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GLASS

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Go to the GPCR, ligand, or experimental data tables.
Go to the experimental data table for text mining information in PubMed ID column.
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GPCR

Name	Proteinase-activated receptor 1
Species	Homo sapiens (Human)
Gene	F2R
Synonym	Coagulation factor II receptor PAR-1 coagulation factor II (thrombin) receptor protease-activated receptor 1 Thrombin receptor PAR1 [ Show all ]
Disease	Thrombosis Restenosis Myocardial infarction Cancer Atherosclerosis Acute coronary syndrome [ Show all ]
Length	425
Amino acid sequence	MGPRRLLLVAACFSLCGPLLSARTRARRPESKATNATLDPRSFLLRNPNDKYEPFWEDEEKNESGLTEYRLVSINKSSPLQKQLPAFISEDASGYLTSSWLTLFVPSVYTGVFVVSLPLNIMAIVVFILKMKVKKPAVVYMLHLATADVLFVSVLPFKISYYFSGSDWQFGSELCRFVTAAFYCNMYASILLMTVISIDRFLAVVYPMQSLSWRTLGRASFTCLAIWALAIAGVVPLLLKEQTIQVPGLNITTCHDVLNETLLEGYYAYYFSAFSAVFFFVPLIISTVCYVSIIRCLSSSAVANRSKKSRALFLSAAVFCIFIICFGPTNVLLIAHYSFLSHTSTTEAAYFAYLLCVCVSSISCCIDPLIYYYASSECQRYVYSILCCKESSDPSSYNSSGQLMASKMDTCSSNLNNSIYKKLLT
UniProt	P25116
Protein Data Bank	3vw7
GPCR-HGmod model	P25116
3D structure model	This structure is from PDB ID 3vw7.
BioLiP	BL0217099
Therapeutic Target Database	T36483
ChEMBL	CHEMBL3974
IUPHAR	347
DrugBank	BE0000928

Ligand

Name	CHEMBL337875
Molecular formula	C30H51N9O5
IUPAC name	(2S)-N-[(2S)-1-[[(2S)-1-amino-5-(diaminomethylideneamino)-1-oxopentan-2-yl]amino]-4-methyl-1-oxopentan-2-yl]-2-[[(2S)-2-[[(2S)-2-aminopropanoyl]amino]-3-phenylpropanoyl]amino]-4-methylpentanamide
Molecular weight	617.796
Hydrogen bond acceptor	7
Hydrogen bond donor	8
XlogP	-0.8
Synonyms	143188-77-6 BDBM50031417 CTK0B5077 (S)-2-[(S)-2-((S)-2-Amino-propionylamino)-3-phenyl-propionylamino]-4-methyl-pentanoic acid [(S)-1-((S)-1-carbamoyl-4-guanidino-butylcarbamoyl)-3-methyl-butyl]-amide L-Argininamide, L-alanyl-L-phenylalanyl-L-leucyl-L-leucyl- AKOS030608741 [ Show all ]
Inchi Key	BFBVBPGZHZLSEB-DUSBTPNUSA-N
Inchi ID	InChI=1S/C30H51N9O5/c1-17(2)14-22(27(42)36-21(25(32)40)12-9-13-35-30(33)34)38-28(43)23(15-18(3)4)39-29(44)24(37-26(41)19(5)31)16-20-10-7-6-8-11-20/h6-8,10-11,17-19,21-24H,9,12-16,31H2,1-5H3,(H2,32,40)(H,36,42)(H,37,41)(H,38,43)(H,39,44)(H4,33,34,35)/t19-,21-,22-,23-,24-/m0/s1
PubChem CID	11758525
ChEMBL	CHEMBL337875
IUPHAR	N/A
BindingDB	50031417
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand has more than 5 hydrogen bond donor. This ligand is heavier than 500 daltons.

Experimental Data

Parameter	Value	Reference	Database source
EC50	800.0 nM	PMID7562949	BindingDB,ChEMBL

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