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GLASS

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Go to the GPCR, ligand, or experimental data tables.
Go to the experimental data table for text mining information in PubMed ID column.
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GPCR

Name	Thyrotropin-releasing hormone receptor
Species	Homo sapiens (Human)
Gene	TRHR
Synonym	Thyroliberin receptor TRH receptor TRH-R TRH-R1 TRH1 receptor
Disease	Unspecified Pain Neurodegenerative disease Endocrine disease Cognitive disorders CNS stimulant [ Show all ]
Length	398
Amino acid sequence	MENETVSELNQTQLQPRAVVALEYQVVTILLVLIICGLGIVGNIMVVLVVMRTKHMRTPTNCYLVSLAVADLMVLVAAGLPNITDSIYGSWVYGYVGCLCITYLQYLGINASSCSITAFTIERYIAICHPIKAQFLCTFSRAKKIIIFVWAFTSLYCMLWFFLLDLNISTYKDAIVISCGYKISRNYYSPIYLMDFGVFYVVPMILATVLYGFIARILFLNPIPSDPKENSKTWKNDSTHQNTNLNVNTSNRCFNSTVSSRKQVTKMLAVVVILFALLWMPYRTLVVVNSFLSSPFQENWFLLFCRICIYLNSAINPVIYNLMSQKFRAAFRKLCNCKQKPTEKPANYSVALNYSVIKESDHFSTELDDITVTDTYLSATKVSFDDTCLASEVSFSQS
UniProt	P34981
Protein Data Bank	N/A
GPCR-HGmod model	P34981
3D structure model	This predicted structure model is from GPCR-EXP P34981.
BioLiP	N/A
Therapeutic Target Database	T77796
ChEMBL	CHEMBL1810
IUPHAR	363
DrugBank	BE0008659

Ligand

Name	MLS001138759
Molecular formula	C28H30N4O6
IUPAC name	[2-[(6-amino-1-benzyl-2,4-dioxopyrimidin-5-yl)-(2-methylpropyl)amino]-2-oxoethyl] 2-(6-methyl-1-benzofuran-3-yl)acetate
Molecular weight	518.57
Hydrogen bond acceptor	7
Hydrogen bond donor	2
XlogP	3.4
Synonyms	MCULE-8046531926 SMR000710288 CHEMBL1327994 AKOS008019056 ZINC24773098 HMS3022H08 MolPort-005-737-011 [ Show all ]
Inchi Key	IJDXDKGEZKHTMU-UHFFFAOYSA-N
Inchi ID	InChI=1S/C28H30N4O6/c1-17(2)13-31(25-26(29)32(28(36)30-27(25)35)14-19-7-5-4-6-8-19)23(33)16-38-24(34)12-20-15-37-22-11-18(3)9-10-21(20)22/h4-11,15,17H,12-14,16,29H2,1-3H3,(H,30,35,36)
PubChem CID	24980222
ChEMBL	CHEMBL1327994
IUPHAR	N/A
BindingDB	N/A
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand is heavier than 500 daltons.

Experimental Data

Parameter	Value	Reference	Database source
Potency	29092.9 nM	PubChem BioAssay data set	ChEMBL

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