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GLASS

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Go to the GPCR, ligand, or experimental data tables.
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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	MLS001173005
Molecular formula	C18H16N2O3
IUPAC name	3-[(E)-2-(2,5-dimethoxyphenyl)ethenyl]-1H-quinoxalin-2-one
Molecular weight	308.337
Hydrogen bond acceptor	4
Hydrogen bond donor	1
XlogP	2.7
Synonyms	BDBM83255 3-[(E)-2-(2,5-dimethoxyphenyl)ethenyl]-1H-quinoxalin-2-one cid_8853414 AC1PFA4Q NCGC00274744-01 3-[(E)-2-(2,5-dimethoxyphenyl)vinyl]-1H-quinoxalin-2-one HMS2898P17 AKOS001209856 SMR000592370 CHEMBL1523192 AB01278726-01 [ Show all ]
Inchi Key	FGGFVLUSYKVYFC-VQHVLOKHSA-N
Inchi ID	InChI=1S/C18H16N2O3/c1-22-13-8-10-17(23-2)12(11-13)7-9-16-18(21)20-15-6-4-3-5-14(15)19-16/h3-11H,1-2H3,(H,20,21)/b9-7+
PubChem CID	8853414
ChEMBL	CHEMBL1523192
IUPHAR	N/A
BindingDB	N/A
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand satisfies Lipinski's rule of five.

Experimental Data

Parameter	Value	Reference	Database source
Potency	18356.4 nM	PubChem BioAssay data set	ChEMBL

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