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GLASS

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Go to the GPCR, ligand, or experimental data tables.
Go to the experimental data table for text mining information in PubMed ID column.
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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	CHEMBL309999
Molecular formula	C29H35NO6S
IUPAC name	(Z)-7-[(1S,2R,3R,4R)-3-[(2-methoxydibenzofuran-3-yl)sulfonylamino]-2-bicyclo[2.2.1]heptanyl]-2,2-dimethylhept-5-enoic acid
Molecular weight	525.66
Hydrogen bond acceptor	7
Hydrogen bond donor	2
XlogP	6.3
Synonyms	7-[3-(2-Methoxy-dibenzofuran-3-sulfonylamino)-bicyclo[2.2.1]hept-2-yl]-2,2-dimethyl-hept-5-enoic acid BDBM50128709
Inchi Key	BRDIMTQGTOLKQZ-OWSPQCILSA-N
Inchi ID	InChI=1S/C29H35NO6S/c1-29(2,28(31)32)14-8-4-5-9-20-18-12-13-19(15-18)27(20)30-37(33,34)26-17-24-22(16-25(26)35-3)21-10-6-7-11-23(21)36-24/h4-7,10-11,16-20,27,30H,8-9,12-15H2,1-3H3,(H,31,32)/b5-4-/t18-,19+,20+,27+/m0/s1
PubChem CID	10951507
ChEMBL	CHEMBL309999
IUPHAR	N/A
BindingDB	50128709
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand is heavier than 500 daltons. This ligand has a partition coefficient log P greater than 5.

Experimental Data

Parameter	Value	Reference	Database source
IC50	57.0 nM	PMID12773047	BindingDB
IC50	57.0 nM	PMID12773047	ChEMBL
IC50	320.0 nM	PMID12773047	BindingDB,ChEMBL

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