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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	CHEMBL312707
Molecular formula	C27H31NO7S
IUPAC name	7-[(1S,2R,3R,4R)-3-[(2-methoxydibenzofuran-3-yl)sulfonylamino]-2-bicyclo[2.2.1]heptanyl]-6-oxoheptanoic acid
Molecular weight	513.605
Hydrogen bond acceptor	8
Hydrogen bond donor	2
XlogP	4.0
Synonyms	7-[3-(2-Methoxy-dibenzofuran-3-sulfonylamino)-bicyclo[2.2.1]hept-2-yl]-6-oxo-heptanoic acid BDBM50128731
Inchi Key	AGEJSDATIXGYNN-VTKXYJJGSA-N
Inchi ID	InChI=1S/C27H31NO7S/c1-34-24-14-21-19-7-3-4-8-22(19)35-23(21)15-25(24)36(32,33)28-27-17-11-10-16(12-17)20(27)13-18(29)6-2-5-9-26(30)31/h3-4,7-8,14-17,20,27-28H,2,5-6,9-13H2,1H3,(H,30,31)/t16-,17+,20+,27+/m0/s1
PubChem CID	10874929
ChEMBL	CHEMBL312707
IUPHAR	N/A
BindingDB	50128731
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand is heavier than 500 daltons.

Experimental Data

Parameter	Value	Reference	Database source
IC50	33.0 nM	PMID12773047	BindingDB,ChEMBL
IC50	960.0 nM	PMID12773047	BindingDB,ChEMBL

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