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GLASS

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Go to the GPCR, ligand, or experimental data tables.
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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	BDBM50290481
Molecular formula	C30H44N6O3
IUPAC name	2-[4-[3-[(2R)-3-cyclohexyl-1-oxo-1-spiro[1,2-dihydroindene-3,4'-piperidine]-1'-ylpropan-2-yl]-4-hydroxy-2-oxo-1H-imidazol-5-yl]butyl]guanidine
Molecular weight	536.721
Hydrogen bond acceptor	4
Hydrogen bond donor	4
XlogP	4.1
Synonyms	5-[4-amino(imino)methylaminobutyl]-3-[1-cyclohexylmethyl-2-oxo-2-spiro[2,3-dihydro-1H-indene-1,4''-(hexahydropyridine)]-1-yl-(1R)-ethyl]-(5R)-tetrahydro-1H-2,4-imidazoledione
Inchi Key	ANHCIXWBJNUVMD-RUZDIDTESA-N
Inchi ID	InChI=1S/C30H44N6O3/c31-28(32)33-17-7-6-12-24-26(37)36(29(39)34-24)25(20-21-8-2-1-3-9-21)27(38)35-18-15-30(16-19-35)14-13-22-10-4-5-11-23(22)30/h4-5,10-11,21,25,37H,1-3,6-9,12-20H2,(H,34,39)(H4,31,32,33)/t25-/m1/s1
PubChem CID	91934578
ChEMBL	N/A
IUPHAR	N/A
BindingDB	50290481
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand is heavier than 500 daltons.

Experimental Data

Parameter	Value	Reference	Database source
IC50	300.0 nM	N/A	BindingDB

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