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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 E2 receptor EP1 subtype
Species	Homo sapiens (Human)
Gene	PTGER1
Synonym	PGE receptor EP1 subtype EP1 receptor prostaglandin E receptor 1 (subtype EP1), 42kDa Prostanoid EP1 receptor EP1 prostanoid receptor PGE2 receptor EP1 subtype [ Show all ]
Disease	Unspecified Thrombosis Pollakiuria Pain
Length	402
Amino acid sequence	MSPCGPLNLSLAGEATTCAAPWVPNTSAVPPSGASPALPIFSMTLGAVSNLLALALLAQAAGRLRRRRSAATFLLFVASLLATDLAGHVIPGALVLRLYTAGRAPAGGACHFLGGCMVFFGLCPLLLGCGMAVERCVGVTRPLLHAARVSVARARLALAAVAAVALAVALLPLARVGRYELQYPGTWCFIGLGPPGGWRQALLAGLFASLGLVALLAALVCNTLSGLALLRARWRRRSRRPPPASGPDSRRRWGAHGPRSASASSASSIASASTFFGGSRSSGSARRARAHDVEMVGQLVGIMVVSCICWSPMLVLVALAVGGWSSTSLQRPLFLAVRLASWNQILDPWVYILLRQAVLRQLLRLLPPRAGAKGGPAGLGLTPSAWEASSLRSSRHSGLSHF
UniProt	P34995
Protein Data Bank	N/A
GPCR-HGmod model	P34995
3D structure model	This predicted structure model is from GPCR-EXP P34995.
BioLiP	N/A
Therapeutic Target Database	T15497
ChEMBL	CHEMBL1811
IUPHAR	340
DrugBank	BE0000064

Ligand

Name	632621-53-5
Molecular formula	C25H21NO3
IUPAC name	3-[2-methyl-5-(2-phenylmethoxyphenyl)pyrrol-1-yl]benzoic acid
Molecular weight	383.447
Hydrogen bond acceptor	3
Hydrogen bond donor	1
XlogP	5.4
Synonyms	AGAPITQLTSHAJC-UHFFFAOYSA-N 3-{2-[2-(Benzyloxy)phenyl]-5-methyl-1H-pyrrol-1-yl}benzoic acid DTXSID90658791 AKOS030589006 3-[2-(2-Benzyloxy-phenyl)-5-methyl-pyrrol-1-yl]-benzoic acid CHEMBL211776 SCHEMBL5627321 Benzoic acid, 3-[2-methyl-5-[2-(phenylmethoxy)phenyl]-1H-pyrrol-1-yl]- 3-{-[2-(benzyloxy)-phenyl]-5-methyl-pyrrol-1-yl}-benzoic acid CTK1I7614 [ Show all ]
Inchi Key	AGAPITQLTSHAJC-UHFFFAOYSA-N
Inchi ID	InChI=1S/C25H21NO3/c1-18-14-15-23(26(18)21-11-7-10-20(16-21)25(27)28)22-12-5-6-13-24(22)29-17-19-8-3-2-4-9-19/h2-16H,17H2,1H3,(H,27,28)
PubChem CID	44413109
ChEMBL	CHEMBL211776
IUPHAR	N/A
BindingDB	N/A
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand has a partition coefficient log P greater than 5.

Experimental Data

Parameter	Value	Reference	Database source
IC50	19.95 nM	PMID16697196	ChEMBL

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