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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.
Go to the GPCR page and check other ligands which interact with it.
Go to the ligand page and check other GPCRs which it interacts with.
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GPCR

Name	Prostaglandin E2 receptor EP4 subtype
Species	Homo sapiens (Human)
Gene	PTGER4
Synonym	Prostanoid EP4 receptor PGE2 receptor EP4 subtype PGE receptor EP4 subtype EP4 receptor EP2
Disease	Ulcerative colitis Glaucoma Inflammatory disease Migraine Osteoarthritis Osteoarthritis; Pain Pain Fracture Asthma Acute heart failure [ Show all ]
Length	488
Amino acid sequence	MSTPGVNSSASLSPDRLNSPVTIPAVMFIFGVVGNLVAIVVLCKSRKEQKETTFYTLVCGLAVTDLLGTLLVSPVTIATYMKGQWPGGQPLCEYSTFILLFFSLSGLSIICAMSVERYLAINHAYFYSHYVDKRLAGLTLFAVYASNVLFCALPNMGLGSSRLQYPDTWCFIDWTTNVTAHAAYSYMYAGFSSFLILATVLCNVLVCGALLRMHRQFMRRTSLGTEQHHAAAAASVASRGHPAASPALPRLSDFRRRRSFRRIAGAEIQMVILLIATSLVVLICSIPLVVRVFVNQLYQPSLEREVSKNPDLQAIRIASVNPILDPWIYILLRKTVLSKAIEKIKCLFCRIGGSRRERSGQHCSDSQRTSSAMSGHSRSFISRELKEISSTSQTLLPDLSLPDLSENGLGGRNLLPGVPGMGLAQEDTTSLRTLRISETSDSSQGQDSESVLLVDEAGGSGRAGPAPKGSSLQVTFPSETLNLSEKCI
UniProt	P35408
Protein Data Bank	5ywy, 5yhl
GPCR-HGmod model	P35408
3D structure model	This structure is from PDB ID 5ywy.
BioLiP	BL0434347, BL0434289
Therapeutic Target Database	T18876
ChEMBL	CHEMBL1836
IUPHAR	343
DrugBank	BE0003522

Ligand

Name	CHEMBL1644015
Molecular formula	C26H32N2O3S
IUPAC name	tert-butyl N-[2-[4-[2-(dimethylcarbamoyl)-5,7-dimethyl-1-benzothiophen-3-yl]phenyl]ethyl]carbamate
Molecular weight	452.613
Hydrogen bond acceptor	4
Hydrogen bond donor	1
XlogP	6.1
Synonyms	tert-butyl 4-(2-(dimethylcarbamoyl)-5,7-dimethylbenzo[b]thiophen-3-yl)phenethylcarbamate BDBM50333736
Inchi Key	ANRAKMNOGBONEK-UHFFFAOYSA-N
Inchi ID	InChI=1S/C26H32N2O3S/c1-16-14-17(2)22-20(15-16)21(23(32-22)24(29)28(6)7)19-10-8-18(9-11-19)12-13-27-25(30)31-26(3,4)5/h8-11,14-15H,12-13H2,1-7H3,(H,27,30)
PubChem CID	53325841
ChEMBL	CHEMBL1644015
IUPHAR	N/A
BindingDB	50333736
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
Ki	29.0 nM	PMID21208803	BindingDB,ChEMBL
Ki	68.0 nM	PMID21208803	BindingDB,ChEMBL
Ki	1991.0 nM	PMID21208803	BindingDB,ChEMBL

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