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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	C-C chemokine receptor type 4
Species	Homo sapiens (Human)
Gene	CCR4
Synonym	K5-5 ChemR13 chemokine (C-C motif) receptor 4 CD194 CCR4 CCR-4 CC-CKR-4 CC CKR4 C-C CKR-4 C-C chemokine receptor 4 [ Show all ]
Disease	Asthma Atopic dermatitis Autoimmune diabetes
Length	360
Amino acid sequence	MNPTDIADTTLDESIYSNYYLYESIPKPCTKEGIKAFGELFLPPLYSLVFVFGLLGNSVVVLVLFKYKRLRSMTDVYLLNLAISDLLFVFSLPFWGYYAADQWVFGLGLCKMISWMYLVGFYSGIFFVMLMSIDRYLAIVHAVFSLRARTLTYGVITSLATWSVAVFASLPGFLFSTCYTERNHTYCKTKYSLNSTTWKVLSSLEINILGLVIPLGIMLFCYSMIIRTLQHCKNEKKNKAVKMIFAVVVLFLGFWTPYNIVLFLETLVELEVLQDCTFERYLDYAIQATETLAFVHCCLNPIIYFFLGEKFRKYILQLFKTCRGLFVLCQYCGLLQIYSADTPSSSYTQSTMDHDLHDAL
UniProt	P51679
Protein Data Bank	N/A
GPCR-HGmod model	P51679
3D structure model	This predicted structure model is from GPCR-EXP P51679.
BioLiP	N/A
Therapeutic Target Database	T06955
ChEMBL	CHEMBL2414
IUPHAR	61
DrugBank	N/A

Ligand

Name	CHEMBL206039
Molecular formula	C16H17N3S
IUPAC name	4-tert-butyl-N-quinolin-8-yl-1,3-thiazol-2-amine
Molecular weight	283.393
Hydrogen bond acceptor	4
Hydrogen bond donor	1
XlogP	4.8
Synonyms	N-(4-tert-butylthiazol-2-yl)quinolin-8-amine BDBM50183108
Inchi Key	ADTVKKGXBYFDCC-UHFFFAOYSA-N
Inchi ID	InChI=1S/C16H17N3S/c1-16(2,3)13-10-20-15(19-13)18-12-8-4-6-11-7-5-9-17-14(11)12/h4-10H,1-3H3,(H,18,19)
PubChem CID	44411497
ChEMBL	CHEMBL206039
IUPHAR	N/A
BindingDB	50183108
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	<25000.0 nM	PMID16497499	BindingDB,ChEMBL

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