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GLASS

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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	CHEMBL1916087
Molecular formula	C26H26N4O3S
IUPAC name	N-[(2,4-dimethylphenyl)methyl]-5-[(4-methylphenyl)sulfonylamino]-1-phenylpyrazole-4-carboxamide
Molecular weight	474.579
Hydrogen bond acceptor	5
Hydrogen bond donor	2
XlogP	5.2
Synonyms	BDBM50419360
Inchi Key	DJFADAJUGGIVQF-UHFFFAOYSA-N
Inchi ID	InChI=1S/C26H26N4O3S/c1-18-10-13-23(14-11-18)34(32,33)29-25-24(17-28-30(25)22-7-5-4-6-8-22)26(31)27-16-21-12-9-19(2)15-20(21)3/h4-15,17,29H,16H2,1-3H3,(H,27,31)
PubChem CID	57399797
ChEMBL	CHEMBL1916087
IUPHAR	N/A
BindingDB	50419360
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand has a partition coefficient log P greater than 5.

Experimental Data

Parameter	Value	Reference	Database source
IC50	794.0 nM	PMID21955939	BindingDB
IC50	794.33 nM	PMID21955939	ChEMBL

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