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GLASS

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Go to the GPCR, ligand, or experimental data tables.
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GPCR

Name	Proteinase-activated receptor 2
Species	Homo sapiens (Human)
Gene	F2RL1
Synonym	Protease-activated receptor-2 PAR2 PAR-2 GPR11 G-protein coupled receptor 11 coagulation factor II receptor-like 1 coagulation factor II (thrombin) receptor-like 1 Thrombin receptor-like 1 [ 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

Ligand

Name	CHEMBL238406
Molecular formula	C39H67N11O9
IUPAC name	(2S,3S)-2-[[(2S)-2-[[(2S)-2-[[2-[[(2S,3S)-2-[[(2S)-2-[[(2S)-2-amino-3-hydroxypropanoyl]amino]-4-methylpentanoyl]amino]-3-methylpentanoyl]amino]acetyl]amino]-5-(diaminomethylideneamino)pentanoyl]amino]-4-(4-hydroxyphenyl)butanoyl]amino]-3-methylpentanamide
Molecular weight	834.033
Hydrogen bond acceptor	11
Hydrogen bond donor	12
XlogP	0.0
Synonyms	N/A
Inchi Key	IDQIUUSKJXPWLA-GFWSYSKKSA-N
Inchi ID	InChI=1S/C39H67N11O9/c1-7-22(5)31(33(41)54)49-36(57)28(16-13-24-11-14-25(52)15-12-24)47-35(56)27(10-9-17-44-39(42)43)46-30(53)19-45-38(59)32(23(6)8-2)50-37(58)29(18-21(3)4)48-34(55)26(40)20-51/h11-12,14-15,21-23,26-29,31-32,51-52H,7-10,13,16-20,40H2,1-6H3,(H2,41,54)(H,45,59)(H,46,53)(H,47,56)(H,48,55)(H,49,57)(H,50,58)(H4,42,43,44)/t22-,23-,26-,27-,28-,29-,31-,32-/m0/s1
PubChem CID	44433880
ChEMBL	CHEMBL238406
IUPHAR	N/A
BindingDB	N/A
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand has more than 5 hydrogen bond donor. This ligand has more than 10 hydrogen bond acceptor. This ligand is heavier than 500 daltons.

Experimental Data

Parameter	Value	Reference	Database source
EC50	3000.0 nM	PMID17765542	ChEMBL

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