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GPCR

Name	fMet-Leu-Phe receptor
Species	Homo sapiens (Human)
Gene	FPR1
Synonym	NFPR N-formylpeptide chemoattractant receptor N-formyl peptide receptor FPR1 FPR formyl peptide receptor 1 fMLP receptor fMLF-R [ Show all ]
Disease	Inflammatory disease Peptic ulcer
Length	350
Amino acid sequence	METNSSLPTNISGGTPAVSAGYLFLDIITYLVFAVTFVLGVLGNGLVIWVAGFRMTHTVTTISYLNLAVADFCFTSTLPFFMVRKAMGGHWPFGWFLCKFVFTIVDINLFGSVFLIALIALDRCVCVLHPVWTQNHRTVSLAKKVIIGPWVMALLLTLPVIIRVTTVPGKTGTVACTFNFSPWTNDPKERINVAVAMLTVRGIIRFIIGFSAPMSIVAVSYGLIATKIHKQGLIKSSRPLRVLSFVAAAFFLCWSPYQVVALIATVRIRELLQGMYKEIGIAVDVTSALAFFNSCLNPMLYVFMGQDFRERLIHALPASLERALTEDSTQTSDTATNSTLPSAEVELQAK
UniProt	P21462
Protein Data Bank	N/A
GPCR-HGmod model	P21462
3D structure model	This predicted structure model is from GPCR-EXP P21462.
BioLiP	N/A
Therapeutic Target Database	T87831
ChEMBL	CHEMBL3359
IUPHAR	222
DrugBank	BE0000995

Ligand

Name	AC1MEUXL
Molecular formula	C23H26N2O7
IUPAC name	2-(2,4-dimethoxyphenyl)-3-(furan-2-carbonyl)-4-hydroxy-1-(2-morpholin-4-ylethyl)-2H-pyrrol-5-one
Molecular weight	442.468
Hydrogen bond acceptor	8
Hydrogen bond donor	1
XlogP	2.0
Synonyms	5-(2,4-Dimethoxy-phenyl)-4-(furan-2-carbonyl)-3-hydroxy-1-(2-morpholin-4-yl-ethyl)-1,5-dihydro-pyrrol-2-one BAS 03302633 MolPort-000-850-765 UNM000003552001 AB00115204-01 EU-0044130 SCHEMBL6720983 2-(2,4-dimethoxyphenyl)-3-(furan-2-carbonyl)-4-hydroxy-1-(2-morpholin-4-ylethyl)-2H-pyrrol-5-one AKOS000524511 MLS001222489 SR-01000486790-1 378214-42-7 5-(2,4-dimethoxyphenyl)-4-(furan-2-carbonyl)-3-hydroxy-1-[2-(morpholin-4-yl)ethyl]-2,5-dihydro-1H-pyrrol-2-one Cambridge id 6669157 Oprea1_291095 Z57217688 AB00115204-05 HMS2919A10 SMR000611664 2-(2,4-dimethoxyphenyl)-3-(furan-2-carbonyl)-4-hydroxy-1-(2-morpholinoethyl)-2H-pyrrol-5-one AKOS016291087 MolPort-000-426-590 STK702767 5-(2,4-Dimethoxy-phenyl)-4-(furan-2-carbonyl)-3-hydroxy-1-(2-morpholin-4-yl-ethy 5-(2,4-dimethoxyphenyl)-4-(furan-2-ylcarbonyl)-3-hydroxy-1-[2-(morpholin-4-yl)ethyl]-1,5-dihydro-2H-pyrrol-2-one Oprea1_672329 MCULE-8604652990 SR-01000486790 2H-Pyrrol-2-one, 5-(2,4-dimethoxyphenyl)-4-(2-furanylcarbonyl)-1,5-dihydro-3-hydroxy-1-[2-(4-morpholinyl)ethyl]- [ Show all ]
Inchi Key	CLOCOXWERSSZQD-UHFFFAOYSA-N
Inchi ID	InChI=1S/C23H26N2O7/c1-29-15-5-6-16(18(14-15)30-2)20-19(21(26)17-4-3-11-32-17)22(27)23(28)25(20)8-7-24-9-12-31-13-10-24/h3-6,11,14,20,27H,7-10,12-13H2,1-2H3
PubChem CID	2909444
ChEMBL	CHEMBL381077
IUPHAR	N/A
BindingDB	N/A
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand satisfies Lipinski's rule of five.

Experimental Data

Parameter	Value	Reference	Database source
KI_MICROM	6.4 um	PubChem BioAssay data set	ChEMBL

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