TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 507.525 | Formula: C24H24F3N3O4S
H donors: 2 H acceptors: 5 LogP: 3.56 Rotable bonds: 12
Rule of 5 violations (Lipinski): 2
SMILES: CCC(=O)N(c1ccc(cc1)SC[C@@](C(=O)Nc1ccc(c(c1)C(F)(F)F)C#N)(O)C)C(=O)CC
InChi: 1S/C24H24F3N3O4S/c1-4-20(31)30(21(32)5-2)17-8-10-18(11-9-17)35-14-23(3,34)22(33)29-16-7-6-15(13-28)19(12-16)24(25,26)27/h6-12,34H,4-5,14H2,1-3H3,(H,29,33)/t23-/m0/s1
InChiKey: FIGQBMHQXANYRA-QHCPKHFHSA-N

Network

Hover on a compound node to display the structore

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

This is a work in progress. Come back soon to try this features!

Clustering layers

This is a work in progress. Come back soon to try this features!

Synonyms

No synonyms found for this compound

Targets

Known targets for this compound

Species	Target name	Source	Bibliographic reference
Rattus norvegicus	Androgen Receptor	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

No druggable targets predicted by sequence similarity

Ranking Plot

Putative Targets List

Species	Potential target	Raw	Global	Species
Brugia malayi	hypothetical protein	0.0064	0.0327	0.0327
Echinococcus granulosus	FTZ F1 nuclear receptor protein	0.0136	0.1327	0.1327
Echinococcus multilocularis	carboxylesterase 5A	0.076	1	1
Loa Loa (eye worm)	animal heme peroxidase	0.0195	0.2148	0.2148
Brugia malayi	Nuclear hormone receptor-like 1	0.0136	0.1327	0.1327
Echinococcus granulosus	FTZ F1 alpha	0.0136	0.1327	0.1327
Loa Loa (eye worm)	nuclear hormone receptor	0.0064	0.0327	0.0327
Brugia malayi	nuclear hormone receptor family member odr-7	0.0064	0.0327	0.0327
Echinococcus multilocularis	peroxidasin	0.0195	0.2148	0.2148
Echinococcus multilocularis	BC026374 protein (S09 family)	0.0128	0.1219	0.1219
Echinococcus granulosus	BC026374 protein S09 family	0.0128	0.1219	0.1219
Loa Loa (eye worm)	animal heme peroxidase	0.0195	0.2148	0.2148
Onchocerca volvulus		0.0136	0.1327	0.6179
Brugia malayi	Nuclear hormone receptor family member nhr-40	0.0136	0.1327	0.1327
Loa Loa (eye worm)	hypothetical protein	0.0136	0.1327	0.1327
Loa Loa (eye worm)	eukaryotic-type carbonic anhydrase	0.0053	0.0165	0.0165
Echinococcus granulosus	Nuclear hormone receptor HR96	0.0064	0.0327	0.0327
Schistosoma mansoni	nuclear hormone receptor nor-1/nor-2	0.0136	0.1327	0.1327
Onchocerca volvulus	Peroxidase homolog	0.0195	0.2148	1
Loa Loa (eye worm)	hypothetical protein	0.0064	0.0327	0.0327
Brugia malayi	Carboxylesterase family protein	0.0128	0.1219	0.1219
Loa Loa (eye worm)	DR-78	0.0064	0.0327	0.0327
Loa Loa (eye worm)	blistered cuticle protein 3	0.0195	0.2148	0.2148
Echinococcus granulosus	thyroid hormone receptor alpha	0.0064	0.0327	0.0327
Loa Loa (eye worm)	hypothetical protein	0.0195	0.2148	0.2148
Schistosoma mansoni	nuclear receptor nhr-48	0.0064	0.0327	0.0327
Loa Loa (eye worm)	hypothetical protein	0.0195	0.2148	0.2148
Loa Loa (eye worm)	hypothetical protein	0.0072	0.0434	0.0434
Echinococcus multilocularis	nuclear receptor 2DBD gamma	0.0136	0.1327	0.1327
Loa Loa (eye worm)	nuclear Hormone Receptor family member	0.0136	0.1327	0.1327
Trypanosoma brucei	carbonic anhydrase-like protein	0.0053	0.0165	0.5
Schistosoma mansoni	zinc finger protein	0.0064	0.0327	0.0327
Schistosoma mansoni	peroxidasin	0.0195	0.2148	0.2148
Loa Loa (eye worm)	hypothetical protein	0.0072	0.0434	0.0434
Brugia malayi	orphan nuclear receptor NR2E1	0.0064	0.0327	0.0327
Loa Loa (eye worm)	hypothetical protein	0.0195	0.2148	0.2148
Onchocerca volvulus	Steroid hormone receptor family member cnr14 homolog	0.0136	0.1327	0.6179
Mycobacterium ulcerans	carboxylesterase, LipT	0.0128	0.1219	0.5
Loa Loa (eye worm)	hypothetical protein	0.0195	0.2148	0.2148
Echinococcus granulosus	Nuclear hormone receptor family member nhr 41	0.0136	0.1327	0.1327
Echinococcus granulosus	family S9 non peptidase ue S09 family	0.0128	0.1219	0.1219
Loa Loa (eye worm)	hypothetical protein	0.0064	0.0327	0.0327
Brugia malayi	nuclear receptor NHR-88	0.0064	0.0327	0.0327
Schistosoma mansoni	family S9 non-peptidase homologue (S09 family)	0.0128	0.1219	0.1219
Trypanosoma cruzi	carbonic anhydrase-like protein, putative	0.0053	0.0165	0.5
Loa Loa (eye worm)	hypothetical protein	0.0064	0.0327	0.0327
Onchocerca volvulus	Chorion peroxidase homolog	0.0195	0.2148	1
Echinococcus multilocularis	thyroid hormone receptor alpha	0.0136	0.1327	0.1327
Schistosoma mansoni	family S9 non-peptidase homologue (S09 family)	0.0128	0.1219	0.1219
Loa Loa (eye worm)	hypothetical protein	0.0128	0.1219	0.1219
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-41	0.0136	0.1327	0.1327
Loa Loa (eye worm)	hypothetical protein	0.076	1	1
Loa Loa (eye worm)	hypothetical protein	0.0064	0.0327	0.0327
Loa Loa (eye worm)	hypothetical protein	0.0064	0.0327	0.0327
Brugia malayi	Animal haem peroxidase family protein	0.0195	0.2148	0.2148
Loa Loa (eye worm)	acetylcholinesterase 1	0.076	1	1
Schistosoma mansoni	nuclear receptor 2DBD-gamma	0.0136	0.1327	0.1327
Brugia malayi	nuclear receptor RXR	0.0064	0.0327	0.0327
Schistosoma mansoni	thyroid hormone receptor	0.0136	0.1327	0.1327
Schistosoma mansoni	Tr4/Tr2 (homologue)	0.0136	0.1327	0.1327
Brugia malayi	nuclear receptor RXR	0.0072	0.0434	0.0434
Schistosoma mansoni	gliotactin	0.0128	0.1219	0.1219
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-31	0.0136	0.1327	0.1327
Brugia malayi	photoreceptor-specific nuclear receptor	0.0136	0.1327	0.1327
Brugia malayi	ecdysteroid receptor	0.0136	0.1327	0.1327
Loa Loa (eye worm)	hypothetical protein	0.0195	0.2148	0.2148
Loa Loa (eye worm)	hypothetical protein	0.0064	0.0327	0.0327
Loa Loa (eye worm)	hypothetical protein	0.0195	0.2148	0.2148
Echinococcus multilocularis	matrix metallopeptidase 7 (M10 family)	0.005	0.0128	0.0128
Loa Loa (eye worm)	hypothetical protein	0.0128	0.1219	0.1219
Loa Loa (eye worm)	hypothetical protein	0.0128	0.1219	0.1219
Echinococcus granulosus	COUP TF:Svp nuclear hormone receptor	0.0136	0.1327	0.1327
Loa Loa (eye worm)	hypothetical protein	0.0136	0.1327	0.1327
Echinococcus multilocularis	Nuclear hormone receptor family member nhr 41	0.0136	0.1327	0.1327
Brugia malayi	hypothetical protein	0.0072	0.0434	0.0434
Loa Loa (eye worm)	carboxylesterase	0.0128	0.1219	0.1219
Schistosoma mansoni	FTZ-F1 nuclear receptor-like protein	0.0136	0.1327	0.1327
Toxoplasma gondii	EGF family domain-containing protein	0.0041	0	0.5
Echinococcus granulosus	neuroligin	0.0128	0.1219	0.1219
Echinococcus multilocularis	family S9 non peptidase ue (S09 family)	0.0128	0.1219	0.1219
Loa Loa (eye worm)	hypothetical protein	0.0136	0.1327	0.1327
Brugia malayi	Nuclear hormone receptor family member nhr-3	0.0136	0.1327	0.1327
Loa Loa (eye worm)	hypothetical protein	0.0064	0.0327	0.0327
Echinococcus multilocularis	FTZ F1 nuclear receptor protein	0.0136	0.1327	0.1327
Schistosoma mansoni	retinoid-x-receptor (RXR)	0.0072	0.0434	0.0434
Loa Loa (eye worm)	hypothetical protein	0.0064	0.0327	0.0327
Brugia malayi	nuclear hormone receptor	0.0136	0.1327	0.1327
Brugia malayi	Carboxylesterase family protein	0.0128	0.1219	0.1219
Brugia malayi	nuclear hormone receptor	0.0064	0.0327	0.0327
Brugia malayi	hypothetical protein	0.0064	0.0327	0.0327
Brugia malayi	nuclear hormone receptor family member nhr-6	0.0064	0.0327	0.0327
Brugia malayi	Animal haem peroxidase family protein	0.0195	0.2148	0.2148
Brugia malayi	Nuclear hormone receptor family member nhr-19	0.0136	0.1327	0.1327
Echinococcus multilocularis	acetylcholinesterase	0.076	1	1
Schistosoma mansoni	BC026374 protein (S09 family)	0.0128	0.1219	0.1219
Schistosoma mansoni	neuroligin 3 (S09 family)	0.0128	0.1219	0.1219
Onchocerca volvulus		0.0128	0.1219	0.5678
Loa Loa (eye worm)	animal heme peroxidase	0.0195	0.2148	0.2148
Echinococcus multilocularis	acetylcholinesterase	0.076	1	1
Echinococcus granulosus	nuclear receptor 2DBD gamma	0.0064	0.0327	0.0327
Loa Loa (eye worm)	carboxylesterase	0.076	1	1
Onchocerca volvulus	Peroxidasin homolog	0.0195	0.2148	1
Schistosoma mansoni	nuclear receptor	0.0064	0.0327	0.0327
Echinococcus multilocularis	COUP TF:Svp nuclear hormone receptor	0.0136	0.1327	0.1327
Brugia malayi	Nuclear hormone receptor family member nhr-41	0.0136	0.1327	0.1327
Echinococcus multilocularis	carbonic anhydrase II	0.0053	0.0165	0.0165
Brugia malayi	Animal haem peroxidase family protein	0.0195	0.2148	0.2148
Loa Loa (eye worm)	hypothetical protein	0.0064	0.0327	0.0327
Schistosoma mansoni	coup transcription factor	0.0136	0.1327	0.1327
Onchocerca volvulus	Protein ultraspiracle homolog	0.0136	0.1327	0.6179
Echinococcus granulosus	hepatocyte nuclear factor 4 alpha	0.0136	0.1327	0.1327
Brugia malayi	Nuclear hormone receptor family member nhr-25	0.0136	0.1327	0.1327
Schistosoma mansoni	nuclear hormone receptor superfamily protein-related	0.0064	0.0327	0.0327
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-1	0.0136	0.1327	0.1327
Loa Loa (eye worm)	hypothetical protein	0.0195	0.2148	0.2148
Trichomonas vaginalis	spcc417.12 protein, putative	0.0128	0.1219	0.5
Echinococcus granulosus	ecdysone induced protein 78C	0.0136	0.1327	0.1327
Brugia malayi	Nuclear hormone receptor-like 1	0.0072	0.0434	0.0434
Brugia malayi	Eukaryotic-type carbonic anhydrase family protein	0.0053	0.0165	0.0165
Brugia malayi	Nuclear hormone receptor-like 1	0.0072	0.0434	0.0434
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-14	0.0136	0.1327	0.1327
Loa Loa (eye worm)	hypothetical protein	0.0128	0.1219	0.1219
Brugia malayi	hypothetical protein	0.0072	0.0434	0.0434
Echinococcus granulosus	carboxylesterase 5A	0.076	1	1
Brugia malayi	Nuclear hormone receptor family member nhr-31	0.0136	0.1327	0.1327
Brugia malayi	nuclear receptor NHR-88	0.0136	0.1327	0.1327
Schistosoma mansoni	retinoic acid receptor RXR	0.0136	0.1327	0.1327
Loa Loa (eye worm)	hypothetical protein	0.0072	0.0434	0.0434
Loa Loa (eye worm)	hypothetical protein	0.0072	0.0434	0.0434
Onchocerca volvulus	Dual oxidase homolog	0.0195	0.2148	1
Loa Loa (eye worm)	hypothetical protein	0.0072	0.0434	0.0434
Loa Loa (eye worm)	nuclear hormone receptor-like 1	0.0072	0.0434	0.0434
Brugia malayi	tailless protein	0.0064	0.0327	0.0327
Onchocerca volvulus		0.0195	0.2148	1
Loa Loa (eye worm)	hypothetical protein	0.0195	0.2148	0.2148
Onchocerca volvulus		0.0128	0.1219	0.5678
Brugia malayi	Carboxylesterase family protein	0.0128	0.1219	0.1219
Loa Loa (eye worm)	hypothetical protein	0.0128	0.1219	0.1219
Brugia malayi	Nuclear hormone receptor family member nhr-19	0.0136	0.1327	0.1327
Onchocerca volvulus		0.0128	0.1219	0.5678
Echinococcus granulosus	retinoic acid receptor rxr beta a	0.0136	0.1327	0.1327
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-49	0.0136	0.1327	0.1327
Schistosoma mansoni	thyroid hormone receptor	0.0136	0.1327	0.1327
Onchocerca volvulus	Bile acid receptor homolog	0.0136	0.1327	0.6179
Loa Loa (eye worm)	hypothetical protein	0.0136	0.1327	0.1327
Echinococcus granulosus	nuclear receptor subfamily 4 group A	0.0064	0.0327	0.0327
Onchocerca volvulus	Peroxidasin homolog	0.0195	0.2148	1
Brugia malayi	Animal haem peroxidase family protein	0.0195	0.2148	0.2148
Brugia malayi	Carboxylesterase family protein	0.076	1	1
Onchocerca volvulus		0.0195	0.2148	1
Loa Loa (eye worm)	hypothetical protein	0.0128	0.1219	0.1219
Echinococcus multilocularis	retinoic acid receptor rxr beta a retinoic acid receptor rxr alpha a retinoic acid receptor rxr alpha	0.0064	0.0327	0.0327
Loa Loa (eye worm)	hypothetical protein	0.0195	0.2148	0.2148
Schistosoma mansoni	family S9 non-peptidase homologue (S09 family)	0.076	1	1
Brugia malayi	Carboxylesterase family protein	0.0128	0.1219	0.1219
Echinococcus granulosus	Nuclear hormone receptor HR96	0.0064	0.0327	0.0327
Schistosoma mansoni	steroid hormone receptor ad4bp	0.0136	0.1327	0.1327
Loa Loa (eye worm)	hypothetical protein	0.0064	0.0327	0.0327
Schistosoma mansoni	carbonic anhydrase II (carbonate dehydratase II)	0.0053	0.0165	0.0165
Onchocerca volvulus	Peroxidase homolog	0.0195	0.2148	1
Mycobacterium tuberculosis	POSSIBLE PARA-NITROBENZYL ESTERASE (FRAGMENT)	0.0128	0.1219	0.5
Schistosoma mansoni	family S9 non-peptidase homologue (S09 family)	0.0128	0.1219	0.1219
Onchocerca volvulus	Nuclear receptor subfamily 6 group A member 1 homolog	0.0064	0.0327	0.1523
Brugia malayi	nuclear receptor NHR-67	0.0064	0.0327	0.0327
Schistosoma mansoni	ecdysone-induced protein 78c (dr-78)	0.0072	0.0434	0.0434
Brugia malayi	Nuclear hormone receptor family member nhr-25	0.0136	0.1327	0.1327
Echinococcus multilocularis	hepatocyte nuclear factor 4 alpha	0.0136	0.1327	0.1327
Brugia malayi	Nuclear hormone receptor family member nhr-1	0.0136	0.1327	0.1327
Echinococcus granulosus	acetylcholinesterase	0.076	1	1
Brugia malayi	Ligand-binding domain of nuclear hormone receptor family protein	0.0136	0.1327	0.1327
Loa Loa (eye worm)	hypothetical protein	0.0064	0.0327	0.0327
Echinococcus granulosus	nuclear receptor 2DBD gamma	0.0136	0.1327	0.1327
Echinococcus granulosus	matrix metallopeptidase 7 M10 family	0.005	0.0128	0.0128
Onchocerca volvulus		0.0128	0.1219	0.5678
Brugia malayi	Nuclear hormone receptor E75	0.0064	0.0327	0.0327
Loa Loa (eye worm)	hypothetical protein	0.0064	0.0327	0.0327
Brugia malayi	Blistered cuticle protein 3	0.0195	0.2148	0.2148
Brugia malayi	Nuclear hormone receptor E75	0.0064	0.0327	0.0327
Loa Loa (eye worm)	hypothetical protein	0.0136	0.1327	0.1327
Loa Loa (eye worm)	hypothetical protein	0.0195	0.2148	0.2148
Schistosoma mansoni	acetylcholinesterase	0.0128	0.1219	0.1219
Brugia malayi	nuclear receptor subfamily 1, group D, member 1, putative	0.0064	0.0327	0.0327
Loa Loa (eye worm)	carbonic anhydrase 3	0.0053	0.0165	0.0165
Brugia malayi	steroid hormone receptor	0.0136	0.1327	0.1327
Echinococcus multilocularis	neuroligin	0.0128	0.1219	0.1219
Loa Loa (eye worm)	hypothetical protein	0.0136	0.1327	0.1327
Brugia malayi	ecdysone receptor	0.0064	0.0327	0.0327
Loa Loa (eye worm)	hypothetical protein	0.0195	0.2148	0.2148
Loa Loa (eye worm)	hypothetical protein	0.076	1	1
Brugia malayi	Peroxidasin	0.0195	0.2148	0.2148
Echinococcus multilocularis	nuclear receptor subfamily 4 group A	0.0064	0.0327	0.0327
Mycobacterium tuberculosis	POSSIBLE PARA-NITROBENZYL ESTERASE (FRAGMENT)	0.0128	0.1219	0.5
Schistosoma mansoni	peroxidasin	0.0195	0.2148	0.2148
Onchocerca volvulus	Nuclear receptor subfamily 6 group A member 1 homolog	0.0064	0.0327	0.1523
Loa Loa (eye worm)	nuclear receptor NHR-67	0.0064	0.0327	0.0327
Brugia malayi	Animal haem peroxidase family protein	0.0195	0.2148	0.2148
Loa Loa (eye worm)	hypothetical protein	0.0195	0.2148	0.2148
Brugia malayi	Putative carbonic anhydrase 5 precursor	0.0053	0.0165	0.0165
Trypanosoma cruzi	carbonic anhydrase-like protein, putative	0.0053	0.0165	0.5
Brugia malayi	Nuclear hormone receptor family member nhr-14	0.0136	0.1327	0.1327
Echinococcus multilocularis	ecdysone induced protein 78C	0.0136	0.1327	0.1327
Giardia lamblia	High cysteine protein	0.0041	0	0.5
Echinococcus granulosus	acetylcholinesterase	0.076	1	1
Echinococcus multilocularis	Nuclear hormone receptor HR96	0.0064	0.0327	0.0327
Loa Loa (eye worm)	carboxylesterase	0.0128	0.1219	0.1219
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-40	0.0136	0.1327	0.1327
Schistosoma mansoni	carbonic anhydrase II (carbonate dehydratase II)	0.0053	0.0165	0.0165
Schistosoma mansoni	retinoid-x-receptor (RXR)	0.0136	0.1327	0.1327
Loa Loa (eye worm)	hypothetical protein	0.0195	0.2148	0.2148
Echinococcus multilocularis	nuclear receptor 2DBD gamma	0.0064	0.0327	0.0327
Loa Loa (eye worm)	nuclear receptor nhr-7B	0.0064	0.0327	0.0327
Echinococcus multilocularis	nuclear receptor 2DBD gamma	0.0136	0.1327	0.1327
Loa Loa (eye worm)	hypothetical protein	0.0128	0.1219	0.1219
Leishmania major	carbonic anhydrase-like protein	0.0053	0.0165	0.5
Echinococcus granulosus	nuclear receptor nhr 48	0.0064	0.0327	0.0327
Onchocerca volvulus		0.0195	0.2148	1
Onchocerca volvulus		0.0064	0.0327	0.1523
Schistosoma mansoni	nuclear hormone receptor	0.0064	0.0327	0.0327
Brugia malayi	Nuclear hormone receptor family member nhr-49	0.0136	0.1327	0.1327
Loa Loa (eye worm)	hypothetical protein	0.0136	0.1327	0.1327
Echinococcus granulosus	para nitrobenzyl esterase	0.0128	0.1219	0.1219
Onchocerca volvulus		0.0128	0.1219	0.5678
Loa Loa (eye worm)	hypothetical protein	0.0195	0.2148	0.2148
Loa Loa (eye worm)	animal heme peroxidase	0.0195	0.2148	0.2148
Echinococcus multilocularis	nuclear receptor nhr 48	0.0064	0.0327	0.0327
Schistosoma mansoni	hepatocyte nuclear factor 4-alpha (hnf-4-alpha)	0.0064	0.0327	0.0327
Schistosoma mansoni	photoreceptor-specific nuclear receptor related	0.0136	0.1327	0.1327
Loa Loa (eye worm)	hypothetical protein	0.0136	0.1327	0.1327
Echinococcus granulosus	nuclear receptor 2DBD gamma	0.0136	0.1327	0.1327
Echinococcus multilocularis	para nitrobenzyl esterase	0.0128	0.1219	0.1219
Mycobacterium tuberculosis	Carboxylesterase LipT	0.0128	0.1219	0.5
Echinococcus granulosus	carbonic anhydrase II	0.0053	0.0165	0.0165
Trichomonas vaginalis	carboxylesterase domain containing protein, putative	0.0128	0.1219	0.5
Brugia malayi	conserved hypotetical protein	0.0064	0.0327	0.0327
Brugia malayi	Steroid receptor seven-up type 2	0.0136	0.1327	0.1327
Echinococcus multilocularis	nuclear receptor subfamily 1 group D	0.0072	0.0434	0.0434
Brugia malayi	hypothetical protein	0.0128	0.1219	0.1219
Schistosoma mansoni	nuclear hormone receptor	0.0136	0.1327	0.1327
Loa Loa (eye worm)	hypothetical protein	0.0064	0.0327	0.0327
Brugia malayi	hypothetical protein	0.0195	0.2148	0.2148
Echinococcus granulosus	nuclear receptor subfamily 1 group D	0.0072	0.0434	0.0434
Schistosoma mansoni	RAR-like nuclear receptor	0.0136	0.1327	0.1327
Brugia malayi	Ligand-binding domain of nuclear hormone receptor family protein	0.0136	0.1327	0.1327
Schistosoma mansoni	nuclear receptor	0.0064	0.0327	0.0327
Echinococcus multilocularis	Nuclear hormone receptor HR96	0.0064	0.0327	0.0327
Echinococcus granulosus	peroxidasin	0.0195	0.2148	0.2148
Onchocerca volvulus		0.0064	0.0327	0.1523
Loa Loa (eye worm)	steroid hormone receptor	0.0136	0.1327	0.1327
Schistosoma mansoni	nuclear hormone receptor	0.0064	0.0327	0.0327
Echinococcus multilocularis	FTZ F1 alpha	0.0136	0.1327	0.1327

Activities

Activity type	Activity value	Assay description	Source	Reference
Ki (binding)	= -6.18	Inhibition of [3H]-mibolerone binding to cytosolic androgen receptor of rat ventral prostrate	ChEMBL.	15715462
Log Ki (binding)	= 6.18	Inhibition of [3H]-mibolerone binding to cytosolic androgen receptor of rat ventral prostrate	ChEMBL.	15715462
Relative binding affinity (binding)	= 3.39	Binding affinity against cytosolic androgen receptor from ventral prostate of rats using [3H]-MIB competitive binding assay (relative to dihydro testosterone)	ChEMBL.	15239655
Relative binding affinity (binding)	= 3.39	Binding affinity against cytosolic androgen receptor from ventral prostate of rats using [3H]-MIB competitive binding assay (relative to dihydro testosterone)	ChEMBL.	15239655

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: CHEMBL121962

Bibliographic References

2 literature references were 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 214527