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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	MLS000779148
Molecular formula	C16H9N3O4S
IUPAC name	(6E)-6-[(6-hydroxy-4-oxochromen-3-yl)methylidene]-5-imino-[1,3]thiazolo[3,2-a]pyrimidin-7-one
Molecular weight	339.325
Hydrogen bond acceptor	6
Hydrogen bond donor	2
XlogP	1.5
Synonyms	CHEMBL1543251 ZINC5442848 3-[(E)-(5-iminio-7-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidin-6(7H)-ylidene)methyl]-4-oxo-4H-chromen-6-olate AC1LZUHQ (6E)-5-azanylidene-6-[(6-oxidanyl-4-oxidanylidene-chromen-3-yl)methylidene]-[1,3]thiazolo[3,2-a]pyrimidin-7-one BDBM54131 SMR000415851 (6E)-6-[(6-hydroxy-4-oxochromen-3-yl)methylidene]-5-imino-[1,3]thiazolo[3,2-a]pyrimidin-7-one 6-[1-(6-Hydroxy-4-oxo-4H-chromen-3-yl)-meth-(E)-ylidene]-5-imino-5,6-dihydro-thiazolo[3,2-a]pyrimidin -7-one cid_1958984 AKOS005503936 MolPort-000-790-584 (6E)-6-[(6-hydroxy-4-keto-chromen-3-yl)methylene]-5-imino-thiazolo[3,2-a]pyrimidin-7-one STK580059 (E)-6-((6-hydroxy-4-oxo-4H-chromen-3-yl)methylene)-5-imino-5H-thiazolo[3,2-a]pyrimidin-7(6H)-one 899385-36-5 HMS2754P13 AKOS032395549 MolPort-002-645-207 (6E)-6-[(6-hydroxy-4-oxo-1-benzopyran-3-yl)methylidene]-5-imino-7-thiazolo[3,2-a]pyrimidinone [ Show all ]
Inchi Key	FNEJQEBATASNNC-UTVFFRKMSA-N
Inchi ID	InChI=1S/C16H9N3O4S/c17-14-11(15(22)18-16-19(14)3-4-24-16)5-8-7-23-12-2-1-9(20)6-10(12)13(8)21/h1-7,17,20H/b11-5+,17-14?
PubChem CID	1958984
ChEMBL	CHEMBL1543251
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	9200.0 nM	PubChem BioAssay data set	ChEMBL

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