TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 399.525 | Formula: C27H29NO2
H donors: 1 H acceptors: 3 LogP: 7.19 Rotable bonds: 3
Rule of 5 violations (Lipinski): 1
SMILES: Cc1cc2c(cc1c1cccc(n1)c1ccc(cc1)C(=O)O)C(C)(C)CCC2(C)C
InChi: 1S/C27H29NO2/c1-17-15-21-22(27(4,5)14-13-26(21,2)3)16-20(17)24-8-6-7-23(28-24)18-9-11-19(12-10-18)25(29)30/h6-12,15-16H,13-14H2,1-5H3,(H,29,30)
InChiKey: ACSZYKRTELLCHB-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	retinoic acid receptor, alpha	Starlite/ChEMBL	References
Homo sapiens	retinoic acid receptor, gamma	Starlite/ChEMBL	References
Homo sapiens	retinoid X receptor, alpha	Starlite/ChEMBL	References
Homo sapiens	retinoic acid receptor, beta	Starlite/ChEMBL	References

Predicted pathogen targets for this compound

By orthology

Species	Potential target	Known druggable target/s	Ortholog Group
Echinococcus multilocularis	retinoic acid receptor rxr beta a retinoic acid receptor rxr alpha a retinoic acid receptor rxr alpha	Get druggable targets OG5_130073	All targets in OG5_130073
Loa Loa (eye worm)	hypothetical protein	Get druggable targets OG5_131607	All targets in OG5_131607
Loa Loa (eye worm)	nuclear receptor nhr-7B	Get druggable targets OG5_131607	All targets in OG5_131607
Onchocerca volvulus	Steroid hormone receptor family member cnr14 homolog	Get druggable targets OG5_131607	All targets in OG5_131607
Echinococcus granulosus	retinoic acid receptor rxr beta a	Get druggable targets OG5_130073	All targets in OG5_130073
Schistosoma japonicum	ko:K08524 nuclear receptor, subfamily 2, group B, member 1, putative	Get druggable targets OG5_130073	All targets in OG5_130073
Brugia malayi	nuclear hormone receptor	Get druggable targets OG5_131607	All targets in OG5_131607
Schistosoma mansoni	retinoic acid receptor RXR	Get druggable targets OG5_130073	All targets in OG5_130073

By sequence similarity to non orthologous known druggable targets

Species	Potential target	Known druggable target	Length	Alignment span	Identity
Brugia malayi	ecdysteroid receptor	retinoid X receptor, alpha	435 aa	352 aa	23.9 %

Ranking Plot

Putative Targets List

Species	Potential target	Raw	Global	Species
Echinococcus multilocularis	retinoic acid receptor rxr beta a retinoic acid receptor rxr alpha a retinoic acid receptor rxr alpha	0.0182	0.1742	0.1861
Trypanosoma brucei	DNA polymerase kappa, putative	0.0041	0.0125	0.0365
Onchocerca volvulus		0.0133	0.1186	0.1186
Trichomonas vaginalis	rap1 and, putative	0.0366	0.3848	1
Brugia malayi	Nuclear hormone receptor family member nhr-31	0.0133	0.1186	0.129
Brugia malayi	nuclear hormone receptor	0.0133	0.1186	0.129
Trichomonas vaginalis	ral, putative	0.0366	0.3848	1
Schistosoma mansoni	nuclear receptor	0.0063	0.0378	0.0404
Mycobacterium leprae	Probable fructose bisphosphate aldolase Fba	0.0143	0.1297	1
Brugia malayi	Nuclear hormone receptor-like 1	0.0133	0.1186	0.129
Brugia malayi	hypothetical protein	0.0063	0.0378	0.0411
Trypanosoma cruzi	mitochondrial DNA polymerase beta, putative	0.0303	0.3125	1
Schistosoma mansoni	nuclear receptor	0.0063	0.0378	0.0404
Brugia malayi	Thioredoxin reductase	0.0038	0.0092	0.01
Loa Loa (eye worm)	hypothetical protein	0.007	0.0465	0.0505
Loa Loa (eye worm)	hypothetical protein	0.0063	0.0378	0.0411
Echinococcus multilocularis	serotonin receptor	0.0281	0.2879	0.3075
Entamoeba histolytica	Ras family GTPase	0.0366	0.3848	1
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-1	0.0133	0.1186	0.129
Loa Loa (eye worm)	hypothetical protein	0.0133	0.1186	0.129
Trypanosoma cruzi	mitochondrial DNA polymerase beta-PAK, putative	0.0052	0.0252	0.0527
Loa Loa (eye worm)	hypothetical protein	0.0769	0.8472	0.9216
Schistosoma mansoni	nuclear hormone receptor	0.0063	0.0378	0.0404
Loa Loa (eye worm)	nuclear receptor nhr-7B	0.0832	0.9193	1
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.0293	0.3013	0.7757
Brugia malayi	Nuclear hormone receptor family member nhr-3	0.0133	0.1186	0.129
Echinococcus granulosus	DNA topoisomerase 1	0.0186	0.1789	0.1911
Mycobacterium tuberculosis	Probable reductase	0.0086	0.0648	0.3997
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.0293	0.3013	0.7757
Brugia malayi	steroid hormone receptor	0.0133	0.1186	0.129
Schistosoma mansoni	retinoic acid receptor RXR	0.0252	0.255	0.2724
Trypanosoma brucei	trypanothione reductase	0.0038	0.0092	0.0258
Schistosoma mansoni	DNA topoisomerase type I	0.0186	0.1789	0.1911
Brugia malayi	bHLH-PAS transcription factor	0.0036	0.0071	0.0077
Mycobacterium tuberculosis	Probable nitrite reductase [NAD(P)H] large subunit [FAD flavoprotein] NirB	0.0086	0.0648	0.3997
Plasmodium vivax	topoisomerase I, putative	0.0186	0.1789	1
Echinococcus granulosus	single minded 2	0.0036	0.0071	0.0075
Echinococcus granulosus	nuclear receptor 2DBD gamma	0.0063	0.0378	0.0404
Brugia malayi	nuclear receptor NHR-67	0.0063	0.0378	0.0411
Leishmania major	mitochondrial DNA polymerase beta-PAK, putative	0.0143	0.1298	0.3978
Toxoplasma gondii	hypothetical protein	0.0049	0.0217	0.1211
Mycobacterium tuberculosis	Probable oxidoreductase	0.0096	0.0759	0.4791
Plasmodium vivax	thioredoxin reductase, putative	0.0038	0.0092	0.0512
Echinococcus granulosus	FTZ F1 nuclear receptor protein	0.0133	0.1186	0.1267
Mycobacterium leprae	DIHYDROLIPOAMIDE DEHYDROGENASE LPD (LIPOAMIDE REDUCTASE (NADH)) (LIPOYL DEHYDROGENASE) (DIHYDROLIPOYL DEHYDROGENASE) (DIAPHORASE	0.0096	0.0759	0.1705
Schistosoma mansoni	nuclear hormone receptor	0.0063	0.0378	0.0404
Echinococcus multilocularis	nuclear receptor subfamily 1 group D	0.007	0.0465	0.0496
Echinococcus granulosus	ecdysone induced protein 78C	0.0133	0.1186	0.1267
Schistosoma mansoni	nuclear hormone receptor superfamily protein-related	0.0063	0.0378	0.0404
Trypanosoma cruzi	DNA polymerase kappa, putative	0.0041	0.0125	0.0109
Loa Loa (eye worm)	hypothetical protein	0.007	0.0465	0.0505
Entamoeba histolytica	ras-1, putative	0.0366	0.3848	1
Trypanosoma brucei	DNA polymerase kappa, putative	0.0041	0.0125	0.0365
Loa Loa (eye worm)	hypothetical protein	0.0031	0.0011	0.0012
Trypanosoma brucei	mitochondrial DNA polymerase beta	0.0303	0.3125	1
Mycobacterium ulcerans	fructose-bisphosphate aldolase	0.0143	0.1297	0.8675
Trypanosoma cruzi	mitochondrial DNA polymerase beta, putative	0.0303	0.3125	1
Trypanosoma brucei	mitochondrial DNA polymerase beta-PAK	0.0143	0.1298	0.4134
Mycobacterium tuberculosis	Probable membrane NADH dehydrogenase NdhA	0.0086	0.0648	0.3997
Brugia malayi	Nuclear hormone receptor family member nhr-19	0.0133	0.1186	0.129
Loa Loa (eye worm)	hypothetical protein	0.0063	0.0378	0.0411
Loa Loa (eye worm)	hypothetical protein	0.0063	0.0378	0.0411
Loa Loa (eye worm)	hypothetical protein	0.007	0.0465	0.0505
Trypanosoma cruzi	mitochondrial DNA polymerase beta-PAK, putative	0.0043	0.0145	0.0176
Trypanosoma cruzi	DNA polymerase beta thumb, putative	0.0043	0.0145	0.0176
Brugia malayi	Ligand-binding domain of nuclear hormone receptor family protein	0.0133	0.1186	0.129
Echinococcus multilocularis	thioredoxin glutathione reductase	0.0038	0.0097	0.0104
Brugia malayi	Nuclear hormone receptor family member nhr-14	0.0133	0.1186	0.129
Echinococcus multilocularis	Nuclear hormone receptor HR96	0.0063	0.0378	0.0404
Schistosoma mansoni	nuclear hormone receptor	0.0133	0.1186	0.1267
Loa Loa (eye worm)	glutathione reductase	0.0038	0.0092	0.01
Loa Loa (eye worm)	nuclear hormone receptor-like 1	0.007	0.0465	0.0505
Brugia malayi	ecdysone receptor	0.0063	0.0378	0.0411
Trypanosoma brucei	DNA polymerase kappa, putative	0.0041	0.0125	0.0365
Echinococcus granulosus	dna polymerase kappa	0.0041	0.0125	0.0133
Loa Loa (eye worm)	hypothetical protein	0.0133	0.1186	0.129
Brugia malayi	nuclear receptor subfamily 1, group D, member 1, putative	0.0063	0.0378	0.0411
Trypanosoma brucei	DNA topoisomerase IB, large subunit	0.0139	0.1253	0.3989
Echinococcus granulosus	COUP TF:Svp nuclear hormone receptor	0.0133	0.1186	0.1267
Echinococcus multilocularis	DNA topoisomerase 1	0.0186	0.1789	0.1911
Loa Loa (eye worm)	hypothetical protein	0.0366	0.3848	0.4186
Giardia lamblia	Fructose-bisphosphate aldolase	0.0293	0.3013	0.5
Trypanosoma brucei	DNA polymerase IV, putative	0.0034	0.005	0.0124
Brugia malayi	Nuclear hormone receptor family member nhr-41	0.0133	0.1186	0.129
Brugia malayi	polk-prov protein	0.0031	0.0011	0.0012
Echinococcus granulosus	Nuclear hormone receptor family member nhr 41	0.0133	0.1186	0.1267
Trichomonas vaginalis	ras-dva small GTPase, putative	0.0366	0.3848	1
Brugia malayi	Nuclear hormone receptor family member nhr-25	0.0133	0.1186	0.129
Loa Loa (eye worm)	hypothetical protein	0.0133	0.1186	0.129
Brugia malayi	PAS domain containing protein	0.0049	0.0216	0.0235
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.0293	0.3013	0.7757
Leishmania major	DNA topoisomerase IB, large subunit	0.0139	0.1253	0.383
Loa Loa (eye worm)	hypothetical protein	0.0133	0.1186	0.129
Loa Loa (eye worm)	DR-78	0.0063	0.0378	0.0411
Echinococcus multilocularis	COUP TF:Svp nuclear hormone receptor	0.0133	0.1186	0.1267
Trypanosoma brucei	DNA polymerase beta thumb, putative	0.0043	0.0145	0.043
Onchocerca volvulus	Protein ultraspiracle homolog	0.0133	0.1186	0.1186
Echinococcus granulosus	hepatocyte nuclear factor 4 alpha	0.0133	0.1186	0.1267
Schistosoma mansoni	biogenic amine (5HT) receptor	0.0281	0.2879	0.3075
Brugia malayi	nuclear hormone receptor family member nhr-6	0.0063	0.0378	0.0411
Trypanosoma brucei	DNA polymerase IV, putative	0.0041	0.0125	0.0365
Loa Loa (eye worm)	hypothetical protein	0.0133	0.1186	0.129
Mycobacterium tuberculosis	Dihydrolipoamide dehydrogenase LpdC (lipoamide reductase (NADH)) (lipoyl dehydrogenase) (dihydrolipoyl dehydrogenase) (diaphoras	0.0096	0.0759	0.4791
Loa Loa (eye worm)	DNA topoisomerase I	0.0186	0.1789	0.1946
Echinococcus multilocularis	FTZ F1 nuclear receptor protein	0.0133	0.1186	0.1267
Mycobacterium ulcerans	DNA polymerase IV	0.0041	0.0125	0.0383
Schistosoma mansoni	retinoid-x-receptor (RXR)	0.007	0.0465	0.0496
Loa Loa (eye worm)	steroid hormone receptor	0.0133	0.1186	0.129
Plasmodium falciparum	topoisomerase I	0.0186	0.1789	1
Mycobacterium tuberculosis	Conserved hypothetical protein	0.0159	0.1484	1
Echinococcus granulosus	nuclear receptor 2DBD gamma	0.0133	0.1186	0.1267
Loa Loa (eye worm)	nuclear Hormone Receptor family member	0.0133	0.1186	0.129
Loa Loa (eye worm)	hypothetical protein	0.0063	0.0378	0.0411
Loa Loa (eye worm)	hypothetical protein	0.007	0.0465	0.0505
Echinococcus multilocularis	hepatocyte nuclear factor 4 alpha	0.0133	0.1186	0.1267
Mycobacterium tuberculosis	Probable dehydrogenase	0.0086	0.0648	0.3997
Brugia malayi	nuclear receptor RXR	0.007	0.0465	0.0505
Echinococcus granulosus	nuclear receptor subfamily 1 group D	0.007	0.0465	0.0496
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.0293	0.3013	0.7757
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.0293	0.3013	0.7757
Schistosoma mansoni	ecdysone-induced protein 78c (dr-78)	0.007	0.0465	0.0496
Brugia malayi	hypothetical protein	0.007	0.0465	0.0505
Trypanosoma cruzi	DNA topoisomerase type IB small subunit, putative	0.0047	0.0193	0.0334
Echinococcus multilocularis	nuclear receptor subfamily 4 group A	0.0063	0.0378	0.0404
Brugia malayi	glutathione reductase	0.0038	0.0092	0.01
Brugia malayi	Ligand-binding domain of nuclear hormone receptor family protein	0.0133	0.1186	0.129
Toxoplasma gondii	thioredoxin reductase	0.0038	0.0092	0.0512
Brugia malayi	Nuclear hormone receptor E75	0.0063	0.0378	0.0411
Schistosoma mansoni	RAR-like nuclear receptor	0.0133	0.1186	0.1267
Brugia malayi	nuclear hormone receptor	0.0832	0.9193	1
Loa Loa (eye worm)	hypothetical protein	0.0063	0.0378	0.0411
Trypanosoma brucei	DNA polymerase kappa, putative	0.0041	0.0125	0.0365
Loa Loa (eye worm)	Ras protein let-60	0.0366	0.3848	0.4186
Loa Loa (eye worm)	hypothetical protein	0.0133	0.1186	0.129
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-49	0.0133	0.1186	0.129
Brugia malayi	hypothetical protein	0.0063	0.0378	0.0411
Trypanosoma cruzi	DNA polymerase kappa, putative	0.0041	0.0125	0.0109
Brugia malayi	nuclear hormone receptor family member odr-7	0.0063	0.0378	0.0411
Brugia malayi	Nuclear hormone receptor E75	0.0063	0.0378	0.0411
Echinococcus multilocularis	thyroid hormone receptor alpha	0.0133	0.1186	0.1267
Schistosoma mansoni	hepatocyte nuclear factor 4-alpha (hnf-4-alpha)	0.0063	0.0378	0.0404
Schistosoma mansoni	retinoid-x-receptor (RXR)	0.0133	0.1186	0.1267
Echinococcus multilocularis	microtubule associated protein 2	0.0691	0.7581	0.8098
Loa Loa (eye worm)	hypothetical protein	0.0281	0.2879	0.3131
Onchocerca volvulus		0.0036	0.0071	0.0071
Echinococcus multilocularis	transfer RNA-Lys	0.0036	0.0071	0.0075
Leishmania major	mitochondrial DNA polymerase beta	0.0303	0.3125	1
Brugia malayi	Steroid receptor seven-up type 2	0.0133	0.1186	0.129
Loa Loa (eye worm)	hypothetical protein	0.0063	0.0378	0.0411
Loa Loa (eye worm)	hypothetical protein	0.007	0.0465	0.0505
Echinococcus multilocularis	biogenic amine (5HT) receptor	0.0847	0.9361	1
Trichomonas vaginalis	set domain proteins, putative	0.0237	0.2377	0.6049
Brugia malayi	ecdysteroid receptor	0.0133	0.1186	0.129
Onchocerca volvulus	Nuclear receptor subfamily 6 group A member 1 homolog	0.0063	0.0378	0.0378
Echinococcus multilocularis	nuclear receptor nhr 48	0.0063	0.0378	0.0404
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-14	0.0133	0.1186	0.129
Schistosoma mansoni	DNA topoisomerase type I	0.0139	0.1253	0.1339
Onchocerca volvulus		0.0237	0.2377	0.2377
Echinococcus granulosus	nuclear receptor nhr 48	0.0063	0.0378	0.0404
Brugia malayi	Nuclear hormone receptor family member nhr-25	0.0133	0.1186	0.129
Trypanosoma cruzi	DNA polymerase kappa, putative	0.0041	0.0125	0.0109
Plasmodium vivax	glutathione reductase, putative	0.0038	0.0092	0.0512
Trichomonas vaginalis	GTP-binding protein rit, putative	0.0366	0.3848	1
Brugia malayi	Nuclear hormone receptor family member nhr-40	0.0133	0.1186	0.129
Schistosoma mansoni	steroid hormone receptor ad4bp	0.0133	0.1186	0.1267
Brugia malayi	Nuclear hormone receptor family member nhr-1	0.0133	0.1186	0.129
Mycobacterium ulcerans	DNA polymerase IV	0.0041	0.0125	0.0383
Schistosoma mansoni	single-minded	0.0049	0.0216	0.0231
Trypanosoma cruzi	DNA polymerase kappa, putative	0.0041	0.0125	0.0109
Mycobacterium tuberculosis	NAD(P)H quinone reductase LpdA	0.0096	0.0759	0.4791
Loa Loa (eye worm)	hypothetical protein	0.0063	0.0378	0.0411
Onchocerca volvulus		0.0063	0.0378	0.0378
Loa Loa (eye worm)	nuclear hormone receptor	0.0063	0.0378	0.0411
Schistosoma mansoni	photoreceptor-specific nuclear receptor related	0.0133	0.1186	0.1267
Schistosoma mansoni	microtubule-associated protein tau	0.0691	0.7581	0.8098
Trichomonas vaginalis	rheb, putative	0.0366	0.3848	1
Schistosoma mansoni	FTZ-F1 nuclear receptor-like protein	0.0133	0.1186	0.1267
Schistosoma mansoni	thyroid hormone receptor	0.0133	0.1186	0.1267
Echinococcus granulosus	FTZ F1 alpha	0.0133	0.1186	0.1267
Brugia malayi	Nuclear hormone receptor-like 1	0.007	0.0465	0.0505
Onchocerca volvulus	Nuclear receptor subfamily 6 group A member 1 homolog	0.0063	0.0378	0.0378
Brugia malayi	orphan nuclear receptor NR2E1	0.0063	0.0378	0.0411
Echinococcus multilocularis	ecdysone induced protein 78C	0.0133	0.1186	0.1267
Brugia malayi	conserved hypotetical protein	0.0063	0.0378	0.0411
Echinococcus granulosus	biogenic amine 5HT receptor	0.0281	0.2879	0.3075
Echinococcus multilocularis	dna polymerase kappa	0.0041	0.0125	0.0133
Echinococcus granulosus	Nuclear hormone receptor HR96	0.0063	0.0378	0.0404
Brugia malayi	Nuclear hormone receptor family member nhr-19	0.0133	0.1186	0.129
Brugia malayi	photoreceptor-specific nuclear receptor	0.0133	0.1186	0.129
Entamoeba histolytica	Ras family GTPase	0.0366	0.3848	1
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.0293	0.3013	0.7757
Trypanosoma brucei	DNA polymerase kappa, putative	0.0041	0.0125	0.0365
Brugia malayi	hypothetical protein	0.007	0.0465	0.0505
Loa Loa (eye worm)	hypothetical protein	0.0063	0.0378	0.0411
Loa Loa (eye worm)	hypothetical protein	0.0063	0.0378	0.0411
Echinococcus multilocularis	Nuclear hormone receptor family member nhr 41	0.0133	0.1186	0.1267
Trypanosoma cruzi	DNA polymerase beta thumb, putative	0.0043	0.0145	0.0176
Mycobacterium tuberculosis	Probable fructose-bisphosphate aldolase Fba	0.0143	0.1297	0.8655
Loa Loa (eye worm)	hypothetical protein	0.0281	0.2879	0.3131
Loa Loa (eye worm)	hypothetical protein	0.0133	0.1186	0.129
Trypanosoma brucei	DNA polymerase kappa, putative	0.0041	0.0125	0.0365
Trypanosoma cruzi	DNA topoisomerase IB, large subunit, putative	0.0139	0.1253	0.383
Echinococcus granulosus	nuclear receptor 2DBD gamma	0.0133	0.1186	0.1267
Mycobacterium tuberculosis	Putative ferredoxin reductase	0.0086	0.0648	0.3997
Schistosoma mansoni	zinc finger protein	0.0063	0.0378	0.0404
Trypanosoma brucei	DNA polymerase kappa, putative	0.0041	0.0125	0.0365
Trypanosoma brucei	DNA polymerase kappa, putative	0.0041	0.0125	0.0365
Trypanosoma brucei	DNA polymerase IV, putative	0.0041	0.0125	0.0365
Echinococcus multilocularis	Nuclear hormone receptor HR96	0.0063	0.0378	0.0404
Loa Loa (eye worm)	hypothetical protein	0.0063	0.0378	0.0411
Mycobacterium ulcerans	hypothetical protein	0.0159	0.1484	1
Loa Loa (eye worm)	hypothetical protein	0.0063	0.0378	0.0411
Echinococcus granulosus	ras gtpase	0.0366	0.3848	0.4111
Onchocerca volvulus		0.0063	0.0378	0.0378
Brugia malayi	DNA topoisomerase I	0.0186	0.1789	0.1946
Toxoplasma gondii	DNA topoisomerase I, putative	0.0186	0.1789	1
Echinococcus granulosus	thioredoxin glutathione reductase	0.0038	0.0097	0.0104
Brugia malayi	nuclear receptor NHR-88	0.0133	0.1186	0.129
Trichomonas vaginalis	dexras1, putative	0.0366	0.3848	1
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-40	0.0133	0.1186	0.129
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-41	0.0133	0.1186	0.129
Echinococcus granulosus	retinoic acid receptor rxr beta a	0.0252	0.255	0.2724
Loa Loa (eye worm)	thioredoxin reductase	0.0038	0.0092	0.01
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-31	0.0133	0.1186	0.129
Brugia malayi	Ras-related protein R-Ras2	0.0366	0.3848	0.4186
Loa Loa (eye worm)	hypothetical protein	0.0133	0.1186	0.129
Echinococcus multilocularis	nuclear receptor 2DBD gamma	0.0133	0.1186	0.1267
Brugia malayi	Nuclear hormone receptor family member nhr-49	0.0133	0.1186	0.129
Loa Loa (eye worm)	hypothetical protein	0.0164	0.1531	0.1666
Brugia malayi	Nuclear hormone receptor-like 1	0.007	0.0465	0.0505
Trypanosoma cruzi	mitochondrial DNA polymerase beta-PAK, putative	0.0143	0.1298	0.3978
Trypanosoma brucei	DNA polymerase kappa, putative	0.0041	0.0125	0.0365
Schistosoma mansoni	biogenic amine (5HT) receptor	0.0847	0.9361	1
Brugia malayi	Pre-SET motif family protein	0.0209	0.2047	0.2227
Brugia malayi	tailless protein	0.0063	0.0378	0.0411
Echinococcus multilocularis	nuclear receptor 2DBD gamma	0.0063	0.0378	0.0404
Schistosoma mansoni	DNA topoisomerase type I	0.0139	0.1253	0.1339
Schistosoma mansoni	nuclear receptor 2DBD-gamma	0.0133	0.1186	0.1267
Leishmania major	DNA topoisomerase type IB small subunit	0.0047	0.0193	0.0334
Echinococcus granulosus	microtubule associated protein 2	0.0691	0.7581	0.8098
Echinococcus multilocularis	ras gtpase	0.0366	0.3848	0.4111
Trypanosoma brucei	DNA topoisomerase type IB small subunit	0.0047	0.0193	0.0584
Brugia malayi	nuclear receptor RXR	0.0063	0.0378	0.0411
Brugia malayi	nuclear receptor NHR-88	0.0063	0.0378	0.0411
Echinococcus granulosus	nuclear receptor subfamily 4 group A	0.0063	0.0378	0.0404
Echinococcus multilocularis	nuclear receptor 2DBD gamma	0.0133	0.1186	0.1267
Echinococcus multilocularis	FTZ F1 alpha	0.0133	0.1186	0.1267
Schistosoma mansoni	coup transcription factor	0.0133	0.1186	0.1267
Schistosoma mansoni	nuclear hormone receptor nor-1/nor-2	0.0133	0.1186	0.1267
Mycobacterium tuberculosis	Probable NADH dehydrogenase Ndh	0.0086	0.0648	0.3997
Echinococcus multilocularis	serotonin receptor	0.0281	0.2879	0.3075
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.0293	0.3013	0.7757
Brugia malayi	Ras protein let-60	0.0366	0.3848	0.4186
Echinococcus granulosus	Nuclear hormone receptor HR96	0.0063	0.0378	0.0404
Loa Loa (eye worm)	hypoxia-induced factor 1	0.0151	0.1386	0.1508
Loa Loa (eye worm)	hypothetical protein	0.0063	0.0378	0.0411
Schistosoma mansoni	Tr4/Tr2 (homologue)	0.0133	0.1186	0.1267
Brugia malayi	hypoxia-induced factor 1	0.0151	0.1386	0.1508
Onchocerca volvulus	Bile acid receptor homolog	0.0133	0.1186	0.1186
Schistosoma mansoni	thyroid hormone receptor	0.0133	0.1186	0.1267
Schistosoma mansoni	nuclear receptor nhr-48	0.0063	0.0378	0.0404
Loa Loa (eye worm)	hypothetical protein	0.0063	0.0378	0.0411
Echinococcus granulosus	thyroid hormone receptor alpha	0.0063	0.0378	0.0404
Schistosoma mansoni	aryl hydrocarbon receptor	0.0049	0.0216	0.0231
Loa Loa (eye worm)	pre-SET domain-containing protein family protein	0.0209	0.2047	0.2227
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.0293	0.3013	0.7757
Trypanosoma brucei	unspecified product	0.0034	0.005	0.0124
Brugia malayi	hypothetical protein	0.0164	0.1531	0.1666
Treponema pallidum	fructose-bisphosphate aldolase	0.0293	0.3013	0.5
Echinococcus granulosus	biogenic amine 5HT receptor	0.0847	0.9361	1
Loa Loa (eye worm)	nuclear receptor NHR-67	0.0063	0.0378	0.0411

Activities

Activity type	Activity value	Assay description	Source	Reference
AC50 (binding)	> 1000 nM	Transcriptional activation in CV-1 cells expressing Retinoic acid receptor alpha	ChEMBL.	10890153
AC50 (binding)	> 1000 nM	Transcriptional activation in CV-1 cells expressing Retinoic acid receptor beta	ChEMBL.	10890153
AC50 (binding)	= 1000 nM	Transcriptional activation in CV-1 cells expressing retinoic acid gamma receptor	ChEMBL.	10890153
AC50 (binding)	> 1000 nM	Transcriptional activation in CV-1 cells expressing Retinoic acid receptor RXR-alpha	ChEMBL.	10890153
AC50 (binding)	> 1000 nM	Transcriptional activation in CV-1 cells expressing Retinoic acid receptor alpha	ChEMBL.	10890153
AC50 (binding)	> 1000 nM	Transcriptional activation in CV-1 cells expressing Retinoic acid receptor beta	ChEMBL.	10890153
AC50 (binding)	= 1000 nM	Transcriptional activation in CV-1 cells expressing retinoic acid gamma receptor	ChEMBL.	10890153
AC50 (binding)	> 1000 nM	Transcriptional activation in CV-1 cells expressing Retinoic acid receptor RXR-alpha	ChEMBL.	10890153
Activation (binding)	= 0 %	Percent activation of Retinoic acid receptor RXR-alpha at 1 uM relative to 1 uM 9-cis-retinoic acid	ChEMBL.	10890153
Activation (binding)	= 0 %	Percent activation of Retinoic acid receptor RXR-alpha at 1 uM relative to 1 uM 9-cis-retinoic acid	ChEMBL.	10890153
Activation (binding)	= 5 %	Percent activation of Retinoic acid receptor gamma receptor at 1 uM relative to 1 uM trans-retinoic acid	ChEMBL.	10890153
Activation (binding)	= 5 %	Percent activation of Retinoic acid receptor gamma receptor at 1 uM relative to 1 uM trans-retinoic acid	ChEMBL.	10890153
Activation (binding)	= 26 %	Percent activation of Retinoic acid receptor alpha at 1 uM relative to 1 uM trans-retinoic acid	ChEMBL.	10890153
Activation (binding)	= 26 %	Percent activation of Retinoic acid receptor alpha at 1 uM relative to 1 uM trans-retinoic acid	ChEMBL.	10890153
Activation (binding)	= 42 %	Percent activation of Retinoic acid receptor beta at 1 uM relative to 1 uM trans-retinoic acid	ChEMBL.	10890153
Activation (binding)	= 42 %	Percent activation of Retinoic acid receptor beta at 1 uM relative to 1 uM trans-retinoic acid	ChEMBL.	10890153

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: CHEMBL428708

Bibliographic References

1 literature reference was collected for this gene.

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Detailed information for compound 32452