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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	SMR000118449
Molecular formula	C16H32N4O6
IUPAC name	2-[16-(2-amino-2-oxoethyl)-1,4,10,13-tetraoxa-7,16-diazacyclooctadec-7-yl]acetamide
Molecular weight	376.454
Hydrogen bond acceptor	8
Hydrogen bond donor	2
XlogP	-2.6
Synonyms	DTXSID80385226 SR-01000399400-1 72912-00-6 BAS 00104348 MLS000121054 CHEMBL1700567 2-(16-Carbamoylmethyl-1,4,10,13-tetraoxa-7,16-diaza-cyclooctadec-7-yl)-acetamide HMS2339D08 STL326774 AC1MD0O9 CBDivE_001550 MLS002534682 1,4,10,13-Tetraoxa-7,16-diazacyclooctadecane-7,16-diacetamide CTK2G2058 SR-01000399400 2-[16-(2-amino-2-oxoethyl)-1,4,10,13-tetraoxa-7,16-diazacyclooctadec-7-yl]acetamide MCULE-8797843439 ZINC4566320 AKOS000519543 MolPort-001-914-697 2,2'-(1,4,10,13-tetraoxa-7,16-diazacyclooctadecane-7,16-diyl)diacetamide [ Show all ]
Inchi Key	AXUHNKFJBCTBFC-UHFFFAOYSA-N
Inchi ID	InChI=1S/C16H32N4O6/c17-15(21)13-19-1-5-23-9-10-25-7-3-20(14-16(18)22)4-8-26-12-11-24-6-2-19/h1-14H2,(H2,17,21)(H2,18,22)
PubChem CID	2829034
ChEMBL	CHEMBL1700567
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	29092.9 nM	PubChem BioAssay data set	ChEMBL

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