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Name | Sphingosine 1-phosphate receptor 4 |
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Species | Homo sapiens (Human) |
Gene | S1PR4 |
Synonym | S1P4 receptor S1P4 S1P receptor Edg-6 S1P receptor 4 endothelial differentiation, G protein-coupled receptor 6 [ Show all ] |
Disease | N/A |
Length | 384 |
Amino acid sequence | MNATGTPVAPESCQQLAAGGHSRLIVLHYNHSGRLAGRGGPEDGGLGALRGLSVAASCLVVLENLLVLAAITSHMRSRRWVYYCLVNITLSDLLTGAAYLANVLLSGARTFRLAPAQWFLREGLLFTALAASTFSLLFTAGERFATMVRPVAESGATKTSRVYGFIGLCWLLAALLGMLPLLGWNCLCAFDRCSSLLPLYSKRYILFCLVIFAGVLATIMGLYGAIFRLVQASGQKAPRPAARRKARRLLKTVLMILLAFLVCWGPLFGLLLADVFGSNLWAQEYLRGMDWILALAVLNSAVNPIIYSFRSREVCRAVLSFLCCGCLRLGMRGPGDCLARAVEAHSGASTTDSSLRPRDSFRGSRSLSFRMREPLSSISSVRSI |
UniProt | O95977 |
Protein Data Bank | N/A |
GPCR-HGmod model | O95977 |
3D structure model | This predicted structure model is from GPCR-EXP O95977. |
BioLiP | N/A |
Therapeutic Target Database | N/A |
ChEMBL | CHEMBL3230 |
IUPHAR | 278 |
DrugBank | N/A |
Name | CHEMBL2048293 |
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Molecular formula | C23H15F3N4O4 |
IUPAC name | 2-[6-[5-[3-cyano-5-(trifluoromethoxy)phenyl]-1,2,4-oxadiazol-3-yl]-2,3-dihydro-1H-pyrrolo[1,2-a]indol-3-yl]acetic acid |
Molecular weight | 468.392 |
Hydrogen bond acceptor | 10 |
Hydrogen bond donor | 1 |
XlogP | 4.1 |
Synonyms | BDBM50386859 HHVPFOZVFPAJBT-UHFFFAOYSA-N 2-(7-(5-(3-Cyano-5-(trifluoromethoxy)phenyl)-1,2,4-oxadiazol-3-yl)-2,3-dihydro-1H-pyrrolo[1,2-a]indol-1-yl)acetic Acid SCHEMBL949280 |
Inchi Key | HHVPFOZVFPAJBT-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C23H15F3N4O4/c24-23(25,26)33-17-6-12(11-27)5-16(8-17)22-28-21(29-34-22)14-1-2-18-15(7-14)9-19-13(10-20(31)32)3-4-30(18)19/h1-2,5-9,13H,3-4,10H2,(H,31,32) |
PubChem CID | 44138103 |
ChEMBL | CHEMBL2048293 |
IUPHAR | N/A |
BindingDB | 50386859 |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand satisfies Lipinski's rule of five. |
Parameter | Value | Reference | Database source |
---|---|---|---|
EC50 | <100000.0 nM | PMID22633692 | BindingDB,ChEMBL |
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