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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	CHEMBL186735
Molecular formula	C26H23NO5
IUPAC name	2-[2-methyl-1-[4-(2-phenoxyethoxy)benzoyl]indol-4-yl]acetic acid
Molecular weight	429.472
Hydrogen bond acceptor	5
Hydrogen bond donor	1
XlogP	5.0
Synonyms	{2-Methyl-1-[4-(2-phenoxy-ethoxy)-benzoyl]-1H-indol-4-yl}-acetic acid BDBM50152506 SCHEMBL5853243
Inchi Key	BCXKWNRNWURDCY-UHFFFAOYSA-N
Inchi ID	InChI=1S/C26H23NO5/c1-18-16-23-20(17-25(28)29)6-5-9-24(23)27(18)26(30)19-10-12-22(13-11-19)32-15-14-31-21-7-3-2-4-8-21/h2-13,16H,14-15,17H2,1H3,(H,28,29)
PubChem CID	21974448
ChEMBL	CHEMBL186735
IUPHAR	N/A
BindingDB	50152506
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	250.0 nM	PMID15341946	BindingDB,ChEMBL
Ki	290.0 nM	PMID15341946	BindingDB,ChEMBL

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