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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	MLS000554145
Molecular formula	C19H21N3OS
IUPAC name	1-benzyl-1-(5,5-dimethyl-4H-1,3-thiazol-2-yl)-3-phenylurea
Molecular weight	339.457
Hydrogen bond acceptor	3
Hydrogen bond donor	1
XlogP	3.6
Synonyms	STL324634 AKOS022101810 HMS2548P12 1-benzyl-1-(5,5-dimethyl-4,5-dihydro-1,3-thiazol-2-yl)-3-phenylurea MolPort-002-544-943 371781-81-6 ZINC497274 MCULE-2219754280 1-Benzyl-1-(5,5-dimethyl-4,5-dihydro-thiazol-2-yl)-3-phenyl-urea SMR000146462 AC1LIX9S CHEMBL1577289 1-benzyl-1-(5,5-dimethyl-4H-1,3-thiazol-2-yl)-3-phenylurea [ Show all ]
Inchi Key	CFYVRWGQGFBSSD-UHFFFAOYSA-N
Inchi ID	InChI=1S/C19H21N3OS/c1-19(2)14-20-18(24-19)22(13-15-9-5-3-6-10-15)17(23)21-16-11-7-4-8-12-16/h3-12H,13-14H2,1-2H3,(H,21,23)
PubChem CID	912993
ChEMBL	CHEMBL1577289
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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