You can:
Name | Lysophosphatidic acid receptor 1 |
---|---|
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 | CHEMBL3401385 |
---|---|
Molecular formula | C31H36FN3O5 |
IUPAC name | N-[3-(2-carbamoylphenoxy)-5-(4-fluorophenoxy)phenyl]-4-(2-ethylbutyl)-4-hydroxypiperidine-1-carboxamide |
Molecular weight | 549.643 |
Hydrogen bond acceptor | 6 |
Hydrogen bond donor | 3 |
XlogP | 5.6 |
Synonyms | BDBM50065613 SCHEMBL15910997 |
Inchi Key | OOEWZQSZRIHFOW-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C31H36FN3O5/c1-3-21(4-2)20-31(38)13-15-35(16-14-31)30(37)34-23-17-25(39-24-11-9-22(32)10-12-24)19-26(18-23)40-28-8-6-5-7-27(28)29(33)36/h5-12,17-19,21,38H,3-4,13-16,20H2,1-2H3,(H2,33,36)(H,34,37) |
PubChem CID | 90309100 |
ChEMBL | CHEMBL3401385 |
IUPHAR | N/A |
BindingDB | 50065613 |
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 |
---|---|---|---|
IC50 | <800.0 nM | PMID25746814 | BindingDB,ChEMBL |
zhanglabzhanggroup.org | (734) 647-1549 | 100 Washtenaw Avenue, Ann Arbor, MI 48109-2218