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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 | CHEMBL2182044 |
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Molecular formula | C28H25FN4O4 |
IUPAC name | 1-[4-[3-fluoro-4-[1-methyl-5-[[(1R)-1-phenylethoxy]carbonylamino]triazol-4-yl]phenyl]phenyl]cyclopropane-1-carboxylic acid |
Molecular weight | 500.53 |
Hydrogen bond acceptor | 7 |
Hydrogen bond donor | 2 |
XlogP | 4.7 |
Synonyms | BDBM50398094 IPBJLADFKWCTMI-QGZVFWFLSA-N 1-{3'-Fluoro-4'-[1-methyl-5-((R)-1-phenyl-ethoxycarbonylamino)-1H-[1,2,3]triazole-4-yl]-biphenyl-4-yl}-cyclopropanecarboxylic acid SCHEMBL16700608 |
Inchi Key | IPBJLADFKWCTMI-QGZVFWFLSA-N |
Inchi ID | InChI=1S/C28H25FN4O4/c1-17(18-6-4-3-5-7-18)37-27(36)30-25-24(31-32-33(25)2)22-13-10-20(16-23(22)29)19-8-11-21(12-9-19)28(14-15-28)26(34)35/h3-13,16-17H,14-15H2,1-2H3,(H,30,36)(H,34,35)/t17-/m1/s1 |
PubChem CID | 71455703 |
ChEMBL | CHEMBL2182044 |
IUPHAR | N/A |
BindingDB | 50398094 |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand is heavier than 500 daltons. |
Parameter | Value | Reference | Database source |
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IC50 | 27350.0 nM | , PMID22894757, None | BindingDB,ChEMBL |
zhanglabzhanggroup.org | +65-6601-1241 | Computing 1, 13 Computing Drive, Singapore 117417