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Name | Lysophosphatidic acid receptor 1 |
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Species | Homo sapiens (Human) |
Gene | LPAR1 |
Synonym | lysophosphatidic acid receptor Edg-2 Lpar1 LPA1 receptor Lysophosphatidic acid receptor Edg-2 {ECO:0000303|PubMed:9070858} LPA-1 [ Show all ] |
Disease | Idiopathic pulmonary fibrosis |
Length | 364 |
Amino acid sequence | MAAISTSIPVISQPQFTAMNEPQCFYNESIAFFYNRSGKHLATEWNTVSKLVMGLGITVCIFIMLANLLVMVAIYVNRRFHFPIYYLMANLAAADFFAGLAYFYLMFNTGPNTRRLTVSTWLLRQGLIDTSLTASVANLLAIAIERHITVFRMQLHTRMSNRRVVVVIVVIWTMAIVMGAIPSVGWNCICDIENCSNMAPLYSDSYLVFWAIFNLVTFVVMVVLYAHIFGYVRQRTMRMSRHSSGPRRNRDTMMSLLKTVVIVLGAFIICWTPGLVLLLLDVCCPQCDVLAYEKFFLLLAEFNSAMNPIIYSYRDKEMSATFRQILCCQRSENPTGPTEGSDRSASSLNHTILAGVHSNDHSVV |
UniProt | Q92633 |
Protein Data Bank | 4z36, 4z35, 4z34 |
GPCR-HGmod model | Q92633 |
3D structure model | This structure is from PDB ID 4z36. |
BioLiP | BL0315557, BL0315553, BL0315554, BL0315555, BL0315556, BL0315558 |
Therapeutic Target Database | T92640 |
ChEMBL | CHEMBL3819 |
IUPHAR | 272 |
DrugBank | N/A |
Name | CHEMBL3901720 |
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Molecular formula | C24H20F3NO5 |
IUPAC name | 4-[[[4-(2-methoxyphenoxy)benzoyl]-(2,2,2-trifluoroethyl)amino]methyl]benzoic acid |
Molecular weight | 459.421 |
Hydrogen bond acceptor | 8 |
Hydrogen bond donor | 1 |
XlogP | 5.0 |
Synonyms | US9464060, 61 BDBM251725 SCHEMBL16507533 |
Inchi Key | DCOUVLUIDXWAHJ-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C24H20F3NO5/c1-32-20-4-2-3-5-21(20)33-19-12-10-17(11-13-19)22(29)28(15-24(25,26)27)14-16-6-8-18(9-7-16)23(30)31/h2-13H,14-15H2,1H3,(H,30,31) |
PubChem CID | 117903713 |
ChEMBL | CHEMBL3901720 |
IUPHAR | N/A |
BindingDB | 251725 |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand satisfies Lipinski's rule of five. |
Parameter | Value | Reference | Database source |
---|---|---|---|
IC50 | 4.0 nM | , None | BindingDB,ChEMBL |
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