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Name | Prostaglandin E2 receptor EP4 subtype |
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Species | Rattus norvegicus (Rat) |
Gene | Ptger4 |
Synonym | EP2 EP4 receptor PGE receptor EP4 subtype PGE2 receptor EP4 subtype Prostanoid EP4 receptor |
Disease | N/A for non-human GPCRs |
Length | 488 |
Amino acid sequence | MSIPGVNASFSSTPERLNSPVTIPAVMFIFGVVGNLVAIVVLCKSRKEQKETTFYTLVCGLAVTDLLGTLLVSPVTIATYMKGQWPGDQALCDYSTFILLFFGLSGLSIICAMSIERYLAINHAYFYSHYVDKRLAGLTLFAVYASNVLFCALPNMGLGRSERQYPGTWCFIDWTTNVTAYAAFSYMYAGFSSFLILATVLCNVLVCGALLRMLRQFMRRTSLGTEQHHAAAAAAVASVACRGHAAASPALQRLSDFRRRRSFRRIAGAEIQMVILLIATSLVVLICSIPLVVRVFINQLYQPSVVKDISRNPDLQAIRIASVNPILDPWIYILLRKTVLSKAIEKIKCLFCRIGGSGRDGSAQHCSESRRTSSAMSGHSRSFLSRELREISSTSHTLLYLPDLTESSLGGKNLLPGTHGMGLTQADTTSLRTLRISETSDSSQGQDSESVLLVDEVSGSQREEPASKGNSLQVTFPSETLKLSEKCI |
UniProt | P43114 |
Protein Data Bank | N/A |
GPCR-HGmod model | N/A |
3D structure model | No available structures or models |
BioLiP | N/A |
Therapeutic Target Database | N/A |
ChEMBL | CHEMBL4086 |
IUPHAR | 343 |
DrugBank | N/A |
Name | CHEMBL2036311 |
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Molecular formula | C28H32N2O4S |
IUPAC name | 4-[2-[(2R)-2-[(E,3S)-3-hydroxy-4-[3-(1H-indol-5-yl)phenyl]but-1-enyl]-5-oxopyrrolidin-1-yl]ethylsulfanyl]butanoic acid |
Molecular weight | 492.634 |
Hydrogen bond acceptor | 5 |
Hydrogen bond donor | 3 |
XlogP | 3.7 |
Synonyms | BDBM50385121 SCHEMBL10210685 |
Inchi Key | NUXMYQHRAUGVMF-RSURJUNSSA-N |
Inchi ID | InChI=1S/C28H32N2O4S/c31-25(9-7-24-8-11-27(32)30(24)14-16-35-15-2-5-28(33)34)18-20-3-1-4-21(17-20)22-6-10-26-23(19-22)12-13-29-26/h1,3-4,6-7,9-10,12-13,17,19,24-25,29,31H,2,5,8,11,14-16,18H2,(H,33,34)/b9-7+/t24-,25+/m0/s1 |
PubChem CID | 57893867 |
ChEMBL | CHEMBL2036311 |
IUPHAR | N/A |
BindingDB | 50385121 |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand satisfies Lipinski's rule of five. |
Parameter | Value | Reference | Database source |
---|---|---|---|
EC50 | 85.0 nM | PMID22546206 | BindingDB,ChEMBL |
zhanglabzhanggroup.org | +65-6601-1241 | Computing 1, 13 Computing Drive, Singapore 117417