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GLASS

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Go to the GPCR, ligand, or experimental data tables.
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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	CHEMBL2391440
Molecular formula	C21H19BrN4O3
IUPAC name	4-[[2-[2-(4-bromoanilino)-2-oxoethyl]-6-methyl-3-oxopyridazin-4-yl]methyl]benzamide
Molecular weight	455.312
Hydrogen bond acceptor	4
Hydrogen bond donor	2
XlogP	2.2
Synonyms	BDBM50435903 SCHEMBL18015868
Inchi Key	IMSKONLMQRQUQO-UHFFFAOYSA-N
Inchi ID	InChI=1S/C21H19BrN4O3/c1-13-10-16(11-14-2-4-15(5-3-14)20(23)28)21(29)26(25-13)12-19(27)24-18-8-6-17(22)7-9-18/h2-10H,11-12H2,1H3,(H2,23,28)(H,24,27)
PubChem CID	71699063
ChEMBL	CHEMBL2391440
IUPHAR	N/A
BindingDB	50435903
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand satisfies Lipinski's rule of five.

Experimental Data

Parameter	Value	Reference	Database source
EC50	29300.0 nM	PMID23685570	ChEMBL
Efficacy	40.0 %	PMID23685570	ChEMBL

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