TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 419.968 | Formula: C21H26ClN3O2S
H donors: 1 H acceptors: 2 LogP: 3.04 Rotable bonds: 7
Rule of 5 violations (Lipinski): 1
SMILES: OCCN(Cc1csc(n1)c1cn(c2c1cccc2Cl)CC1CCOCC1)C
InChi: 1S/C21H26ClN3O2S/c1-24(7-8-26)12-16-14-28-21(23-16)18-13-25(11-15-5-9-27-10-6-15)20-17(18)3-2-4-19(20)22/h2-4,13-15,26H,5-12H2,1H3
InChiKey: PTDAFTZPNCBOIA-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	cannabinoid receptor 1 (brain)	Starlite/ChEMBL	References
Homo sapiens	potassium voltage-gated channel, subfamily H (eag-related), member 2	Starlite/ChEMBL	References

Predicted pathogen targets for this compound

By orthology

Species	Potential target	Known druggable target/s	Ortholog Group
Trichomonas vaginalis	voltage and ligand gated potassium channel, putative	Get druggable targets OG5_128858	All targets in OG5_128858
Schistosoma japonicum	ko:K04910 potassium voltage-gated channel, Eag-related subfamily H, member 7, putative	Get druggable targets OG5_128858	All targets in OG5_128858
Trichomonas vaginalis	voltage and ligand gated potassium channel, putative	Get druggable targets OG5_128858	All targets in OG5_128858
Schistosoma japonicum	Potassium voltage-gated channel subfamily H member 2, putative	Get druggable targets OG5_128858	All targets in OG5_128858
Loa Loa (eye worm)	hypothetical protein	Get druggable targets OG5_128858	All targets in OG5_128858
Schistosoma mansoni	voltage-gated potassium channel	Get druggable targets OG5_128858	All targets in OG5_128858
Echinococcus multilocularis	potassium voltage gated channel subfamily H	Get druggable targets OG5_128858	All targets in OG5_128858
Loa Loa (eye worm)	voltage and ligand gated potassium channel	Get druggable targets OG5_128858	All targets in OG5_128858
Schistosoma mansoni	voltage-gated potassium channel	Get druggable targets OG5_128858	All targets in OG5_128858
Schistosoma japonicum	ko:K04910 potassium voltage-gated channel, Eag-related subfamily H, member 7, putative	Get druggable targets OG5_128858	All targets in OG5_128858
Echinococcus granulosus	potassium voltage gated channel subfamily H	Get druggable targets OG5_128858	All targets in OG5_128858
Brugia malayi	Voltage-gated potassium channel, HERG (KCNH2)-related. C. elegans unc-103 ortholog	Get druggable targets OG5_128858	All targets in OG5_128858

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
Mycobacterium tuberculosis	Probable cytochrome P450 138 Cyp138	0.0017	0.0571	0.5
Echinococcus granulosus	nuclear receptor 2DBD gamma	0.0085	0.9847	1
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0053	0.5505	0.559
Brugia malayi	photoreceptor-specific nuclear receptor	0.0085	0.9847	0.9847
Echinococcus multilocularis	FTZ F1 alpha	0.0085	0.9847	1
Mycobacterium ulcerans	cytochrome P450 189A7 Cyp189A7	0.0017	0.0571	0.5
Brugia malayi	Nuclear hormone receptor family member nhr-25	0.0085	0.9847	0.9847
Brugia malayi	conserved hypotetical protein	0.004	0.3715	0.3715
Toxoplasma gondii	cytochrome p450 superfamily protein	0.0017	0.0571	0.5
Echinococcus granulosus	Nuclear hormone receptor family member nhr 41	0.0085	0.9847	1
Brugia malayi	nuclear hormone receptor family member odr-7	0.004	0.3715	0.3715
Loa Loa (eye worm)	hypothetical protein	0.004	0.3715	0.3715
Echinococcus multilocularis	potassium voltage gated channel subfamily H	0.0045	0.4316	0.4382
Schistosoma mansoni	steroid hormone receptor ad4bp	0.0085	0.9847	1
Loa Loa (eye worm)	hypothetical protein	0.004	0.3715	0.3715
Loa Loa (eye worm)	hypothetical protein	0.004	0.3715	0.3715
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-41	0.0085	0.9847	0.9847
Mycobacterium ulcerans	cytochrome P450 108B4 Cyp108B4	0.0017	0.0571	0.5
Mycobacterium ulcerans	cytochrome P450 191A3 Cyp191A3	0.0017	0.0571	0.5
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-31	0.0085	0.9847	0.9847
Mycobacterium tuberculosis	Cytochrome P450 51 Cyp51 (CYPL1) (P450-L1A1) (sterol 14-alpha demethylase) (lanosterol 14-alpha demethylase) (P450-14DM)	0.0017	0.0571	0.5
Echinococcus granulosus	nuclear receptor nhr 48	0.004	0.3715	0.3773
Schistosoma mansoni	RAR-like nuclear receptor	0.0085	0.9847	1
Schistosoma mansoni	FTZ-F1 nuclear receptor-like protein	0.0085	0.9847	1
Mycobacterium ulcerans	cytochrome P450 188A3 Cyp188A3	0.0017	0.0571	0.5
Echinococcus multilocularis	nuclear receptor subfamily 1 group D	0.0045	0.4372	0.444
Loa Loa (eye worm)	GTP-binding regulatory protein Gs alpha-S chain	0.0053	0.5505	0.5505
Mycobacterium ulcerans	cytochrome P450 144A4 Cyp144A4	0.0017	0.0571	0.5
Brugia malayi	Nuclear hormone receptor family member nhr-19	0.0085	0.9847	0.9847
Mycobacterium tuberculosis	Probable cytochrome P450 monooxygenase 142 Cyp142	0.0017	0.0571	0.5
Mycobacterium tuberculosis	Probable cytochrome P450 132 Cyp132	0.0017	0.0571	0.5
Schistosoma mansoni	thyroid hormone receptor	0.0085	0.9847	1
Brugia malayi	nuclear receptor RXR	0.0045	0.4372	0.4372
Schistosoma mansoni	nuclear hormone receptor	0.004	0.3715	0.3773
Brugia malayi	Nuclear hormone receptor family member nhr-19	0.0085	0.9847	0.9847
Echinococcus granulosus	nuclear receptor 2DBD gamma	0.004	0.3715	0.3773
Loa Loa (eye worm)	hypothetical protein	0.0085	0.9847	0.9847
Loa Loa (eye worm)	cytochrome P450 family protein	0.0017	0.0571	0.0571
Brugia malayi	tailless protein	0.004	0.3715	0.3715
Leishmania major	cytochrome p450-like protein	0.0017	0.0571	0.5
Brugia malayi	Nuclear hormone receptor E75	0.004	0.3715	0.3715
Loa Loa (eye worm)	hypothetical protein	0.0085	0.9847	0.9847
Brugia malayi	Nuclear hormone receptor-like 1	0.0045	0.4372	0.4372
Leishmania major	cytochrome p450-like protein	0.0017	0.0571	0.5
Mycobacterium ulcerans	cytochrome P450 143A4 Cyp143A4	0.0017	0.0571	0.5
Trypanosoma brucei	cytochrome P450, putative	0.0017	0.0571	0.5
Schistosoma mansoni	retinoic acid receptor RXR	0.0085	0.9847	1
Brugia malayi	Ligand-binding domain of nuclear hormone receptor family protein	0.0085	0.9847	0.9847
Mycobacterium ulcerans	cytochrome P450 51B1 Cyp51B1	0.0017	0.0571	0.5
Echinococcus granulosus	COUP TF:Svp nuclear hormone receptor	0.0085	0.9847	1
Schistosoma mansoni	nuclear hormone receptor	0.0085	0.9847	1
Loa Loa (eye worm)	hypothetical protein	0.0085	0.9847	0.9847
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-1	0.0085	0.9847	0.9847
Schistosoma mansoni	hypothetical protein	0.0017	0.0571	0.058
Mycobacterium tuberculosis	Possible cytochrome P450 135B1 Cyp135B1	0.0017	0.0571	0.5
Brugia malayi	Ligand-binding domain of nuclear hormone receptor family protein	0.0085	0.9847	0.9847
Loa Loa (eye worm)	hypothetical protein	0.004	0.3715	0.3715
Echinococcus granulosus	potassium voltage gated channel subfamily H	0.0045	0.4316	0.4382
Trichomonas vaginalis	voltage and ligand gated potassium channel, putative	0.0042	0.3916	0.5
Brugia malayi	Nuclear hormone receptor-like 1	0.0045	0.4372	0.4372
Loa Loa (eye worm)	cytochrome P450 family protein	0.0017	0.0571	0.0571
Echinococcus multilocularis	nuclear receptor 2DBD gamma	0.0085	0.9847	1
Loa Loa (eye worm)	hypothetical protein	0.004	0.3715	0.3715
Brugia malayi	hypothetical protein	0.004	0.3715	0.3715
Onchocerca volvulus		0.0085	0.9847	1
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0053	0.5505	0.559
Brugia malayi	nuclear receptor NHR-88	0.0085	0.9847	0.9847
Mycobacterium tuberculosis	Probable cytochrome P450 140 Cyp140	0.0017	0.0571	0.5
Loa Loa (eye worm)	hypothetical protein	0.0045	0.4372	0.4372
Mycobacterium ulcerans	cytochrome P450 143A3 Cyp143A3	0.0017	0.0571	0.5
Loa Loa (eye worm)	hypothetical protein	0.004	0.3715	0.3715
Brugia malayi	nuclear receptor NHR-67	0.004	0.3715	0.3715
Brugia malayi	Nuclear hormone receptor E75	0.004	0.3715	0.3715
Loa Loa (eye worm)	hypothetical protein	0.0045	0.4372	0.4372
Trypanosoma brucei	Lanosterol 14-alpha demethylase	0.0017	0.0571	0.5
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0053	0.5505	0.559
Loa Loa (eye worm)	hypothetical protein	0.004	0.3715	0.3715
Mycobacterium tuberculosis	Probable cytochrome P450 125 Cyp125	0.0017	0.0571	0.5
Trichomonas vaginalis	voltage and ligand gated potassium channel, putative	0.0042	0.3916	0.5
Mycobacterium ulcerans	cytochrome P450 124A1, Cyp124A1	0.0017	0.0571	0.5
Trypanosoma cruzi	cytochrome P450, putative	0.0017	0.0571	0.5
Brugia malayi	nuclear receptor NHR-88	0.004	0.3715	0.3715
Mycobacterium tuberculosis	Probable cytochrome P450 141 Cyp141	0.0017	0.0571	0.5
Brugia malayi	Cytochrome P450 family protein	0.0017	0.0571	0.0571
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-14	0.0085	0.9847	0.9847
Echinococcus granulosus	hepatocyte nuclear factor 4 alpha	0.0085	0.9847	1
Echinococcus granulosus	nuclear receptor subfamily 1 group D	0.0045	0.4372	0.444
Loa Loa (eye worm)	hypothetical protein	0.0085	0.9847	0.9847
Echinococcus granulosus	thyroid hormone receptor alpha	0.004	0.3715	0.3773
Loa Loa (eye worm)	nuclear receptor nhr-7B	0.004	0.3715	0.3715
Echinococcus granulosus	Nuclear hormone receptor HR96	0.004	0.3715	0.3773
Loa Loa (eye worm)	hypothetical protein	0.0085	0.9847	0.9847
Schistosoma mansoni	thyroid hormone receptor	0.0085	0.9847	1
Mycobacterium ulcerans	cytochrome P450 125A7 Cyp125A7	0.0017	0.0571	0.5
Echinococcus granulosus	FTZ F1 alpha	0.0085	0.9847	1
Brugia malayi	hypothetical protein	0.0045	0.4372	0.4372
Schistosoma mansoni	retinoid-x-receptor (RXR)	0.0045	0.4372	0.444
Brugia malayi	Nuclear hormone receptor family member nhr-31	0.0085	0.9847	0.9847
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-40	0.0085	0.9847	0.9847
Brugia malayi	GTP-binding regulatory protein Gs alpha-S chain, putative	0.0053	0.5505	0.5505
Loa Loa (eye worm)	nuclear hormone receptor-like 1	0.0045	0.4372	0.4372
Loa Loa (eye worm)	hypothetical protein	0.0045	0.4372	0.4372
Loa Loa (eye worm)	nuclear Hormone Receptor family member	0.0085	0.9847	0.9847
Brugia malayi	Nuclear hormone receptor family member nhr-41	0.0085	0.9847	0.9847
Mycobacterium tuberculosis	Probable cytochrome P450 123 Cyp123	0.0017	0.0571	0.5
Loa Loa (eye worm)	hypothetical protein	0.0039	0.3513	0.3513
Mycobacterium tuberculosis	Probable cytochrome P450 139 Cyp139	0.0017	0.0571	0.5
Onchocerca volvulus	Bile acid receptor homolog	0.0085	0.9847	1
Schistosoma mansoni	nuclear receptor 2DBD-gamma	0.0085	0.9847	1
Mycobacterium tuberculosis	Possible cytochrome P450 135A1 Cyp135A1	0.0017	0.0571	0.5
Schistosoma mansoni	nuclear receptor	0.004	0.3715	0.3773
Brugia malayi	ecdysteroid receptor	0.0085	0.9847	0.9847
Onchocerca volvulus	Protein ultraspiracle homolog	0.0085	0.9847	1
Brugia malayi	Voltage-gated potassium channel, HERG (KCNH2)-related. C. elegans unc-103 ortholog	0.0045	0.4316	0.4316
Loa Loa (eye worm)	hypothetical protein	0.004	0.3715	0.3715
Mycobacterium ulcerans	cytochrome P450 123A3 Cyp123A3	0.0017	0.0571	0.5
Mycobacterium tuberculosis	Probable cytochrome P450 136 Cyp136	0.0017	0.0571	0.5
Mycobacterium ulcerans	cytochrome P450 126A3 Cyp126A3	0.0017	0.0571	0.5
Mycobacterium tuberculosis	Probable cytochrome P450 144 Cyp144	0.0017	0.0571	0.5
Brugia malayi	Nuclear hormone receptor-like 1	0.0085	0.9847	0.9847
Loa Loa (eye worm)	cytochrome P450	0.0017	0.0571	0.0571
Onchocerca volvulus	Steroid hormone receptor family member cnr14 homolog	0.0085	0.9847	1
Echinococcus granulosus	nuclear receptor 2DBD gamma	0.0085	0.9847	1
Brugia malayi	nuclear hormone receptor family member nhr-6	0.004	0.3715	0.3715
Loa Loa (eye worm)	hypothetical protein	0.004	0.3715	0.3715
Echinococcus granulosus	Nuclear hormone receptor HR96	0.004	0.3715	0.3773
Schistosoma mansoni	zinc finger protein	0.004	0.3715	0.3773
Brugia malayi	Nuclear hormone receptor family member nhr-3	0.0085	0.9847	0.9847
Loa Loa (eye worm)	nuclear receptor NHR-67	0.004	0.3715	0.3715
Schistosoma mansoni	voltage-gated potassium channel	0.0049	0.4874	0.4949
Schistosoma mansoni	voltage-gated potassium channel	0.0049	0.4874	0.4949
Brugia malayi	nuclear hormone receptor	0.0085	0.9847	0.9847
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0053	0.5505	0.559
Mycobacterium tuberculosis	Probable cytochrome P450 143 Cyp143	0.0017	0.0571	0.5
Echinococcus granulosus	ecdysone induced protein 78C	0.0085	0.9847	1
Echinococcus multilocularis	nuclear receptor 2DBD gamma	0.0085	0.9847	1
Loa Loa (eye worm)	hypothetical protein	0.0085	0.9847	0.9847
Mycobacterium ulcerans	cytochrome P450 185A4 Cyp185A4	0.0017	0.0571	0.5
Brugia malayi	Cytochrome P450 family protein	0.0017	0.0571	0.0571
Echinococcus multilocularis	Nuclear hormone receptor HR96	0.004	0.3715	0.3773
Echinococcus multilocularis	thyroid hormone receptor alpha	0.0085	0.9847	1
Schistosoma mansoni	photoreceptor-specific nuclear receptor related	0.0085	0.9847	1
Brugia malayi	Nuclear hormone receptor family member nhr-40	0.0085	0.9847	0.9847
Leishmania major	lanosterol 14-alpha-demethylase, putative	0.0017	0.0571	0.5
Echinococcus multilocularis	nuclear receptor nhr 48	0.004	0.3715	0.3773
Loa Loa (eye worm)	CYP4Cod1	0.0017	0.0571	0.0571
Echinococcus multilocularis	ecdysone induced protein 78C	0.0085	0.9847	1
Trypanosoma cruzi	cytochrome P450, putative	0.0017	0.0571	0.5
Echinococcus multilocularis		0.0017	0.0571	0.058
Brugia malayi	orphan nuclear receptor NR2E1	0.004	0.3715	0.3715
Trypanosoma cruzi	Lanosterol 14-alpha demethylase	0.0017	0.0571	0.5
Mycobacterium ulcerans	cytochrome P450 187A4 Cyp187A4	0.0017	0.0571	0.5
Echinococcus multilocularis	retinoic acid receptor rxr beta a retinoic acid receptor rxr alpha a retinoic acid receptor rxr alpha	0.004	0.3715	0.3773
Loa Loa (eye worm)	hypothetical protein	0.0045	0.4372	0.4372
Loa Loa (eye worm)	hypothetical protein	0.0045	0.4372	0.4372
Brugia malayi	nuclear receptor RXR	0.004	0.3715	0.3715
Trypanosoma cruzi	cytochrome p450-like protein, putative	0.0017	0.0571	0.5
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0053	0.5505	0.559
Schistosoma mansoni	ecdysone-induced protein 78c (dr-78)	0.0045	0.4372	0.444
Mycobacterium tuberculosis	Cytochrome P450 121 Cyp121	0.0017	0.0571	0.5
Schistosoma mansoni	coup transcription factor	0.0085	0.9847	1
Loa Loa (eye worm)	hypothetical protein	0.0085	0.9847	0.9847
Mycobacterium leprae	Conserved hypothetical protein	0.0017	0.0571	0.5
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-49	0.0085	0.9847	0.9847
Mycobacterium ulcerans	cytochrome P450 187A5 Cyp187A5	0.0017	0.0571	0.5
Schistosoma mansoni	Tr4/Tr2 (homologue)	0.0085	0.9847	1
Echinococcus granulosus	nuclear receptor subfamily 4 group A	0.004	0.3715	0.3773
Trypanosoma cruzi	Lanosterol 14-alpha demethylase	0.0017	0.0571	0.5
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0053	0.5505	0.559
Echinococcus granulosus	cytochrome P450 2K1	0.0017	0.0571	0.058
Mycobacterium ulcerans	cytochrome P450 136A2 Cyp136A2	0.0017	0.0571	0.5
Loa Loa (eye worm)	DR-78	0.004	0.3715	0.3715
Echinococcus granulosus	FTZ F1 nuclear receptor protein	0.0085	0.9847	1
Echinococcus granulosus	retinoic acid receptor rxr beta a	0.0085	0.9847	1
Schistosoma mansoni	retinoid-x-receptor (RXR)	0.0085	0.9847	1
Mycobacterium ulcerans	cytochrome P450 105Q4 Cyp105Q4	0.0017	0.0571	0.5
Schistosoma mansoni	cytochrome P450	0.0017	0.0571	0.058
Loa Loa (eye worm)	steroid hormone receptor	0.0085	0.9847	0.9847
Brugia malayi	Nuclear hormone receptor family member nhr-49	0.0085	0.9847	0.9847
Echinococcus multilocularis	COUP TF:Svp nuclear hormone receptor	0.0085	0.9847	1
Brugia malayi	steroid hormone receptor	0.0085	0.9847	0.9847
Mycobacterium leprae	putative cytochrome p450	0.0017	0.0571	0.5
Loa Loa (eye worm)	nuclear hormone receptor	0.004	0.3715	0.3715
Loa Loa (eye worm)	hypothetical protein	0.004	0.3715	0.3715
Brugia malayi	nuclear hormone receptor	0.004	0.3715	0.3715
Loa Loa (eye worm)	hypothetical protein	0.004	0.3715	0.3715
Mycobacterium ulcerans	cytochrome P450 142A3 Cyp142A3	0.0017	0.0571	0.5
Echinococcus multilocularis	nuclear receptor subfamily 4 group A	0.004	0.3715	0.3773
Loa Loa (eye worm)	hypothetical protein	0.0085	0.9847	0.9847
Loa Loa (eye worm)	hypothetical protein	0.004	0.3715	0.3715
Schistosoma mansoni	nuclear hormone receptor superfamily protein-related	0.004	0.3715	0.3773
Mycobacterium ulcerans	cytochrome p450 150 cyp150	0.0017	0.0571	0.5
Brugia malayi	Steroid receptor seven-up type 2	0.0085	0.9847	0.9847
Brugia malayi	Cytochrome P450 family protein	0.0017	0.0571	0.0571
Echinococcus multilocularis	Nuclear hormone receptor HR96	0.004	0.3715	0.3773
Echinococcus multilocularis	nuclear receptor 2DBD gamma	0.004	0.3715	0.3773
Echinococcus multilocularis	Nuclear hormone receptor family member nhr 41	0.0085	0.9847	1
Mycobacterium tuberculosis	Probable cytochrome P450 137 Cyp137	0.0017	0.0571	0.5
Mycobacterium ulcerans	cytochrome P450 150A6 Cyp150A6	0.0017	0.0571	0.5
Schistosoma mansoni	nuclear hormone receptor	0.004	0.3715	0.3773
Echinococcus multilocularis	hepatocyte nuclear factor 4 alpha	0.0085	0.9847	1
Brugia malayi	Nuclear hormone receptor family member nhr-25	0.0085	0.9847	0.9847
Mycobacterium ulcerans	cytochrome P450 140A5 Cyp140A5	0.0017	0.0571	0.5
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0053	0.5505	0.559
Brugia malayi	Nuclear hormone receptor family member nhr-14	0.0085	0.9847	0.9847
Brugia malayi	hypothetical protein	0.004	0.3715	0.3715
Schistosoma mansoni	hepatocyte nuclear factor 4-alpha (hnf-4-alpha)	0.004	0.3715	0.3773
Brugia malayi	ecdysone receptor	0.004	0.3715	0.3715
Brugia malayi	cytochrome P450	0.0017	0.0571	0.0571
Schistosoma mansoni	nuclear receptor nhr-48	0.004	0.3715	0.3773
Schistosoma mansoni	nuclear receptor	0.004	0.3715	0.3773
Mycobacterium tuberculosis	Probable cytochrome P450 130 Cyp130	0.0017	0.0571	0.5
Loa Loa (eye worm)	hypothetical protein	0.004	0.3715	0.3715
Mycobacterium tuberculosis	Possible cytochrome P450 126 Cyp126	0.0017	0.0571	0.5
Echinococcus multilocularis	FTZ F1 nuclear receptor protein	0.0085	0.9847	1
Brugia malayi	nuclear receptor subfamily 1, group D, member 1, putative	0.004	0.3715	0.3715
Mycobacterium tuberculosis	Probable cytochrome P450 124 Cyp124	0.0017	0.0571	0.5
Brugia malayi	hypothetical protein	0.0045	0.4372	0.4372
Schistosoma mansoni	nuclear hormone receptor nor-1/nor-2	0.0085	0.9847	1
Mycobacterium tuberculosis	Probable cytochrome P450 128 Cyp128	0.0017	0.0571	0.5
Loa Loa (eye worm)	voltage and ligand gated potassium channel	0.0045	0.4316	0.4316
Leishmania major	cytochrome p450-like protein	0.0017	0.0571	0.5
Brugia malayi	Nuclear hormone receptor family member nhr-1	0.0085	0.9847	0.9847

Activities

Activity type	Activity value	Assay description	Source	Reference
EC50 (functional)	= 7.4	Agonist activity at human CB1 receptor expressed in CHO cells by luciferase reporter gene assay	ChEMBL.	21411321
Ki (binding)	= 5.7	Displacement of [3H]-dofetilide from human ERG expressed in HEK293 cells	ChEMBL.	21411321

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: CHEMBL1762806

Bibliographic References

1 literature reference was collected for this gene.

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Detailed information for compound 1508654