TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 538.445 | Formula: C27H21Cl2N3O3S
H donors: 2 H acceptors: 4 LogP: 7.87 Rotable bonds: 7
Rule of 5 violations (Lipinski): 2
SMILES: CC(c1onc(c1CNc1nc2c(s1)cc(cc2)c1cccc(c1)C(=O)O)c1c(Cl)cccc1Cl)C
InChi: 1S/C27H21Cl2N3O3S/c1-14(2)25-18(24(32-35-25)23-19(28)7-4-8-20(23)29)13-30-27-31-21-10-9-16(12-22(21)36-27)15-5-3-6-17(11-15)26(33)34/h3-12,14H,13H2,1-2H3,(H,30,31)(H,33,34)
InChiKey: HYJSTCZABVAHEJ-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	nuclear receptor subfamily 1, group H, member 4	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

Species	Potential target	Known druggable target	Length	Alignment span	Identity
Echinococcus granulosus	ecdysone induced protein 78C	nuclear receptor subfamily 1, group H, member 4	476 aa	402 aa	28.1 %

Ranking Plot

Putative Targets List

Species	Potential target	Raw	Global	Species
Onchocerca volvulus	Protein ultraspiracle homolog	0.0022	0.0211	0.0123
Brugia malayi	Nuclear hormone receptor family member nhr-40	0.0022	0.0211	0.0242
Loa Loa (eye worm)	nuclear Hormone Receptor family member	0.0022	0.0211	0.0242
Mycobacterium tuberculosis	Probable cytochrome P450 143 Cyp143	0.0056	0.1638	0.5
Mycobacterium tuberculosis	Possible cytochrome P450 126 Cyp126	0.0056	0.1638	0.5
Brugia malayi	intermediate filament protein	0.0026	0.0384	0.0441
Echinococcus multilocularis		0.0056	0.1638	0.2357
Echinococcus multilocularis	histone lysine N methyltransferase SETMAR	0.0032	0.0637	0.0916
Echinococcus granulosus	ubiquitin specific protease 41	0.0073	0.2358	0.3392
Brugia malayi	Cytochrome P450 family protein	0.0108	0.3837	0.441
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-1	0.0022	0.0211	0.0242
Schistosoma mansoni	cytochrome P450	0.0056	0.1638	0.2357
Schistosoma mansoni	rab6-interacting	0.0019	0.0089	0.0128
Loa Loa (eye worm)	hypothetical protein	0.0019	0.0089	0.0102
Loa Loa (eye worm)	cytochrome P450 family protein	0.0108	0.3837	0.441
Brugia malayi	Doublecortin family protein	0.0019	0.0089	0.0102
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-40	0.0022	0.0211	0.0242
Brugia malayi	Nuclear hormone receptor family member nhr-31	0.0022	0.0211	0.0242
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-49	0.0022	0.0211	0.0242
Schistosoma mansoni	nuclear receptor 2DBD-gamma	0.0022	0.0211	0.0303
Trypanosoma cruzi	cytochrome P450, putative	0.0108	0.3837	1
Mycobacterium tuberculosis	Probable cytochrome P450 128 Cyp128	0.0056	0.1638	0.5
Loa Loa (eye worm)	pigment dispersing factor receptor c	0.0054	0.1541	0.1772
Echinococcus multilocularis	arachidonate 5 lipoxygenase	0.0053	0.1533	0.2205
Echinococcus multilocularis	lamin dm0	0.0026	0.0384	0.0552
Schistosoma mansoni	lamin	0.0026	0.0384	0.0552
Brugia malayi	Calcitonin receptor-like protein seb-1	0.0054	0.1541	0.1772
Brugia malayi	Corticotropin releasing factor receptor 2 precursor, putative	0.0054	0.1541	0.1772
Echinococcus granulosus	nuclear receptor 2DBD gamma	0.0022	0.0211	0.0303
Brugia malayi	Nuclear hormone receptor family member nhr-19	0.0022	0.0211	0.0242
Mycobacterium tuberculosis	Probable cytochrome P450 130 Cyp130	0.0056	0.1638	0.5
Leishmania major	ubiquitin hydrolase, putative,cysteine peptidase, Clan CA, family C19, putative	0.0073	0.2358	0.3273
Loa Loa (eye worm)	steroid hormone receptor	0.0022	0.0211	0.0242
Echinococcus multilocularis	FTZ F1 nuclear receptor protein	0.0022	0.0211	0.0303
Schistosoma mansoni	hypothetical protein	0.0019	0.0089	0.0128
Schistosoma mansoni	retinoid-x-receptor (RXR)	0.0022	0.0211	0.0303
Onchocerca volvulus	Bile acid receptor homolog	0.0022	0.0211	0.0123
Echinococcus granulosus	histone lysine methyltransferase setb	0.0032	0.0637	0.0916
Loa Loa (eye worm)	hypothetical protein	0.0073	0.2358	0.271
Plasmodium falciparum	LCCL domain-containing protein	0.0019	0.0089	0.5
Schistosoma mansoni	Tr4/Tr2 (homologue)	0.0022	0.0211	0.0303
Echinococcus granulosus	intermediate filament protein	0.0026	0.0384	0.0552
Schistosoma mansoni	coup transcription factor	0.0022	0.0211	0.0303
Schistosoma mansoni	hypothetical protein	0.0182	0.6951	1
Schistosoma mansoni	lamin	0.0026	0.0384	0.0552
Brugia malayi	Intermediate filament tail domain containing protein	0.0026	0.0384	0.0441
Mycobacterium tuberculosis	Probable cytochrome P450 138 Cyp138	0.0056	0.1638	0.5
Mycobacterium leprae	Conserved hypothetical protein	0.0056	0.1638	0.5
Echinococcus multilocularis	Basic leucine zipper (bZIP) transcription	0.004	0.0984	0.1416
Trypanosoma brucei	cytochrome P450, putative	0.0108	0.3837	1
Schistosoma mansoni	nuclear hormone receptor	0.0022	0.0211	0.0303
Brugia malayi	steroid hormone receptor	0.0022	0.0211	0.0242
Schistosoma mansoni	hypothetical protein	0.004	0.0984	0.1416
Echinococcus granulosus	ecdysone induced protein 78C	0.0022	0.0211	0.0303
Mycobacterium tuberculosis	Probable cytochrome P450 132 Cyp132	0.0056	0.1638	0.5
Brugia malayi	hypothetical protein	0.004	0.0984	0.1131
Echinococcus multilocularis	tyrosyl DNA phosphodiesterase 1	0.0068	0.2142	0.3082
Trypanosoma cruzi	cytochrome P450, putative	0.0108	0.3837	1
Loa Loa (eye worm)	cytochrome P450 family protein	0.015	0.5601	0.6438
Loa Loa (eye worm)	intermediate filament protein	0.0026	0.0384	0.0441
Echinococcus granulosus	ubiquitin carboxyl terminal hydrolase 8	0.0073	0.2358	0.3392
Echinococcus granulosus	lipoxygenase domain containing protein	0.0019	0.0089	0.0128
Schistosoma mansoni	rab6-interacting	0.0019	0.0089	0.0128
Brugia malayi	Nuclear hormone receptor family member nhr-1	0.0022	0.0211	0.0242
Brugia malayi	Nuclear hormone receptor family member nhr-41	0.0022	0.0211	0.0242
Schistosoma mansoni	hypothetical protein	0.0056	0.1638	0.2357
Trichomonas vaginalis	set domain proteins, putative	0.0255	1	1
Echinococcus granulosus	COUP TF:Svp nuclear hormone receptor	0.0022	0.0211	0.0303
Loa Loa (eye worm)	hypothetical protein	0.0032	0.0637	0.0732
Echinococcus multilocularis	musashi	0.0026	0.0384	0.0552
Mycobacterium tuberculosis	Possible cytochrome P450 135B1 Cyp135B1	0.0056	0.1638	0.5
Brugia malayi	Pre-SET motif family protein	0.0224	0.87	1
Loa Loa (eye worm)	intermediate filament tail domain-containing protein	0.0026	0.0384	0.0441
Loa Loa (eye worm)	doublecortin family protein	0.0019	0.0089	0.0102
Brugia malayi	Pre-SET motif family protein	0.0032	0.0637	0.0732
Echinococcus multilocularis	hepatocyte nuclear factor 4 alpha	0.0022	0.0211	0.0303
Echinococcus multilocularis	ecdysone induced protein 78C	0.0022	0.0211	0.0303
Echinococcus granulosus	Basic leucine zipper bZIP transcription	0.004	0.0984	0.1416
Brugia malayi	ecdysteroid receptor	0.0022	0.0211	0.0242
Echinococcus granulosus	hepatocyte nuclear factor 4 alpha	0.0022	0.0211	0.0303
Echinococcus multilocularis	ubiquitin specific protease 41	0.0073	0.2358	0.3392
Loa Loa (eye worm)	hypothetical protein	0.0019	0.0089	0.0102
Onchocerca volvulus		0.0026	0.0384	0.0298
Loa Loa (eye worm)	hypothetical protein	0.0037	0.0828	0.0952
Loa Loa (eye worm)	pre-SET domain-containing protein family protein	0.0224	0.87	1
Mycobacterium tuberculosis	Probable cytochrome P450 140 Cyp140	0.0056	0.1638	0.5
Schistosoma mansoni	retinoic acid receptor RXR	0.0022	0.0211	0.0303
Echinococcus multilocularis	histone lysine methyltransferase setb histone lysine methyltransferase eggless	0.0032	0.0637	0.0916
Echinococcus granulosus	Nuclear hormone receptor family member nhr 41	0.0022	0.0211	0.0303
Brugia malayi	Ubiquitin carboxyl-terminal hydrolase family protein	0.0073	0.2358	0.271
Loa Loa (eye worm)	hypothetical protein	0.0022	0.0211	0.0242
Brugia malayi	hypothetical protein	0.0019	0.0089	0.0102
Schistosoma mansoni	histone-lysine n-methyltransferase suv9	0.0032	0.0637	0.0916
Brugia malayi	Ligand-binding domain of nuclear hormone receptor family protein	0.0022	0.0211	0.0242
Brugia malayi	hypothetical protein	0.0019	0.0089	0.0102
Echinococcus multilocularis	RUN	0.0019	0.0089	0.0128
Echinococcus granulosus	RUN	0.0019	0.0089	0.0128
Schistosoma mansoni	polycystin 1-related	0.0019	0.0089	0.0128
Echinococcus multilocularis	FTZ F1 alpha	0.0022	0.0211	0.0303
Mycobacterium tuberculosis	Probable cytochrome P450 123 Cyp123	0.0056	0.1638	0.5
Echinococcus granulosus	FTZ F1 nuclear receptor protein	0.0022	0.0211	0.0303
Trypanosoma cruzi	ubiquitin carboxyl-terminal hydrolase, putative	0.0073	0.2358	0.3273
Giardia lamblia	Ubiquitin carboxyl-terminal hydrolase 4	0.0073	0.2358	0.5
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-41	0.0022	0.0211	0.0242
Brugia malayi	Nuclear hormone receptor family member nhr-14	0.0022	0.0211	0.0242
Entamoeba histolytica	tyrosyl-DNA phosphodiesterase, putative	0.0068	0.2142	0.8429
Echinococcus multilocularis	lamin	0.0026	0.0384	0.0552
Schistosoma mansoni	lipoxygenase	0.0019	0.0089	0.0128
Leishmania major	cytochrome p450-like protein	0.0108	0.3837	1
Echinococcus multilocularis	Polycystic kidney disease protein	0.0019	0.0089	0.0128
Mycobacterium leprae	putative cytochrome p450	0.0056	0.1638	0.5
Mycobacterium tuberculosis	Probable cytochrome P450 124 Cyp124	0.0056	0.1638	0.5
Brugia malayi	nuclear receptor NHR-88	0.0022	0.0211	0.0242
Echinococcus multilocularis	COUP TF:Svp nuclear hormone receptor	0.0022	0.0211	0.0303
Loa Loa (eye worm)	CYP4Cod1	0.0108	0.3837	0.441
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-14	0.0022	0.0211	0.0242
Trypanosoma brucei	tyrosyl-DNA Phosphodiesterase (Tdp1), putative	0.0068	0.2142	0.2291
Echinococcus granulosus	retinoic acid receptor rxr beta a	0.0022	0.0211	0.0303
Loa Loa (eye worm)	hypothetical protein	0.0022	0.0211	0.0242
Schistosoma mansoni	histone-lysine n-methyltransferase setb1	0.0032	0.0637	0.0916
Trypanosoma cruzi	tyrosyl-DNA Phosphodiesterase (Tdp1), putative	0.0068	0.2142	0.2291
Mycobacterium tuberculosis	Probable cytochrome P450 125 Cyp125	0.0056	0.1638	0.5
Schistosoma mansoni	thyroid hormone receptor	0.0022	0.0211	0.0303
Echinococcus granulosus	lipoxygenase domain containing protein	0.0019	0.0089	0.0128
Loa Loa (eye worm)	cytochrome P450	0.0056	0.1638	0.1883
Brugia malayi	Nuclear hormone receptor family member nhr-19	0.0022	0.0211	0.0242
Loa Loa (eye worm)	hypothetical protein	0.0022	0.0211	0.0242
Brugia malayi	Nuclear hormone receptor family member nhr-25	0.0022	0.0211	0.0242
Loa Loa (eye worm)	hypothetical protein	0.0022	0.0211	0.0242
Brugia malayi	Cytochrome P450 family protein	0.015	0.5601	0.6438
Schistosoma mansoni	steroid hormone receptor ad4bp	0.0022	0.0211	0.0303
Echinococcus multilocularis	thyroid hormone receptor alpha	0.0022	0.0211	0.0303
Mycobacterium tuberculosis	Probable cytochrome P450 141 Cyp141	0.0056	0.1638	0.5
Brugia malayi	Cytochrome P450 family protein	0.0056	0.1638	0.1883
Echinococcus multilocularis	geminin	0.0182	0.6951	1
Brugia malayi	Nuclear hormone receptor family member nhr-49	0.0022	0.0211	0.0242
Echinococcus multilocularis	Peptidase C19, ubiquitin carboxyl terminal hydrolase 2	0.0073	0.2358	0.3392
Trypanosoma brucei	ubiquitin carboxyl-terminal hydrolase, putative	0.0073	0.2358	0.3273
Schistosoma mansoni	photoreceptor-specific nuclear receptor related	0.0022	0.0211	0.0303
Mycobacterium tuberculosis	Probable cytochrome P450 144 Cyp144	0.0056	0.1638	0.5
Loa Loa (eye worm)	hypothetical protein	0.0022	0.0211	0.0242
Mycobacterium tuberculosis	Probable cytochrome P450 139 Cyp139	0.0056	0.1638	0.5
Schistosoma mansoni	tyrosyl-DNA phosphodiesterase	0.0068	0.2142	0.3082
Brugia malayi	photoreceptor-specific nuclear receptor	0.0022	0.0211	0.0242
Echinococcus granulosus	Polycystic kidney disease protein	0.0019	0.0089	0.0128
Onchocerca volvulus	Steroid hormone receptor family member cnr14 homolog	0.0022	0.0211	0.0123
Mycobacterium tuberculosis	Cytochrome P450 121 Cyp121	0.0056	0.1638	0.5
Echinococcus granulosus	lamin dm0	0.0026	0.0384	0.0552
Loa Loa (eye worm)	cytochrome P450 family protein	0.0108	0.3837	0.441
Mycobacterium tuberculosis	Probable cytochrome P450 monooxygenase 142 Cyp142	0.0056	0.1638	0.5
Echinococcus granulosus	arachidonate 5 lipoxygenase	0.0053	0.1533	0.2205
Echinococcus multilocularis	nuclear receptor 2DBD gamma	0.0022	0.0211	0.0303
Brugia malayi	Ligand-binding domain of nuclear hormone receptor family protein	0.0022	0.0211	0.0242
Entamoeba histolytica	ubiquitin carboxyl-terminal hydrolase domain containing protein	0.0073	0.2358	1
Plasmodium vivax	SET domain protein, putative	0.0032	0.0637	1
Echinococcus granulosus	transcription factor Dp 1	0.0039	0.0939	0.1352
Brugia malayi	Nuclear hormone receptor-like 1	0.0022	0.0211	0.0242
Brugia malayi	Steroid receptor seven-up type 2	0.0022	0.0211	0.0242
Loa Loa (eye worm)	hypothetical protein	0.0052	0.1485	0.1707
Mycobacterium tuberculosis	Cytochrome P450 51 Cyp51 (CYPL1) (P450-L1A1) (sterol 14-alpha demethylase) (lanosterol 14-alpha demethylase) (P450-14DM)	0.0056	0.1638	0.5
Loa Loa (eye worm)	tyrosyl-DNA phosphodiesterase	0.0068	0.2142	0.2462
Mycobacterium tuberculosis	Possible cytochrome P450 135A1 Cyp135A1	0.0056	0.1638	0.5
Onchocerca volvulus		0.0032	0.0637	0.0553
Echinococcus granulosus	FTZ F1 alpha	0.0022	0.0211	0.0303
Mycobacterium tuberculosis	Probable cytochrome P450 137 Cyp137	0.0056	0.1638	0.5
Echinococcus multilocularis	ubiquitin carboxyl terminal hydrolase 8	0.0073	0.2358	0.3392
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-31	0.0022	0.0211	0.0242
Schistosoma mansoni	histone-lysine n-methyltransferase setb1	0.0032	0.0637	0.0916
Echinococcus granulosus	lamin	0.0026	0.0384	0.0552
Loa Loa (eye worm)	hypothetical protein	0.0022	0.0211	0.0242
Leishmania major	tyrosyl-DNA phosphodiesterase 1	0.0068	0.2142	0.2291
Loa Loa (eye worm)	hypothetical protein	0.0026	0.0384	0.0441
Brugia malayi	nuclear hormone receptor	0.0022	0.0211	0.0242
Schistosoma mansoni	hypothetical protein	0.0037	0.0828	0.1191
Brugia malayi	latrophilin 2 splice variant baaae	0.0037	0.0828	0.0952
Echinococcus multilocularis	lipoxygenase domain containing protein	0.0019	0.0089	0.0128
Trypanosoma cruzi	tyrosyl-DNA Phosphodiesterase (Tdp1), putative	0.0068	0.2142	0.2291
Schistosoma mansoni	RAR-like nuclear receptor	0.0022	0.0211	0.0303
Echinococcus granulosus	tyrosyl DNA phosphodiesterase 1	0.0068	0.2142	0.3082
Schistosoma mansoni	intermediate filament proteins	0.0026	0.0384	0.0552
Loa Loa (eye worm)	hypothetical protein	0.0022	0.0211	0.0242
Echinococcus multilocularis	lipoxygenase domain containing protein	0.0019	0.0089	0.0128
Brugia malayi	Nuclear hormone receptor family member nhr-3	0.0022	0.0211	0.0242
Echinococcus granulosus	geminin	0.0182	0.6951	1
Schistosoma mansoni	transcription factor LCR-F1	0.004	0.0984	0.1416
Echinococcus multilocularis	nuclear receptor 2DBD gamma	0.0022	0.0211	0.0303
Brugia malayi	Nuclear hormone receptor family member nhr-25	0.0022	0.0211	0.0242
Brugia malayi	Tyrosyl-DNA phosphodiesterase family protein	0.0068	0.2142	0.2462
Echinococcus multilocularis	transcription factor Dp 1	0.0039	0.0939	0.1352
Schistosoma mansoni	hypothetical protein	0.0182	0.6951	1
Toxoplasma gondii	cytochrome p450 superfamily protein	0.0056	0.1638	1
Schistosoma mansoni	ubiquitin-specific peptidase 2 (C19 family)	0.0073	0.2358	0.3392
Loa Loa (eye worm)	hypothetical protein	0.0026	0.0364	0.0418
Schistosoma mansoni	loxhd1	0.0019	0.0089	0.0128
Schistosoma mansoni	FTZ-F1 nuclear receptor-like protein	0.0022	0.0211	0.0303
Brugia malayi	cytochrome P450	0.0056	0.1638	0.1883
Schistosoma mansoni	ubiquitin-specific peptidase 8 (C19 family)	0.0073	0.2358	0.3392
Echinococcus granulosus	5'partial\|histone lysine N methyltransferase SETDB2	0.0031	0.0587	0.0845
Echinococcus granulosus	cytochrome P450 2K1	0.0056	0.1638	0.2357
Echinococcus granulosus	Peptidase C19 ubiquitin carboxyl terminal hydrolase 2	0.0073	0.2358	0.3392
Loa Loa (eye worm)	hypothetical protein	0.0054	0.1541	0.1772
Mycobacterium tuberculosis	Probable cytochrome P450 136 Cyp136	0.0056	0.1638	0.5
Echinococcus granulosus	nuclear receptor 2DBD gamma	0.0022	0.0211	0.0303
Schistosoma mansoni	thyroid hormone receptor	0.0022	0.0211	0.0303
Echinococcus multilocularis	Nuclear hormone receptor family member nhr 41	0.0022	0.0211	0.0303
Schistosoma mansoni	lipoxygenase	0.0053	0.1533	0.2205
Schistosoma mansoni	histone-lysine n-methyltransferase setb1	0.0032	0.0637	0.0916
Brugia malayi	Cytochrome P450 family protein	0.0108	0.3837	0.441
Onchocerca volvulus		0.0022	0.0211	0.0123
Trypanosoma cruzi	ubiquitin carboxyl-terminal hydrolase, putative	0.0073	0.2358	0.3273
Schistosoma mansoni	nuclear hormone receptor nor-1/nor-2	0.0022	0.0211	0.0303
Mycobacterium ulcerans	cytochrome P450 185A4 Cyp185A4	0.0108	0.3837	1
Onchocerca volvulus		0.0026	0.0384	0.0298
Loa Loa (eye worm)	hypothetical protein	0.0022	0.0211	0.0242

Activities

Activity type	Activity value	Assay description	Source	Reference
Activity (binding)	= 91 %	Induction of SRC1 coactivator peptide binding to ligand binding domain of human FXR by FRET assay relative to GW-4064	ChEMBL.	19586769
Activity (binding)	= 123 %	Increase in human FXR-mediated transient transcription of luciferase reporter gene transfected in african green monkey CV1 cells relative to GW-4064	ChEMBL.	19586769
EC50 (binding)	= 380 nM	Increase in human FXR-mediated transient transcription of luciferase reporter gene transfected in african green monkey CV1 cells	ChEMBL.	19586769
EC50 (binding)	= 960 nM	Induction of SRC1 coactivator peptide binding to ligand binding domain of human FXR by FRET assay	ChEMBL.	19586769

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: CHEMBL563241

Bibliographic References

1 literature reference was collected for this gene.

If you have references for this compound, please enter them in a user comment (below) or Contact us.

Detailed information for compound 1193160