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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	MLS000123585
Molecular formula	C15H12N4O
IUPAC name	6-benzyl-5-methyl-7-oxo-1H-pyrazolo[1,5-a]pyrimidine-3-carbonitrile
Molecular weight	264.288
Hydrogen bond acceptor	4
Hydrogen bond donor	1
XlogP	1.9
Synonyms	SCHEMBL16077817 ZINC100630210 6-benzyl-7-keto-5-methyl-1H-pyrazolo[1,5-a]pyrimidine-3-carbonitrile CHEMBL1519083 HMS2473A13 SR-01000320103 5-methyl-7-oxo-6-(phenylmethyl)-1H-pyrazolo[1,5-a]pyrimidine-3-carbonitrile AKOS000550265 MolPort-000-823-359 STK584829 6-benzyl-5-methyl-7-oxo-4,7-dihydropyrazolo[1,5-a]pyrimidine-3-carbonitrile BDBM37820 SCHEMBL902395 ZINC5730157 767323-14-8 cid_754780 MCULE-2846074959 SR-01000320103-1 6-benzyl-5-methyl-7-oxo-1H-pyrazolo[1,5-a]pyrimidine-3-carbonitrile AKOS005507990 MolPort-002-001-218 UNM000003580301 6-benzyl-7-hydroxy-5-methylpyrazolo[1,5-a]pyrimidine-3-carbonitrile CCG-114953 EU-0015346 SMR000124167 5-methyl-7-oxidanylidene-6-(phenylmethyl)-1H-pyrazolo[1,5-a]pyrimidine-3-carbonitrile AC1LFJI4 STK186197 6-Benzyl-5-methyl-7-oxo-4,7-dihydro-pyrazolo[1,5-a]pyrimidine-3-carbonitrile BAS 05427581 [ Show all ]
Inchi Key	DGLODFBTANILDO-UHFFFAOYSA-N
Inchi ID	InChI=1S/C15H12N4O/c1-10-13(7-11-5-3-2-4-6-11)15(20)19-14(18-10)12(8-16)9-17-19/h2-6,9,17H,7H2,1H3
PubChem CID	754780
ChEMBL	N/A
IUPHAR	N/A
BindingDB	37820
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	27400.0 nM	N/A	BindingDB
Ki	17900.0 nM	N/A	BindingDB

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