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GLASS

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Go to the GPCR, ligand, or experimental data tables.
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GPCR

Name	Prostaglandin D2 receptor
Species	Homo sapiens (Human)
Gene	PTGDR
Synonym	PGD2 receptor DP1 DP1 receptor PTGDR1 prostanoid DP receptor-like Prostanoid DP receptor prostaglandin D2 receptor (DP) PGD receptor [ Show all ]
Disease	Pain Dyslipidaemias Rhinitis Thromboembolism Thrombosis Atopic dermatitis Asthma Allergy Allergic rhinitis [ Show all ]
Length	359
Amino acid sequence	MKSPFYRCQNTTSVEKGNSAVMGGVLFSTGLLGNLLALGLLARSGLGWCSRRPLRPLPSVFYMLVCGLTVTDLLGKCLLSPVVLAAYAQNRSLRVLAPALDNSLCQAFAFFMSFFGLSSTLQLLAMALECWLSLGHPFFYRRHITLRLGALVAPVVSAFSLAFCALPFMGFGKFVQYCPGTWCFIQMVHEEGSLSVLGYSVLYSSLMALLVLATVLCNLGAMRNLYAMHRRLQRHPRSCTRDCAEPRADGREASPQPLEELDHLLLLALMTVLFTMCSLPVIYRAYYGAFKDVKEKNRTSEEAEDLRALRFLSVISIVDPWIFIIFRSPVFRIFFHKIFIRPLRYRSRCSNSTNMESSL
UniProt	Q13258
Protein Data Bank	N/A
GPCR-HGmod model	Q13258
3D structure model	This predicted structure model is from GPCR-EXP Q13258.
BioLiP	N/A
Therapeutic Target Database	T68782
ChEMBL	CHEMBL4427
IUPHAR	338
DrugBank	BE0000296

Ligand

Name	CHEMBL3943291
Molecular formula	C22H26ClNO6S
IUPAC name	2-[2-chloro-5-[1-(4-propan-2-yloxyphenyl)sulfonylpiperidin-4-yl]phenoxy]acetic acid
Molecular weight	467.961
Hydrogen bond acceptor	7
Hydrogen bond donor	1
XlogP	4.3
Synonyms	N/A
Inchi Key	BBDLETDDOUTUHC-UHFFFAOYSA-N
Inchi ID	InChI=1S/C22H26ClNO6S/c1-15(2)30-18-4-6-19(7-5-18)31(27,28)24-11-9-16(10-12-24)17-3-8-20(23)21(13-17)29-14-22(25)26/h3-8,13,15-16H,9-12,14H2,1-2H3,(H,25,26)
PubChem CID	134146220
ChEMBL	CHEMBL3943291
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
IC50	160.0 nM	None	ChEMBL
Ki	3600.0 nM	None	ChEMBL

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