TDR Targets

Basic information

Technical information

TDR Targets ID: 55807
Name: 5-ethenyl-1,6-dimethyl-9,10-dihydrophenanthre ne-2,7-diol
MW: 266.334 | Formula: C18H18O2
H donors: 2 H acceptors: 2 LogP: 4.64 Rotable bonds: 1
Rule of 5 violations (Lipinski): 1
SMILES: C=Cc1c(C)c(O)cc2c1c1ccc(c(c1CC2)C)O
InChi: 1S/C18H18O2/c1-4-13-10(2)17(20)9-12-5-6-14-11(3)16(19)8-7-15(14)18(12)13/h4,7-9,19-20H,1,5-6H2,2-3H3
InChiKey: XNVMKPYDOHZJLR-UHFFFAOYSA-N

Network

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Target Layer

Model Organisms

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

TDR Pathogens:

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

Other Pathogens:

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

Compound Layer

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Clustering layers

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Synonyms

1,6-dimethyl-5-vinyl-9,10-dihydrophenanthrene-2,7-diol
juncusol
62023-90-9
2,7-Phenanthrenediol, 5-ethenyl-9,10-dihydro-1,6-dimethyl-
NSC220968
NSC 220968
NCI60_001834

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	RAR-like nuclear receptor	0.0053	0.1311	0.2037
Onchocerca volvulus	Nuclear receptor subfamily 6 group A member 1 homolog	0.0025	0.0372	0.1233
Loa Loa (eye worm)	steroid hormone receptor	0.0053	0.1311	0.2776
Brugia malayi	nuclear receptor RXR	0.0025	0.0372	0.0687
Loa Loa (eye worm)	hypothetical protein	0.0053	0.1311	0.2776
Brugia malayi	Nuclear hormone receptor family member nhr-3	0.0053	0.1311	0.2697
Echinococcus granulosus	histone acetyltransferase KAT2B	0.0151	0.4579	0.8173
Brugia malayi	conserved hypotetical protein	0.0025	0.0372	0.0687
Loa Loa (eye worm)	sodium-independent organic anion transporter	0.0028	0.0464	0.0982
Loa Loa (eye worm)	hypothetical protein	0.0025	0.0372	0.0788
Echinococcus granulosus	geminin	0.0181	0.5602	1
Giardia lamblia	Fructose-bisphosphate aldolase	0.0313	1	1
Loa Loa (eye worm)	cytoplasmic intermediate filament protein	0.0015	0.0051	0.0109
Loa Loa (eye worm)	hypothetical protein	0.0025	0.0372	0.0788
Echinococcus multilocularis	Basic leucine zipper (bZIP) transcription factor	0.009	0.2541	0.4367
Brugia malayi	steroid hormone receptor	0.0053	0.1311	0.2697
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-49	0.0053	0.1311	0.2776
Loa Loa (eye worm)	hypothetical protein	0.0028	0.0473	0.1001
Loa Loa (eye worm)	SMO-1 protein	0.0051	0.1231	0.2605
Schistosoma mansoni	nuclear hormone receptor superfamily protein-related	0.0025	0.0372	0.0378
Loa Loa (eye worm)	hypothetical protein	0.0019	0.0169	0.0358
Brugia malayi	nuclear hormone receptor family member odr-7	0.0025	0.0372	0.0687
Loa Loa (eye worm)	hypothetical protein	0.0025	0.0372	0.0788
Echinococcus granulosus	thyroid hormone receptor alpha	0.0025	0.0372	0.0665
Loa Loa (eye worm)	nuclear Hormone Receptor family member	0.0053	0.1311	0.2776
Schistosoma mansoni	ecdysone-induced protein 78c (dr-78)	0.0028	0.0473	0.0556
Brugia malayi	hypothetical protein	0.0025	0.0372	0.0687
Echinococcus granulosus	mitogen activated protein kinase	0.005	0.1192	0.2128
Echinococcus multilocularis	retinoic acid receptor rxr beta a retinoic acid receptor rxr alpha a retinoic acid receptor rxr alpha	0.0025	0.0372	0.064
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.0313	1	1
Echinococcus multilocularis	geminin	0.0181	0.5602	0.9626
Echinococcus granulosus	ecdysone induced protein 78C	0.0053	0.1311	0.2341
Schistosoma mansoni	Tr4/Tr2 (homologue)	0.0053	0.1311	0.2037
Brugia malayi	Nuclear hormone receptor E75	0.0025	0.0372	0.0687
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-40	0.0053	0.1311	0.2776
Schistosoma mansoni	organic anion transporter	0.0028	0.0464	0.054
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.0313	1	1
Echinococcus granulosus	Solute carrier organic anion transporter family	0.0028	0.0464	0.0828
Brugia malayi	ecdysteroid receptor	0.0053	0.1311	0.2697
Echinococcus multilocularis	nuclear receptor 2DBD gamma	0.0053	0.1311	0.2253
Loa Loa (eye worm)	nuclear hormone receptor-like 1	0.0028	0.0473	0.1001
Echinococcus granulosus	nuclear receptor subfamily 4 group A	0.0025	0.0372	0.0665
Echinococcus granulosus	nuclear receptor subfamily 1 group D	0.0028	0.0473	0.0844
Loa Loa (eye worm)	hypothetical protein	0.0019	0.0158	0.0335
Schistosoma mansoni	nuclear receptor nhr-48	0.0025	0.0372	0.0378
Trichomonas vaginalis	CMGC family protein kinase	0.005	0.1192	0.0648
Entamoeba histolytica	acetyltransferase, GNAT family	0.0042	0.0933	0.0373
Loa Loa (eye worm)	acetyltransferase	0.0155	0.4724	1
Brugia malayi	Kazal-type serine protease inhibitor domain containing protein	0.0019	0.0169	0.0252
Brugia malayi	Nuclear hormone receptor family member nhr-1	0.0053	0.1311	0.2697
Echinococcus multilocularis	Nuclear hormone receptor family member nhr 41	0.0053	0.1311	0.2253
Schistosoma mansoni	nuclear hormone receptor	0.0025	0.0372	0.0378
Echinococcus multilocularis	expressed protein	0.0019	0.0169	0.029
Loa Loa (eye worm)	hypothetical protein	0.0025	0.0372	0.0788
Brugia malayi	prostaglandin transporter	0.0028	0.0464	0.0883
Schistosoma mansoni	nuclear receptor	0.0025	0.0372	0.0378
Loa Loa (eye worm)	matrixin family protein	0.0041	0.0919	0.1944
Echinococcus multilocularis	jun protein	0.009	0.2541	0.4367
Entamoeba histolytica	ubiquitin like protein	0.0051	0.1231	0.0689
Onchocerca volvulus		0.0028	0.0464	0.176
Brugia malayi	Hemopexin family protein	0.0026	0.0419	0.0787
Brugia malayi	ecdysone receptor	0.0025	0.0372	0.0687
Echinococcus granulosus	lamin	0.0029	0.05	0.0892
Echinococcus granulosus	histone acetyltransferase KAT2B	0.0046	0.106	0.1893
Trichomonas vaginalis	CMGC family protein kinase	0.005	0.1192	0.0648
Onchocerca volvulus	Matrix metalloproteinase homolog	0.0041	0.0919	0.4377
Brugia malayi	nuclear hormone receptor	0.0025	0.0372	0.0687
Loa Loa (eye worm)	hypothetical protein	0.0028	0.0464	0.0982
Loa Loa (eye worm)	hypothetical protein	0.0053	0.1311	0.2776
Echinococcus multilocularis	FTZ F1 alpha	0.0053	0.1311	0.2253
Schistosoma mansoni	retinoid-x-receptor (RXR)	0.0028	0.0473	0.0556
Schistosoma mansoni	jun-related protein	0.0073	0.1978	0.3214
Loa Loa (eye worm)	agrin synaptic family protein	0.0019	0.0169	0.0358
Brugia malayi	Nuclear hormone receptor family member nhr-31	0.0053	0.1311	0.2697
Echinococcus granulosus	organic anion transporting polypeptide 30B	0.0028	0.0464	0.0828
Schistosoma mansoni	hypothetical protein	0.0135	0.4042	0.686
Echinococcus multilocularis	nuclear receptor nhr 48	0.0025	0.0372	0.064
Brugia malayi	nuclear hormone receptor	0.0053	0.1311	0.2697
Brugia malayi	Ligand-binding domain of nuclear hormone receptor family protein	0.0053	0.1311	0.2697
Trichomonas vaginalis	conserved hypothetical protein	0.0051	0.1231	0.0689
Trypanosoma cruzi	small ubiquitin protein, putative	0.0051	0.1231	1
Brugia malayi	hypothetical protein	0.0028	0.0473	0.0902
Brugia malayi	sodium-independent organic anion transporter family protein	0.0028	0.0464	0.0883
Echinococcus granulosus	Nuclear hormone receptor family member nhr 41	0.0053	0.1311	0.2341
Schistosoma mansoni	steroid hormone receptor ad4bp	0.0053	0.1311	0.2037
Leishmania major	small ubiquitin protein, putative	0.0051	0.1231	1
Echinococcus granulosus	Mitotic checkpoint protein PRCC C terminal	0.0135	0.4042	0.7216
Schistosoma mansoni	zinc finger protein	0.0025	0.0372	0.0378
Echinococcus multilocularis	mitogen activated protein kinase 3	0.005	0.1192	0.2048
Echinococcus multilocularis	organic anion transporting polypeptide 30B	0.0028	0.0464	0.0797
Loa Loa (eye worm)	hypothetical protein	0.0028	0.0464	0.0982
Echinococcus multilocularis	ecdysone induced protein 78C	0.0053	0.1311	0.2253
Loa Loa (eye worm)	hypothetical protein	0.0053	0.1311	0.2776
Brugia malayi	Nuclear hormone receptor family member nhr-41	0.0053	0.1311	0.2697
Onchocerca volvulus	Protein ultraspiracle homolog	0.0053	0.1311	0.6638
Loa Loa (eye worm)	nuclear receptor nhr-7B	0.0025	0.0372	0.0788
Onchocerca volvulus	Steroid hormone receptor family member cnr14 homolog	0.0053	0.1311	0.6638
Onchocerca volvulus		0.0025	0.0372	0.1233
Echinococcus granulosus	FTZ F1 nuclear receptor protein	0.0053	0.1311	0.2341
Echinococcus multilocularis	Nuclear hormone receptor HR96	0.0025	0.0372	0.064
Brugia malayi	nuclear receptor NHR-88	0.0025	0.0372	0.0687
Loa Loa (eye worm)	nuclear hormone receptor	0.0025	0.0372	0.0788
Brugia malayi	Matrixin family protein	0.0045	0.1043	0.2123
Entamoeba histolytica	fructose-1,6-bisphosphate aldolase, putative	0.0313	1	1
Giardia lamblia	Kinase, CMGC MAPK	0.005	0.1192	0.0286
Echinococcus multilocularis	mitogen activated protein kinase	0.005	0.1192	0.2048
Echinococcus granulosus	COUP TF:Svp nuclear hormone receptor	0.0053	0.1311	0.2341
Loa Loa (eye worm)	nuclear receptor NHR-67	0.0025	0.0372	0.0788
Echinococcus granulosus	nuclear receptor 2DBD gamma	0.0053	0.1311	0.2341
Echinococcus multilocularis	ubiquitin	0.0031	0.0582	0.1
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.0313	1	1
Brugia malayi	hypothetical protein	0.0025	0.0372	0.0687
Onchocerca volvulus		0.0031	0.0582	0.2438
Brugia malayi	Matrix metalloprotease, N-terminal domain containing protein	0.0023	0.0294	0.052
Trichomonas vaginalis	CMGC family protein kinase	0.005	0.1192	0.0648
Brugia malayi	hypothetical protein	0.0028	0.0464	0.0883
Echinococcus granulosus	agrin	0.0019	0.0169	0.0302
Brugia malayi	Matrixin family protein	0.0019	0.0158	0.0229
Loa Loa (eye worm)	kazal-type serine protease inhibitor domain-containing protein	0.0019	0.0169	0.0358
Loa Loa (eye worm)	hypothetical protein	0.0019	0.0169	0.0358
Echinococcus multilocularis	nuclear receptor 2DBD gamma	0.0025	0.0372	0.064
Echinococcus granulosus	Nuclear hormone receptor HR96	0.0025	0.0372	0.0665
Brugia malayi	Nuclear hormone receptor family member nhr-19	0.0053	0.1311	0.2697
Schistosoma mansoni	photoreceptor-specific nuclear receptor related	0.0053	0.1311	0.2037
Loa Loa (eye worm)	hypothetical protein	0.0025	0.0372	0.0788
Mycobacterium ulcerans	fructose-bisphosphate aldolase	0.0153	0.4647	1
Mycobacterium tuberculosis	Probable fructose-bisphosphate aldolase Fba	0.0153	0.4647	1
Echinococcus granulosus	mitogen activated protein kinase 3	0.005	0.1192	0.2128
Brugia malayi	hypothetical protein	0.0031	0.0582	0.1135
Loa Loa (eye worm)	hypothetical protein	0.0019	0.0158	0.0335
Loa Loa (eye worm)	CMGC/MAPK/ERK1 protein kinase	0.005	0.1192	0.2523
Echinococcus multilocularis	nuclear receptor subfamily 4 group A	0.0025	0.0372	0.064
Echinococcus multilocularis	gcn5proteinral control of amino acid synthesis	0.0155	0.4724	0.8118
Trypanosoma cruzi	mitogen activated protein kinase 4, putative	0.005	0.1192	0.9496
Brugia malayi	nuclear hormone receptor family member nhr-6	0.0025	0.0372	0.0687
Loa Loa (eye worm)	hypothetical protein	0.0053	0.1311	0.2776
Onchocerca volvulus	Bile acid receptor homolog	0.0053	0.1311	0.6638
Trichomonas vaginalis	CMGC family protein kinase	0.005	0.1192	0.0648
Brugia malayi	Kazal-type serine protease inhibitor domain containing protein	0.0019	0.0169	0.0252
Loa Loa (eye worm)	hypothetical protein	0.0025	0.0372	0.0788
Echinococcus multilocularis	nuclear receptor 2DBD gamma	0.0053	0.1311	0.2253
Plasmodium vivax	small ubiquitin-related modifier, putative	0.0051	0.1231	1
Trypanosoma cruzi	mitogen activated protein kinase 2, putative	0.005	0.1192	0.9496
Brugia malayi	sodium-independent organic anion transporter family protein	0.0028	0.0464	0.0883
Echinococcus granulosus	jun protein	0.009	0.2541	0.4536
Echinococcus multilocularis	agrin	0.0019	0.0169	0.029
Echinococcus multilocularis	hepatocyte nuclear factor 4 alpha	0.0053	0.1311	0.2253
Loa Loa (eye worm)	hypothetical protein	0.0025	0.0372	0.0788
Brugia malayi	Matrixin family protein	0.0019	0.0158	0.0229
Brugia malayi	Nuclear hormone receptor family member nhr-25	0.0053	0.1311	0.2697
Schistosoma mansoni	retinoid-x-receptor (RXR)	0.0053	0.1311	0.2037
Schistosoma mansoni	nuclear receptor 2DBD-gamma	0.0053	0.1311	0.2037
Schistosoma mansoni	serine/threonine protein kinase	0.005	0.1192	0.1826
Echinococcus multilocularis	Nuclear hormone receptor HR96	0.0025	0.0372	0.064
Brugia malayi	Nuclear hormone receptor-like 1	0.0053	0.1311	0.2697
Loa Loa (eye worm)	hypothetical protein	0.0028	0.0473	0.1001
Echinococcus multilocularis	COUP TF:Svp nuclear hormone receptor	0.0053	0.1311	0.2253
Loa Loa (eye worm)	DR-78	0.0025	0.0372	0.0788
Echinococcus granulosus	Nuclear hormone receptor HR96	0.0025	0.0372	0.0665
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.0313	1	1
Onchocerca volvulus		0.0028	0.0464	0.176
Schistosoma mansoni	FTZ-F1 nuclear receptor-like protein	0.0053	0.1311	0.2037
Echinococcus granulosus	lamin dm0	0.0029	0.05	0.0892
Brugia malayi	hypothetical protein	0.0028	0.0473	0.0902
Onchocerca volvulus		0.0026	0.0419	0.1502
Schistosoma mansoni	hypothetical protein	0.0073	0.1978	0.3214
Brugia malayi	nuclear receptor NHR-88	0.0053	0.1311	0.2697
Echinococcus multilocularis	lamin	0.0029	0.05	0.0859
Loa Loa (eye worm)	hypothetical protein	0.0029	0.05	0.1058
Echinococcus granulosus	matrix metallopeptidase 7 M10 family	0.0068	0.1804	0.322
Brugia malayi	tailless protein	0.0025	0.0372	0.0687
Brugia malayi	Kazal-type serine protease inhibitor domain containing protein	0.0019	0.0169	0.0252
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-31	0.0053	0.1311	0.2776
Trypanosoma cruzi	mitogen-activated protein kinase 11, putative	0.005	0.1192	0.9496
Toxoplasma gondii	small ubiquitin family modifier, putative	0.0051	0.1231	1
Treponema pallidum	fructose-bisphosphate aldolase	0.0313	1	0.5
Brugia malayi	Nuclear hormone receptor-like 1	0.0028	0.0473	0.0902
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.0313	1	1
Brugia malayi	Matrixin family protein	0.0019	0.0158	0.0229
Loa Loa (eye worm)	hypothetical protein	0.0053	0.1311	0.2776
Schistosoma mansoni	nuclear receptor	0.0025	0.0372	0.0378
Brugia malayi	Nuclear hormone receptor-like 1	0.0028	0.0473	0.0902
Loa Loa (eye worm)	hypothetical protein	0.0019	0.0169	0.0358
Loa Loa (eye worm)	hypothetical protein	0.0023	0.0294	0.0623
Loa Loa (eye worm)	hypothetical protein	0.0028	0.0464	0.0982
Loa Loa (eye worm)	hypothetical protein	0.0019	0.0158	0.0335
Schistosoma mansoni	nuclear hormone receptor nor-1/nor-2	0.0053	0.1311	0.2037
Trypanosoma brucei	small ubiquitin-related modifier	0.0051	0.1231	1
Echinococcus multilocularis	Mitotic checkpoint protein PRCC, C terminal	0.0135	0.4042	0.6946
Brugia malayi	Nuclear hormone receptor family member nhr-40	0.0053	0.1311	0.2697
Echinococcus multilocularis	lamin dm0	0.0029	0.05	0.0859
Schistosoma mansoni	hepatocyte nuclear factor 4-alpha (hnf-4-alpha)	0.0025	0.0372	0.0378
Onchocerca volvulus		0.0025	0.0372	0.1233
Schistosoma mansoni	follistatin	0.0019	0.0169	0.0019
Onchocerca volvulus		0.0019	0.0169	0.0061
Echinococcus granulosus	nuclear receptor 2DBD gamma	0.0053	0.1311	0.2341
Echinococcus multilocularis	musashi	0.0029	0.05	0.0859
Loa Loa (eye worm)	hypothetical protein	0.0053	0.1311	0.2776
Brugia malayi	Nuclear hormone receptor family member nhr-25	0.0053	0.1311	0.2697
Loa Loa (eye worm)	hypothetical protein	0.0025	0.0372	0.0788
Brugia malayi	acetyltransferase, GNAT family protein	0.0155	0.4724	1
Toxoplasma gondii	CMGC kinase, MAPK family (ERK) MAPK-1	0.005	0.1192	0.9636
Trichomonas vaginalis	bromodomain-containing protein, putative	0.0046	0.106	0.0508
Toxoplasma gondii	histone lysine acetyltransferase GCN5-A	0.0046	0.106	0.8395
Giardia lamblia	Sentrin	0.0051	0.1231	0.0328
Brugia malayi	nuclear receptor subfamily 1, group D, member 1, putative	0.0025	0.0372	0.0687
Plasmodium falciparum	small ubiquitin-related modifier	0.0051	0.1231	1
Echinococcus granulosus	nuclear receptor nhr 48	0.0025	0.0372	0.0665
Echinococcus multilocularis	Small ubiquitin modifier 2	0.0051	0.1231	0.2115
Brugia malayi	nuclear receptor RXR	0.0028	0.0473	0.0902
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.0313	1	1
Brugia malayi	Nuclear hormone receptor family member nhr-14	0.0053	0.1311	0.2697
Brugia malayi	Nuclear hormone receptor family member nhr-49	0.0053	0.1311	0.2697
Loa Loa (eye worm)	hypothetical protein	0.0025	0.0372	0.0788
Loa Loa (eye worm)	hypothetical protein	0.0053	0.1311	0.2776
Loa Loa (eye worm)	hypothetical protein	0.0028	0.0473	0.1001
Trypanosoma cruzi	small ubiquitin protein, putative	0.0051	0.1231	1
Loa Loa (eye worm)	matrix metalloproteinase	0.0019	0.0158	0.0335
Echinococcus granulosus	FTZ F1 alpha	0.0053	0.1311	0.2341
Schistosoma mansoni	ubiquitin-like protein sumo/smt3-related	0.0051	0.1231	0.1894
Trichomonas vaginalis	cat eye syndrome critical region protein 2, cscr2, putative	0.0046	0.106	0.0508
Brugia malayi	hypothetical protein	0.0071	0.1895	0.3946
Onchocerca volvulus	Nuclear receptor subfamily 6 group A member 1 homolog	0.0025	0.0372	0.1233
Brugia malayi	Intermediate filament tail domain containing protein	0.0029	0.05	0.096
Brugia malayi	nuclear receptor NHR-67	0.0025	0.0372	0.0687
Echinococcus granulosus	hepatocyte nuclear factor 4 alpha	0.0053	0.1311	0.2341
Schistosoma mansoni	lamin	0.0029	0.05	0.0603
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-41	0.0053	0.1311	0.2776
Echinococcus granulosus	Basic leucine zipper bZIP transcription factor	0.009	0.2541	0.4536
Schistosoma mansoni	nuclear hormone receptor	0.0025	0.0372	0.0378
Echinococcus multilocularis	thyroid hormone receptor alpha	0.0188	0.5819	1
Loa Loa (eye worm)	hypothetical protein	0.0028	0.0464	0.0982
Echinococcus granulosus	nuclear receptor 2DBD gamma	0.0025	0.0372	0.0665
Loa Loa (eye worm)	hypothetical protein	0.0028	0.0464	0.0982
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.0313	1	1
Schistosoma mansoni	agrin	0.0019	0.0169	0.0019
Schistosoma mansoni	retinoic acid receptor RXR	0.0053	0.1311	0.2037
Brugia malayi	Ligand-binding domain of nuclear hormone receptor family protein	0.0053	0.1311	0.2697
Echinococcus multilocularis	Solute carrier organic anion transporter family	0.0028	0.0464	0.0797
Onchocerca volvulus		0.0028	0.0464	0.176
Schistosoma mansoni	lamin	0.0029	0.05	0.0603
Schistosoma mansoni	thyroid hormone receptor	0.0188	0.5819	1
Onchocerca volvulus		0.0053	0.1311	0.6638
Onchocerca volvulus		0.0028	0.0464	0.176
Schistosoma mansoni	organic anion transporter	0.0028	0.0464	0.054
Loa Loa (eye worm)	intermediate filament tail domain-containing protein	0.0029	0.05	0.1058
Brugia malayi	orphan nuclear receptor NR2E1	0.0025	0.0372	0.0687
Brugia malayi	Kazal-type serine protease inhibitor domain containing protein	0.0019	0.0169	0.0252
Loa Loa (eye worm)	hypothetical protein	0.0028	0.0482	0.102
Schistosoma mansoni	hypothetical protein	0.0181	0.5602	0.9616
Schistosoma mansoni	gcn5proteinral control of amino-acid synthesis 5-like 2 gcnl2	0.0155	0.4724	0.8065
Echinococcus multilocularis	nuclear receptor subfamily 1 group D	0.0028	0.0473	0.0813
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-14	0.0053	0.1311	0.2776
Mycobacterium leprae	Probable fructose bisphosphate aldolase Fba	0.0153	0.4647	1
Schistosoma mansoni	thyroid hormone receptor	0.0188	0.5819	1
Onchocerca volvulus	Putative organic anion transporter	0.0028	0.0464	0.176
Brugia malayi	Nuclear hormone receptor E75	0.0025	0.0372	0.0687
Trypanosoma cruzi	mitogen-activated protein kinase 11, putative	0.005	0.1192	0.9496
Brugia malayi	SPARC precursor	0.0019	0.0169	0.0252
Echinococcus granulosus	ubiquitin	0.0031	0.0582	0.1038
Onchocerca volvulus	Matrilysin homolog	0.0041	0.0919	0.4377
Brugia malayi	Ubiquitin-like protein SMT3	0.0051	0.1231	0.2524
Loa Loa (eye worm)	hypothetical protein	0.0031	0.0582	0.1231
Schistosoma mansoni	nuclear hormone receptor	0.0053	0.1311	0.2037
Brugia malayi	photoreceptor-specific nuclear receptor	0.0053	0.1311	0.2697
Loa Loa (eye worm)	hypothetical protein	0.0028	0.0464	0.0982
Schistosoma mansoni	matrix metallopeptidase-9 (M10 family)	0.0044	0.1017	0.1516
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.0313	1	1
Onchocerca volvulus		0.0028	0.0464	0.176
Schistosoma mansoni	hypothetical protein	0.0026	0.0419	0.0461
Onchocerca volvulus	Putative organic anion transporter	0.0028	0.0464	0.176
Loa Loa (eye worm)	intermediate filament protein	0.0029	0.05	0.1058
Brugia malayi	secreted modular calcium-binding protein 1	0.0019	0.0169	0.0252
Echinococcus multilocularis	follistatin	0.0019	0.0169	0.029
Onchocerca volvulus		0.0029	0.05	0.1965
Schistosoma mansoni	hypothetical protein	0.0181	0.5602	0.9616
Loa Loa (eye worm)	matrixin family protein	0.0045	0.1043	0.2209
Loa Loa (eye worm)	hypothetical protein	0.0025	0.0372	0.0788
Loa Loa (eye worm)	hypothetical protein	0.0025	0.0372	0.0788
Echinococcus granulosus	intermediate filament protein	0.0029	0.05	0.0892
Schistosoma mansoni	intermediate filament proteins	0.0029	0.05	0.0603
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-1	0.0053	0.1311	0.2776
Onchocerca volvulus		0.0029	0.05	0.1965
Echinococcus multilocularis	matrix metallopeptidase 7 (M10 family)	0.0068	0.1804	0.31
Loa Loa (eye worm)	hypothetical protein	0.0025	0.0372	0.0788
Brugia malayi	sodium-independent organic anion transporter family protein	0.0028	0.0464	0.0883
Echinococcus granulosus	retinoic acid receptor rxr beta a	0.0053	0.1311	0.2341
Onchocerca volvulus		0.0071	0.1895	1
Loa Loa (eye worm)	hypothetical protein	0.0053	0.1311	0.2776
Brugia malayi	Nuclear hormone receptor family member nhr-19	0.0053	0.1311	0.2697
Echinococcus granulosus	Small ubiquitin modifier 2	0.0051	0.1231	0.2197
Brugia malayi	Matrixin family protein	0.0019	0.0158	0.0229
Echinococcus granulosus	follistatin	0.0019	0.0169	0.0302
Loa Loa (eye worm)	hypothetical protein	0.0028	0.0473	0.1001
Schistosoma mansoni	coup transcription factor	0.0053	0.1311	0.2037
Loa Loa (eye worm)	hypothetical protein	0.0028	0.0473	0.1001
Toxoplasma gondii	histone lysine acetyltransferase GCN5-B	0.0046	0.106	0.8395
Brugia malayi	hypothetical protein	0.0028	0.0464	0.0883
Onchocerca volvulus	Putative organic anion transporter	0.0028	0.0464	0.176
Loa Loa (eye worm)	hypothetical protein	0.0019	0.0169	0.0358
Loa Loa (eye worm)	hypothetical protein	0.0087	0.2459	0.5204
Brugia malayi	bZIP transcription factor family protein	0.009	0.2541	0.5328
Brugia malayi	intermediate filament protein	0.0029	0.05	0.096
Brugia malayi	MAP kinase sur-1	0.005	0.1192	0.2441
Toxoplasma gondii	transporter, major facilitator family protein	0.0028	0.0464	0.2779
Loa Loa (eye worm)	hypothetical protein	0.0025	0.0372	0.0788
Brugia malayi	Steroid receptor seven-up type 2	0.0053	0.1311	0.2697
Echinococcus multilocularis	FTZ F1 nuclear receptor protein	0.0053	0.1311	0.2253
Loa Loa (eye worm)	hypothetical protein	0.0028	0.0464	0.0982

Activities

Activity type	Activity value	Assay description	Source	Reference
GI50 (functional)	-4.87	PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the SF-539 Central Nervous System cell line. (Class of assay: confirmatory)	ChEMBL.	No reference
GI50 (functional)	-4.865	PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the MDA-N Breast cell line. (Class of assay: confirmatory)	ChEMBL.	No reference
GI50 (functional)	-4.851	PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the DU-145 Prostate cell line. (Class of assay: confirmatory)	ChEMBL.	No reference
GI50 (functional)	-4.829	PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the UO-31 Renal cell line. (Class of assay: confirmatory)	ChEMBL.	No reference
GI50 (functional)	-4.824	PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the HL-60(TB) Leukemia cell line. (Class of assay: confirmatory)	ChEMBL.	No reference
GI50 (functional)	-4.796	PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the SK-MEL-5 Melanoma cell line. (Class of assay: confirmatory)	ChEMBL.	No reference
GI50 (functional)	-4.766	PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the NCI-H23 Non-Small Cell Lung cell line. (Class of assay: confirmatory)	ChEMBL.	No reference
GI50 (functional)	-4.756	PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the SN12C Renal cell line. (Class of assay: confirmatory)	ChEMBL.	No reference
GI50 (functional)	-4.707	PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the MALME-3M Melanoma cell line. (Class of assay: confirmatory)	ChEMBL.	No reference
GI50 (functional)	-4.635	PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the HOP-92 Non-Small Cell Lung cell line. (Class of assay: confirmatory)	ChEMBL.	No reference
GI50 (functional)	-4.531	PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the ACHN Renal cell line. (Class of assay: confirmatory)	ChEMBL.	No reference
IC50 (functional)	ug ml-1	In vitro cytotoxic activity against, human lymphoblastic leukemia cell culture (CCRF-CEM); nt=Not tested	ChEMBL.	4045930
IC50 (functional)	0 ug ml-1	In vitro cytotoxic activity against, human lymphoblastic leukemia cell culture (CCRF-CEM); nt=Not tested	ChEMBL.	4045930
IC50 (functional)	= 12.5 ug ml-1	In vitro cytotoxic activity against B-16 mouse melanoma (B-16)	ChEMBL.	4045930
IC50 (functional)	= 12.5 ug ml-1	In vitro cytotoxic activity against B-16 mouse melanoma (B-16)	ChEMBL.	4045930
IC50 (functional)	= 13.8 ug ml-1	In vitro cytotoxic activity against L-1210 mouse lymphocytic leukemia cell culture (ATCC CCL-219)	ChEMBL.	4045930
IC50 (functional)	= 13.8 ug ml-1	In vitro cytotoxic activity against L-1210 mouse lymphocytic leukemia cell culture (ATCC CCL-219)	ChEMBL.	4045930
Inhibition (binding)		Inhibition of Mycobacterium tuberculosis RmlD assessed as inhibition of dTDP-beta-6-deoxy-L-lyxo-4-hexulose to dTDP-beta-L-rhamnose conversion at 10 ug/ml	ChEMBL.	22014548
MIC (functional)	ug ml-1	In vitro antimicrobial activity against Candida albicans ATCC 10231 tested at 25-0.1 ug/mL; i=Inactive at highest concentration	ChEMBL.	4045930
MIC (functional)	i 0 ug ml-1	In vitro antimicrobial activity against,Klebsiella pneumoniae ATCC 10031 tested at 25-0.1 ug/mL; i=Inactive at highest concentration	ChEMBL.	4045930
MIC (functional)	i 0 ug ml-1	In vitro antimicrobial activity against Candida albicans ATCC 10231 tested at 25-0.1 ug/mL; i=Inactive at highest concentration	ChEMBL.	4045930
MIC (functional)	= 12.5 ug ml-1	In vitro antimicrobial activity against Mycobacterium smegmatis ATCC 607 tested at 25-0.1 ug/mL	ChEMBL.	4045930
MIC (functional)	= 25 ug ml-1	In vitro antimicrobial activity against, Staphylococcus aureus ATCC 13709 tested at 25-0.1 ug/mL	ChEMBL.	4045930

Phenotypes

Whole-cell/tissue/organism interactions

Species name	Source	Reference	Is orphan
Mus musculus	ChEMBL23	4045930

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

Search by CAS
ChEMBL: CHEMBL38650
PubChem: 72740

Bibliographic References

3 literature references were collected for this gene.

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Detailed information for compound 55807