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Name | Proteinase-activated receptor 2 |
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Species | Homo sapiens (Human) |
Gene | F2RL1 |
Synonym | Protease-activated receptor-2 PAR2 PAR-2 GPR11 G-protein coupled receptor 11 [ Show all ] |
Disease | N/A |
Length | 397 |
Amino acid sequence | MRSPSAAWLLGAAILLAASLSCSGTIQGTNRSSKGRSLIGKVDGTSHVTGKGVTVETVFSVDEFSASVLTGKLTTVFLPIVYTIVFVVGLPSNGMALWVFLFRTKKKHPAVIYMANLALADLLSVIWFPLKIAYHIHGNNWIYGEALCNVLIGFFYGNMYCSILFMTCLSVQRYWVIVNPMGHSRKKANIAIGISLAIWLLILLVTIPLYVVKQTIFIPALNITTCHDVLPEQLLVGDMFNYFLSLAIGVFLFPAFLTASAYVLMIRMLRSSAMDENSEKKRKRAIKLIVTVLAMYLICFTPSNLLLVVHYFLIKSQGQSHVYALYIVALCLSTLNSCIDPFVYYFVSHDFRDHAKNALLCRSVRTVKQMQVSLTSKKHSRKSSSYSSSSTTVKTSY |
UniProt | P55085 |
Protein Data Bank | 5ndz, 5ndd |
GPCR-HGmod model | P55085 |
3D structure model | This structure is from PDB ID 5ndz. |
BioLiP | BL0377325, BL0377326 |
Therapeutic Target Database | N/A |
ChEMBL | CHEMBL5963 |
IUPHAR | 348 |
DrugBank | N/A |
Name | CHEMBL3976309 |
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Molecular formula | C33H53N5O5 |
IUPAC name | N-[(2S)-1-[[(2S,3S)-1-[(1S,4aR,8aR)-1-(tert-butylcarbamoyl)-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-2-yl]-3-methyl-1-oxopentan-2-yl]amino]-3-cyclohexyl-1-oxopropan-2-yl]-1,2-oxazole-5-carboxamide |
Molecular weight | 599.817 |
Hydrogen bond acceptor | 6 |
Hydrogen bond donor | 3 |
XlogP | 6.5 |
Synonyms | N/A |
Inchi Key | KASJVGSJSJXIER-ZRDWDXOKSA-N |
Inchi ID | InChI=1S/C33H53N5O5/c1-6-21(2)27(32(42)38-19-17-23-14-10-11-15-24(23)28(38)31(41)37-33(3,4)5)36-29(39)25(20-22-12-8-7-9-13-22)35-30(40)26-16-18-34-43-26/h16,18,21-25,27-28H,6-15,17,19-20H2,1-5H3,(H,35,40)(H,36,39)(H,37,41)/t21-,23+,24+,25-,27-,28-/m0/s1 |
PubChem CID | 134152055 |
ChEMBL | CHEMBL3976309 |
IUPHAR | N/A |
BindingDB | N/A |
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 |
---|---|---|---|
Inhibition | 38.0 % | PMID27994760 | ChEMBL |
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