kinase PrrB	0.0035	0.0076	1
Plasmodium vivax	holo-[acyl-carrier-protein] synthase, putative	0.0024	0.0028	0.3409

Activities

Activity type	Activity value	Assay description	Source	Reference
Activity (functional)	= 1.8 %	Antagonist activity at human muscarinic M1 receptor	ChEMBL.	23062550
IC50 (functional)	= 6.24	Antagonist activity at human muscarinic M1 receptor	ChEMBL.	23062550
IC50 (functional)	= 0.57 uM	Antagonist activity at human muscarinic M1 receptor	ChEMBL.	23062550

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: CHEMBL2164912

Bibliographic References

1 literature reference was collected for this gene.

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Detailed information for compound 1682690