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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	SMR000055040
Molecular formula	C19H16O6
IUPAC name	methyl 2-(2-methyl-4-oxo-3-phenoxychromen-7-yl)oxyacetate
Molecular weight	340.331
Hydrogen bond acceptor	6
Hydrogen bond donor	0
XlogP	3.5
Synonyms	cid_722777 MLS000105111 AC1LF4AW BAS 00480354 MCULE-2751705320 Oprea1_803247 (2-Methyl-4-oxo-3-phenoxy-4H-chromen-7-yloxy)-acetic acid methyl ester methyl 2-[(2-methyl-4-oxo-3-phenoxy-4H-chromen-7-yl)oxy]acetate ZINC127102 303798-43-8 AC1Q4499 EiM07-28797 MolPort-000-653-862 BDBM37802 methyl 2-(2-methyl-4-oxidanylidene-3-phenoxy-chromen-7-yl)oxyethanoate 2-(4-keto-2-methyl-3-phenoxy-chromen-7-yl)oxyacetic acid methyl ester CHEMBL1311143 methyl [(2-methyl-4-oxo-3-phenoxy-4H-chromen-7-yl)oxy]acetate AKOS000574473 HMS2371C20 Oprea1_295637 BRD-K49621849-001-07-1 methyl 2-(2-methyl-4-oxo-3-phenoxychromen-7-yl)oxyacetate STK921449 2-[(2-methyl-4-oxo-3-phenoxy-1-benzopyran-7-yl)oxy]acetic acid methyl ester [ Show all ]
Inchi Key	AKNHFZVXJDNNJF-UHFFFAOYSA-N
Inchi ID	InChI=1S/C19H16O6/c1-12-19(25-13-6-4-3-5-7-13)18(21)15-9-8-14(10-16(15)24-12)23-11-17(20)22-2/h3-10H,11H2,1-2H3
PubChem CID	722777
ChEMBL	CHEMBL1311143
IUPHAR	N/A
BindingDB	37802
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand satisfies Lipinski's rule of five.

Experimental Data

Parameter	Value	Reference	Database source
IC50	<66700.0 nM	N/A	BindingDB
Ki	<43700.0 nM	N/A	BindingDB
Ki	<66700.0 nM	PubChem BioAssay data set	ChEMBL

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