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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	AC1MVUYC
Molecular formula	C26H30N2O5S
IUPAC name	N-[2-(3,4-dimethoxyphenyl)ethyl]-2-(3-methyl-N-(4-methylphenyl)sulfonylanilino)acetamide
Molecular weight	482.595
Hydrogen bond acceptor	6
Hydrogen bond donor	1
XlogP	4.6
Synonyms	CHEMBL238512 N-[2-(3,4-dimethoxyphenyl)ethyl]-2-(3-methyl-N-(4-methylphenyl)sulfonylanilino)acetamide AKOS000382536 ZINC15229739 MCULE-6687681846 N-[2-(3,4-dimethoxyphenyl)ethyl]-N~2~-(3-methylphenyl)-N~2~-[(4-methylphenyl)sulfonyl]glycinamide MolPort-003-879-491 STL086972 [ Show all ]
Inchi Key	AVKWJVNSLPUXOM-UHFFFAOYSA-N
Inchi ID	InChI=1S/C26H30N2O5S/c1-19-8-11-23(12-9-19)34(30,31)28(22-7-5-6-20(2)16-22)18-26(29)27-15-14-21-10-13-24(32-3)25(17-21)33-4/h5-13,16-17H,14-15,18H2,1-4H3,(H,27,29)
PubChem CID	3689365
ChEMBL	CHEMBL238512
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
Ki	61.66 nM	PMID17236765	ChEMBL

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