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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 | CHEMBL236293 |
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Molecular formula | C43H68N10O7 |
IUPAC name | N-[(2S)-1-[[(2S,3S)-1-[[2-[[(2S)-1-[[(2S)-1-[[(2S,3S)-1-amino-3-methyl-1-oxopentan-2-yl]amino]-4-methyl-1-oxopentan-2-yl]amino]-5-(diaminomethylideneamino)-1-oxopentan-2-yl]amino]-2-oxoethyl]amino]-3-methyl-1-oxopentan-2-yl]amino]-4-methyl-1-oxopentan-2-yl]naphthalene-2-carboxamide |
Molecular weight | 837.08 |
Hydrogen bond acceptor | 8 |
Hydrogen bond donor | 9 |
XlogP | 4.2 |
Synonyms | BDBM50440855 |
Inchi Key | BQCCYUKFUFRCJR-KPGVIOAXSA-N |
Inchi ID | InChI=1S/C43H68N10O7/c1-9-26(7)35(37(44)55)52-40(58)33(21-25(5)6)51-39(57)31(16-13-19-47-43(45)46)49-34(54)23-48-42(60)36(27(8)10-2)53-41(59)32(20-24(3)4)50-38(56)30-18-17-28-14-11-12-15-29(28)22-30/h11-12,14-15,17-18,22,24-27,31-33,35-36H,9-10,13,16,19-21,23H2,1-8H3,(H2,44,55)(H,48,60)(H,49,54)(H,50,56)(H,51,57)(H,52,58)(H,53,59)(H4,45,46,47)/t26-,27-,31-,32-,33-,35-,36-/m0/s1 |
PubChem CID | 44433904 |
ChEMBL | CHEMBL236293 |
IUPHAR | N/A |
BindingDB | 50440855 |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand has more than 5 hydrogen bond donor. This ligand is heavier than 500 daltons. |
Parameter | Value | Reference | Database source |
---|---|---|---|
EC50 | 100.0 nM | PMID23895492 | BindingDB,ChEMBL |
EC50 | 360.0 nM | PMID17765542 | ChEMBL |
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