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Name | Lysophosphatidic acid receptor 3 |
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Species | Homo sapiens (Human) |
Gene | LPAR3 |
Synonym | Lysophosphatidic acid receptor Edg-7 LPA3 receptor LPA-3 LPA receptor 3 endothelial differentiation gene 7, lysophosphatidic acid G-protein-coupled receptor 7 [ Show all ] |
Disease | Fibrosis |
Length | 353 |
Amino acid sequence | MNECHYDKHMDFFYNRSNTDTVDDWTGTKLVIVLCVGTFFCLFIFFSNSLVIAAVIKNRKFHFPFYYLLANLAAADFFAGIAYVFLMFNTGPVSKTLTVNRWFLRQGLLDSSLTASLTNLLVIAVERHMSIMRMRVHSNLTKKRVTLLILLVWAIAIFMGAVPTLGWNCLCNISACSSLAPIYSRSYLVFWTVSNLMAFLIMVVVYLRIYVYVKRKTNVLSPHTSGSISRRRTPMKLMKTVMTVLGAFVVCWTPGLVVLLLDGLNCRQCGVQHVKRWFLLLALLNSVVNPIIYSYKDEDMYGTMKKMICCFSQENPERRPSRIPSTVLSRSDTGSQYIEDSISQGAVCNKSTS |
UniProt | Q9UBY5 |
Protein Data Bank | N/A |
GPCR-HGmod model | Q9UBY5 |
3D structure model | This predicted structure model is from GPCR-EXP Q9UBY5. |
BioLiP | N/A |
Therapeutic Target Database | T95923 |
ChEMBL | CHEMBL3250 |
IUPHAR | 274 |
DrugBank | N/A |
Name | CHEMBL183143 |
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Molecular formula | C35H55N2O7P |
IUPAC name | [(2R)-3-[4-[(4-ethoxypyridin-2-yl)methoxy]phenyl]-2-[[(Z)-octadec-9-enoyl]amino]propyl] dihydrogen phosphate |
Molecular weight | 646.806 |
Hydrogen bond acceptor | 8 |
Hydrogen bond donor | 3 |
XlogP | 8.0 |
Synonyms | BDBM50149996 Phosphoric acid mono-[3-[4-(4-ethoxy-pyridin-2-ylmethoxy)-phenyl]-2-((Z)-(R)-octadec-9-enoylamino)-propyl] ester |
Inchi Key | HVANCKKENVXQOH-KTLPGOAZSA-N |
Inchi ID | InChI=1S/C35H55N2O7P/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-35(38)37-32(29-44-45(39,40)41)26-30-20-22-33(23-21-30)43-28-31-27-34(42-4-2)24-25-36-31/h11-12,20-25,27,32H,3-10,13-19,26,28-29H2,1-2H3,(H,37,38)(H2,39,40,41)/b12-11-/t32-/m1/s1 |
PubChem CID | 44392792 |
ChEMBL | CHEMBL183143 |
IUPHAR | N/A |
BindingDB | 50149996 |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand is heavier than 500 daltons. This ligand has a partition coefficient log P greater than 5. |
Parameter | Value | Reference | Database source |
---|---|---|---|
Ki | 39.0 nM | PMID15225728 | BindingDB,ChEMBL |
zhanglabzhanggroup.org | +65-6601-1241 | Computing 1, 13 Computing Drive, Singapore 117417