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GLASS

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Go to the GPCR, ligand, or experimental data tables.
Go to the experimental data table for text mining information in PubMed ID column.
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GPCR

Name	C5a anaphylatoxin chemotactic receptor 1
Species	Homo sapiens (Human)
Gene	C5AR1
Synonym	complement component 5a receptor 1 complement C5a receptor C5A CD88 C5R1 C5aR1 C5AR C5a1 receptor C5a anaphylatoxin chemotactic receptor C5a-R [ Show all ]
Disease	Vasculitis Atopic dermatitis Inflammatory disease Rheumatoid arthritis
Length	350
Amino acid sequence	MDSFNYTTPDYGHYDDKDTLDLNTPVDKTSNTLRVPDILALVIFAVVFLVGVLGNALVVWVTAFEAKRTINAIWFLNLAVADFLSCLALPILFTSIVQHHHWPFGGAACSILPSLILLNMYASILLLATISADRFLLVFKPIWCQNFRGAGLAWIACAVAWGLALLLTIPSFLYRVVREEYFPPKVLCGVDYSHDKRRERAVAIVRLVLGFLWPLLTLTICYTFILLRTWSRRATRSTKTLKVVVAVVASFFIFWLPYQVTGIMMSFLEPSSPTFLLLKKLDSLCVSFAYINCCINPIIYVVAGQGFQGRLRKSLPSLLRNVLTEESVVRESKSFTRSTVDTMAQKTQAV
UniProt	P21730
Protein Data Bank	6c1r, 6c1q, 5o9h
GPCR-HGmod model	P21730
3D structure model	This structure is from PDB ID 6c1r.
BioLiP	BL0415511, BL0415514, BL0415513, BL0415512, BL0401194,BL0401195,BL0401196,
Therapeutic Target Database	T15439
ChEMBL	CHEMBL2373
IUPHAR	32
DrugBank	N/A

Ligand

Name	CHEMBL173708
Molecular formula	C22H23N3O2
IUPAC name	1-[3-(4-methoxyphenyl)-4-phenylmethoxyphenyl]-2-methylguanidine
Molecular weight	361.445
Hydrogen bond acceptor	3
Hydrogen bond donor	2
XlogP	3.8
Synonyms	BDBM50291459 N-(6-Benzyloxy-4''-methoxy-biphenyl-3-yl)-N''-methyl-guanidine
Inchi Key	BSFIJQQABLASDL-UHFFFAOYSA-N
Inchi ID	InChI=1S/C22H23N3O2/c1-24-22(23)25-18-10-13-21(27-15-16-6-4-3-5-7-16)20(14-18)17-8-11-19(26-2)12-9-17/h3-14H,15H2,1-2H3,(H3,23,24,25)
PubChem CID	44383557
ChEMBL	CHEMBL173708
IUPHAR	N/A
BindingDB	50291459
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	54000.0 nM	, Bioorg. Med. Chem. Lett., (1997) 7:7:907	BindingDB,ChEMBL

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