TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 446.334 | Formula: C22H24BrNO4
H donors: 1 H acceptors: 2 LogP: 4.84 Rotable bonds: 7
Rule of 5 violations (Lipinski): 1
SMILES: COc1cc(OC)c(c(c1C(=O)/C=C/c1cccc(c1)Br)O)CN1CCCC1
InChi: 1S/C22H24BrNO4/c1-27-19-13-20(28-2)21(22(26)17(19)14-24-10-3-4-11-24)18(25)9-8-15-6-5-7-16(23)12-15/h5-9,12-13,26H,3-4,10-11,14H2,1-2H3/b9-8+
InChiKey: BXEJLZDALODZPJ-CMDGGOBGSA-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

No curated genes were found associated with this compound

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
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0096	0.353	0.7139
Brugia malayi	Nuclear hormone receptor family member nhr-1	0.001	0.0027	0.0027
Loa Loa (eye worm)	inositol-1	0.0038	0.1153	0.1153
Mycobacterium tuberculosis	Inositol-1-monophosphatase SuhB	0.0034	0.0991	1
Brugia malayi	Nuclear hormone receptor family member nhr-14	0.001	0.0027	0.0027
Mycobacterium ulcerans	cytochrome P450 188A3 Cyp188A3	0.0011	0.0058	0.0506
Loa Loa (eye worm)	hypothetical protein	0.0049	0.1616	0.1616
Trypanosoma cruzi	cytochrome P450, putative	0.0011	0.0058	0.0506
Brugia malayi	Corticotropin releasing factor receptor 2 precursor, putative	0.0049	0.1616	0.1616
Echinococcus multilocularis	nuclear receptor 2DBD gamma	0.001	0.0027	0.0045
Echinococcus granulosus	Nuclear hormone receptor family member nhr 41	0.001	0.0027	0.0045
Echinococcus granulosus	diuretic hormone 44 receptor GPRdih2	0.0016	0.0239	0.0408
Loa Loa (eye worm)	CYP4Cod1	0.0011	0.0058	0.0058
Echinococcus granulosus	tar DNA binding protein	0.0131	0.4944	0.8416
Echinococcus multilocularis	Niemann Pick C1 protein	0.0098	0.3579	0.6092
Echinococcus multilocularis	GPCR, family 2	0.0016	0.0239	0.0408
Trypanosoma cruzi	Lanosterol 14-alpha demethylase	0.0011	0.0058	0.0506
Echinococcus multilocularis	FTZ F1 alpha	0.001	0.0027	0.0045
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-49	0.001	0.0027	0.0027
Brugia malayi	Nuclear hormone receptor family member nhr-25	0.001	0.0027	0.0027
Echinococcus multilocularis	muscleblind protein	0.0154	0.5874	1
Trypanosoma cruzi	Lanosterol 14-alpha demethylase	0.0011	0.0058	0.0506
Schistosoma mansoni	hypothetical protein	0.004	0.1247	0.2523
Echinococcus multilocularis	expressed conserved protein	0.0092	0.3337	0.5682
Schistosoma mansoni	retinoid-x-receptor (RXR)	0.001	0.0027	0.0054
Brugia malayi	cytochrome P450	0.0011	0.0058	0.0058
Mycobacterium ulcerans	cytochrome P450 187A5 Cyp187A5	0.0011	0.0058	0.0506
Schistosoma mansoni	steroid hormone receptor ad4bp	0.001	0.0027	0.0054
Echinococcus multilocularis		0.0011	0.0058	0.0099
Mycobacterium ulcerans	cytochrome P450 144A4 Cyp144A4	0.0011	0.0058	0.0506
Echinococcus granulosus	ecdysone induced protein 78C	0.001	0.0027	0.0045
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0096	0.353	0.6009
Mycobacterium ulcerans	cytochrome P450 143A3 Cyp143A3	0.0011	0.0058	0.0506
Schistosoma mansoni	niemann-pick C1 (NPC1)	0.0099	0.364	0.7363
Brugia malayi	Ligand-binding domain of nuclear hormone receptor family protein	0.001	0.0027	0.0027
Loa Loa (eye worm)	abnormal chemotaxis protein 14	0.0042	0.1309	0.1309
Echinococcus multilocularis	thyroid hormone receptor alpha	0.001	0.0027	0.0045
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-40	0.001	0.0027	0.0027
Mycobacterium ulcerans	cytochrome P450 126A3 Cyp126A3	0.0011	0.0058	0.0506
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0096	0.353	0.7139
Trypanosoma cruzi	myo-inositol-1(or 4)-monophosphatase 1, putative	0.0038	0.1153	1
Schistosoma mansoni	photoreceptor-specific nuclear receptor related	0.001	0.0027	0.0054
Echinococcus granulosus	nuclear receptor 2DBD gamma	0.001	0.0027	0.0045
Echinococcus multilocularis	protein patched	0.0042	0.1309	0.2228
Loa Loa (eye worm)	TAR-binding protein	0.0131	0.4944	0.4944
Entamoeba histolytica	myo-inositol monophosphatase, putative	0.0038	0.1153	0.3222
Echinococcus granulosus	GPCR family 2	0.0016	0.0239	0.0408
Loa Loa (eye worm)	cytochrome P450 family protein	0.0051	0.1697	0.1697
Mycobacterium ulcerans	cytochrome P450 125A7 Cyp125A7	0.0011	0.0058	0.0506
Echinococcus multilocularis	protein dispatched 1	0.0048	0.155	0.2638
Toxoplasma gondii	cytochrome p450 superfamily protein	0.0011	0.0058	0.0506
Mycobacterium ulcerans	cytochrome P450 191A3 Cyp191A3	0.0011	0.0058	0.0506
Brugia malayi	Cytochrome P450 family protein	0.0051	0.1697	0.1697
Trypanosoma brucei	inositol-1(or 4)-monophosphatase 1, putative	0.0038	0.1153	1
Schistosoma mansoni	inositol monophosphatase	0.0038	0.1153	0.2332
Loa Loa (eye worm)	hypothetical protein	0.0034	0.0979	0.0979
Brugia malayi	Steroid receptor seven-up type 2	0.001	0.0027	0.0027
Brugia malayi	Nuclear hormone receptor family member nhr-31	0.001	0.0027	0.0027
Loa Loa (eye worm)	hypothetical protein	0.001	0.0027	0.0027
Schistosoma mansoni	hypothetical protein	0.0016	0.0239	0.0484
Loa Loa (eye worm)	cytochrome P450 family protein	0.0011	0.0058	0.0058
Loa Loa (eye worm)	steroid hormone receptor	0.001	0.0027	0.0027
Brugia malayi	Cytochrome P450 family protein	0.0011	0.0058	0.0058
Schistosoma mansoni	transcription factor LCR-F1	0.0073	0.2566	0.519
Chlamydia trachomatis	DNA ligase	0.001	0	0.5
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-31	0.001	0.0027	0.0027
Leishmania major	myo-inositol-1(or 4)-monophosphatase 1, putative	0.0038	0.1153	1
Brugia malayi	latrophilin 2 splice variant baaae	0.0034	0.0979	0.0979
Schistosoma mansoni	hypothetical protein	0.0016	0.0239	0.0484
Mycobacterium ulcerans	extragenic suppressor protein SuhB	0.0038	0.1153	1
Schistosoma mansoni	hypothetical protein	0.0011	0.0058	0.0118
Mycobacterium leprae	Conserved hypothetical protein	0.0011	0.0058	0.0589
Schistosoma mansoni	hypothetical protein	0.0016	0.0239	0.0484
Mycobacterium ulcerans	cytochrome P450 187A4 Cyp187A4	0.0011	0.0058	0.0506
Loa Loa (eye worm)	GTP-binding regulatory protein Gs alpha-S chain	0.0096	0.353	0.353
Schistosoma mansoni	nuclear hormone receptor	0.001	0.0027	0.0054
Schistosoma mansoni	hypothetical protein	0.004	0.1247	0.2523
Loa Loa (eye worm)	MH2 domain-containing protein	0.0121	0.4542	0.4542
Loa Loa (eye worm)	hypothetical protein	0.0255	1	1
Echinococcus granulosus	Niemann Pick C1 protein	0.014	0.5285	0.8997
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0096	0.353	0.7139
Brugia malayi	Nuclear hormone receptor family member nhr-49	0.001	0.0027	0.0027
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-41	0.001	0.0027	0.0027
Schistosoma mansoni	thyroid hormone receptor	0.001	0.0027	0.0054
Schistosoma mansoni	inositol monophosphatase	0.0038	0.1153	0.2332
Schistosoma mansoni	retinoic acid receptor RXR	0.001	0.0027	0.0054
Trypanosoma cruzi	myo-inositol-1(or 4)-monophosphatase 1, putative	0.0038	0.1153	1
Loa Loa (eye worm)	transcription factor SMAD2	0.0121	0.4542	0.4542
Echinococcus granulosus	muscleblind protein	0.0154	0.5874	1
Loa Loa (eye worm)	hypothetical protein	0.001	0.0027	0.0027
Brugia malayi	Inositol-1	0.0038	0.1153	0.1153
Mycobacterium ulcerans	cytochrome p450 150 cyp150	0.0011	0.0058	0.0506
Echinococcus multilocularis	inositol monophosphatase 1	0.0038	0.1153	0.1963
Echinococcus granulosus	Niemann Pick C1 protein	0.0098	0.3579	0.6092
Brugia malayi	Cytochrome P450 family protein	0.0011	0.0058	0.0058
Loa Loa (eye worm)	cytochrome P450 family protein	0.0011	0.0058	0.0058
Loa Loa (eye worm)	nuclear Hormone Receptor family member	0.001	0.0027	0.0027
Echinococcus granulosus	FTZ F1 nuclear receptor protein	0.001	0.0027	0.0045
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-14	0.001	0.0027	0.0027
Echinococcus multilocularis	FTZ F1 nuclear receptor protein	0.001	0.0027	0.0045
Loa Loa (eye worm)	hypothetical protein	0.001	0.0027	0.0027
Schistosoma mansoni	nuclear hormone receptor nor-1/nor-2	0.001	0.0027	0.0054
Trypanosoma brucei	Lanosterol 14-alpha demethylase	0.0011	0.0058	0.0506
Loa Loa (eye worm)	hypothetical protein	0.0154	0.5874	0.5874
Echinococcus granulosus	cytochrome P450 2K1	0.0011	0.0058	0.0099
Schistosoma mansoni	hypothetical protein	0.004	0.1247	0.2523
Echinococcus multilocularis	sterol regulatory element binding protein	0.0042	0.1309	0.2228
Loa Loa (eye worm)	hypothetical protein	0.001	0.0027	0.0027
Onchocerca volvulus		0.001	0.0027	0.0027
Plasmodium vivax	replication factor C subunit 1, putative	0.001	0	0.5
Brugia malayi	TAR-binding protein	0.0131	0.4944	0.4944
Schistosoma mansoni	thyroid hormone receptor	0.001	0.0027	0.0054
Onchocerca volvulus	Steroid hormone receptor family member cnr14 homolog	0.001	0.0027	0.0027
Schistosoma mansoni	tar DNA-binding protein	0.0131	0.4944	1
Mycobacterium leprae	possible inositol monophosphatase SubH (IMPase) (inositol-1-phosphatase) (I-1-Pase ).	0.0034	0.0991	1
Mycobacterium ulcerans	cytochrome P450 150A6 Cyp150A6	0.0011	0.0058	0.0506
Mycobacterium ulcerans	cytochrome P450 142A3 Cyp142A3	0.0011	0.0058	0.0506
Loa Loa (eye worm)	RNA recognition domain-containing protein domain-containing protein	0.0131	0.4944	0.4944
Echinococcus granulosus	inositol monophosphatase 1	0.0038	0.1153	0.1963
Treponema pallidum	DNA ligase (lig)	0.001	0	0.5
Schistosoma mansoni	hypothetical protein	0.0016	0.0239	0.0484
Schistosoma mansoni	hypothetical protein	0.004	0.1247	0.2523
Toxoplasma gondii	inositol(myo)-1(or 4)-monophosphatase 2, putative	0.0038	0.1153	1
Entamoeba histolytica	hypothetical protein	0.0073	0.2566	0.717
Brugia malayi	RNA recognition motif domain containing protein	0.0131	0.4944	0.4944
Entamoeba histolytica	hypothetical protein	0.0073	0.2566	0.717
Trichomonas vaginalis	inositol monophosphatase, putative	0.0038	0.1153	0.8811
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0096	0.353	0.6009
Echinococcus multilocularis	diuretic hormone 44 receptor GPRdih2	0.0016	0.0239	0.0408
Mycobacterium leprae	putative cytochrome p450	0.0011	0.0058	0.0589
Brugia malayi	nuclear receptor NHR-88	0.001	0.0027	0.0027
Mycobacterium ulcerans	cytochrome P450 51B1 Cyp51B1	0.0011	0.0058	0.0506
Echinococcus granulosus	hepatocyte nuclear factor 4 alpha	0.001	0.0027	0.0045
Loa Loa (eye worm)	hypothetical protein	0.0255	1	1
Echinococcus multilocularis	tar DNA binding protein	0.0131	0.4944	0.8416
Echinococcus granulosus	retinoic acid receptor rxr beta a	0.001	0.0027	0.0045
Schistosoma mansoni	tar DNA-binding protein	0.0131	0.4944	1
Schistosoma mansoni	tar DNA-binding protein	0.0131	0.4944	1
Echinococcus multilocularis	Niemann Pick C1 protein	0.014	0.5285	0.8997
Mycobacterium ulcerans	cytochrome P450 143A4 Cyp143A4	0.0011	0.0058	0.0506
Schistosoma mansoni	hypothetical protein	0.0073	0.2566	0.519
Echinococcus granulosus	Protein patched homolog 1	0.0042	0.1309	0.2228
Mycobacterium ulcerans	cytochrome P450 105Q4 Cyp105Q4	0.0011	0.0058	0.0506
Loa Loa (eye worm)	cytochrome P450	0.0011	0.0058	0.0058
Plasmodium falciparum	replication factor C subunit 1, putative	0.001	0	0.5
Mycobacterium ulcerans	cytochrome P450 185A4 Cyp185A4	0.0011	0.0058	0.0506
Loa Loa (eye worm)	latrophilin receptor protein 2	0.0016	0.0239	0.0239
Echinococcus granulosus	sterol regulatory element binding protein	0.0042	0.1309	0.2228
Entamoeba histolytica	hypothetical protein	0.0073	0.2566	0.717
Loa Loa (eye worm)	hypothetical protein	0.001	0.0027	0.0027
Brugia malayi	nuclear hormone receptor	0.001	0.0027	0.0027
Entamoeba histolytica	Niemann-Pick C1 protein, putative	0.0098	0.3579	1
Echinococcus granulosus	nuclear receptor 2DBD gamma	0.001	0.0027	0.0045
Brugia malayi	Nuclear hormone receptor family member nhr-41	0.001	0.0027	0.0027
Loa Loa (eye worm)	RNA binding protein	0.0131	0.4944	0.4944
Brugia malayi	calcium-independent alpha-latrotoxin receptor 2, putative	0.0016	0.0239	0.0239
Echinococcus granulosus	FTZ F1 alpha	0.001	0.0027	0.0045
Brugia malayi	Cytochrome P450 family protein	0.0011	0.0058	0.0058
Echinococcus granulosus	Basic leucine zipper bZIP transcription	0.0073	0.2566	0.4368
Echinococcus multilocularis	nuclear receptor 2DBD gamma	0.001	0.0027	0.0045
Schistosoma mansoni	cytochrome P450	0.0011	0.0058	0.0118
Brugia malayi	CHE-14 protein	0.0042	0.1309	0.1309
Trichomonas vaginalis	myo inositol monophosphatase, putative	0.0038	0.1153	0.8811
Echinococcus multilocularis	hepatocyte nuclear factor 4 alpha	0.001	0.0027	0.0045
Mycobacterium ulcerans	cytochrome P450 108B4 Cyp108B4	0.0011	0.0058	0.0506
Giardia lamblia	Replication factor C, subunit 1	0.001	0	0.5
Trypanosoma cruzi	cytochrome p450-like protein, putative	0.0011	0.0058	0.0506
Brugia malayi	Ligand-binding domain of nuclear hormone receptor family protein	0.001	0.0027	0.0027
Onchocerca volvulus	Huntingtin homolog	0.0255	1	1
Brugia malayi	ecdysteroid receptor	0.001	0.0027	0.0027
Echinococcus multilocularis	Basic leucine zipper (bZIP) transcription	0.0073	0.2566	0.4368
Loa Loa (eye worm)	hypothetical protein	0.0016	0.0239	0.0239
Loa Loa (eye worm)	hypothetical protein	0.0154	0.5874	0.5874
Echinococcus multilocularis	Nuclear hormone receptor family member nhr 41	0.001	0.0027	0.0045
Brugia malayi	GTP-binding regulatory protein Gs alpha-S chain, putative	0.0096	0.353	0.353
Mycobacterium ulcerans	cytochrome P450 136A2 Cyp136A2	0.0011	0.0058	0.0506
Schistosoma mansoni	tar DNA-binding protein	0.0131	0.4944	1
Schistosoma mansoni	patched 1	0.0042	0.1309	0.2647
Brugia malayi	MH2 domain containing protein	0.0121	0.4542	0.4542
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-1	0.001	0.0027	0.0027
Brugia malayi	Nuclear hormone receptor family member nhr-25	0.001	0.0027	0.0027
Onchocerca volvulus	Huntingtin homolog	0.0255	1	1
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0096	0.353	0.6009
Brugia malayi	RNA binding protein	0.0131	0.4944	0.4944
Echinococcus granulosus	expressed conserved protein	0.0092	0.3337	0.5682
Entamoeba histolytica	hypothetical protein	0.0073	0.2566	0.717
Schistosoma mansoni	Tr4/Tr2 (homologue)	0.001	0.0027	0.0054
Echinococcus multilocularis	cadherin EGF LAG seven pass G type receptor	0.0016	0.0239	0.0408
Brugia malayi	Nuclear hormone receptor family member nhr-3	0.001	0.0027	0.0027
Echinococcus granulosus	COUP TF:Svp nuclear hormone receptor	0.001	0.0027	0.0045
Trichomonas vaginalis	myo inositol monophosphatase, putative	0.0038	0.1153	0.8811
Mycobacterium ulcerans	cytochrome P450 124A1, Cyp124A1	0.0011	0.0058	0.0506
Onchocerca volvulus	Protein ultraspiracle homolog	0.001	0.0027	0.0027
Brugia malayi	hypothetical protein	0.0073	0.2566	0.2566
Mycobacterium ulcerans	cytochrome P450 140A5 Cyp140A5	0.0011	0.0058	0.0506
Brugia malayi	Nuclear hormone receptor family member nhr-19	0.001	0.0027	0.0027
Loa Loa (eye worm)	hypothetical protein	0.001	0.0027	0.0027
Trypanosoma cruzi	cytochrome P450, putative	0.0011	0.0058	0.0506
Trypanosoma brucei	cytochrome P450, putative	0.0011	0.0058	0.0506
Loa Loa (eye worm)	hypothetical protein	0.001	0.0027	0.0027
Brugia malayi	Muscleblind-like protein	0.0154	0.5874	0.5874
Loa Loa (eye worm)	pigment dispersing factor receptor c	0.0049	0.1616	0.1616
Brugia malayi	Niemann-Pick C1 protein precursor	0.0098	0.3579	0.3579
Brugia malayi	photoreceptor-specific nuclear receptor	0.001	0.0027	0.0027
Mycobacterium ulcerans	cytochrome P450 123A3 Cyp123A3	0.0011	0.0058	0.0506
Brugia malayi	Nuclear hormone receptor family member nhr-40	0.001	0.0027	0.0027
Trichomonas vaginalis	conserved hypothetical protein	0.0042	0.1309	1
Brugia malayi	Nuclear hormone receptor-like 1	0.001	0.0027	0.0027
Schistosoma mansoni	hypothetical protein	0.0034	0.0979	0.198
Schistosoma mansoni	nuclear receptor 2DBD-gamma	0.001	0.0027	0.0054
Loa Loa (eye worm)	hypothetical protein	0.0042	0.1309	0.1309
Schistosoma mansoni	coup transcription factor	0.001	0.0027	0.0054
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0096	0.353	0.6009
Brugia malayi	Calcitonin receptor-like protein seb-1	0.0049	0.1616	0.1616
Schistosoma mansoni	RAR-like nuclear receptor	0.001	0.0027	0.0054
Echinococcus multilocularis	ecdysone induced protein 78C	0.001	0.0027	0.0045
Schistosoma mansoni	FTZ-F1 nuclear receptor-like protein	0.001	0.0027	0.0054
Onchocerca volvulus	Bile acid receptor homolog	0.001	0.0027	0.0027
Schistosoma mansoni	tar DNA-binding protein	0.0131	0.4944	1
Loa Loa (eye worm)	hypothetical protein	0.0051	0.1693	0.1693
Echinococcus granulosus	cadherin EGF LAG seven pass G type receptor	0.0016	0.0239	0.0408
Loa Loa (eye worm)	hypothetical protein	0.001	0.0027	0.0027
Echinococcus multilocularis	muscleblind protein 1	0.0154	0.5874	1
Wolbachia endosymbiont of Brugia malayi	fructose-1,6-bisphosphatase	0.0038	0.1153	1
Brugia malayi	Latrophilin receptor protein 2	0.0016	0.0239	0.0239
Brugia malayi	steroid hormone receptor	0.001	0.0027	0.0027
Loa Loa (eye worm)	hypothetical protein	0.0098	0.3579	0.3579
Echinococcus multilocularis	COUP TF:Svp nuclear hormone receptor	0.001	0.0027	0.0045
Mycobacterium ulcerans	cytochrome P450 189A7 Cyp189A7	0.0011	0.0058	0.0506
Brugia malayi	Nuclear hormone receptor family member nhr-19	0.001	0.0027	0.0027

Activities

Activity type	Activity value	Assay description	Source	Reference
Inhibition (binding)	= 19.87 %	Inhibition of ovine COX2 at 1 mM by colorimetric assay	ChEMBL.	20005707
Inhibition (binding)	= 59.81 %	Inhibition of beta-glucuronidase at 10 uM	ChEMBL.	20005707

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: CHEMBL594304

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 1096680