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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-X-C chemokine receptor type 2
Species	Homo sapiens (Human)
Gene	CXCR2
Synonym	chemokine (C-X-C motif) receptor 2 KC receptor CD128 IL8RB IL-8R2 IL-8R B IL-8 receptor type 2 High affinity interleukin-8 receptor B GRO/MGSA receptor Gpcr16 CD182 CDw128b CXCR2 CXCR-2 CXC-R2 [ Show all ]
Disease	Cystic fibrosis; Chronic obstructive pulmonary disease Asthma Cancer Ischemia-reperfusion injury; Lung transplantation; Graft rejection in heart transplantation Fungal infections Chronic obstructive pulmonary disease [ Show all ]
Length	360
Amino acid sequence	MEDFNMESDSFEDFWKGEDLSNYSYSSTLPPFLLDAAPCEPESLEINKYFVVIIYALVFLLSLLGNSLVMLVILYSRVGRSVTDVYLLNLALADLLFALTLPIWAASKVNGWIFGTFLCKVVSLLKEVNFYSGILLLACISVDRYLAIVHATRTLTQKRYLVKFICLSIWGLSLLLALPVLLFRRTVYSSNVSPACYEDMGNNTANWRMLLRILPQSFGFIVPLLIMLFCYGFTLRTLFKAHMGQKHRAMRVIFAVVLIFLLCWLPYNLVLLADTLMRTQVIQETCERRNHIDRALDATEILGILHSCLNPLIYAFIGQKFRHGLLKILAIHGLISKDSLPKDSRPSFVGSSSGHTSTTL
UniProt	P25025
Protein Data Bank	N/A
GPCR-HGmod model	P25025
3D structure model	This predicted structure model is from GPCR-EXP P25025.
BioLiP	N/A
Therapeutic Target Database	T56923
ChEMBL	CHEMBL2434
IUPHAR	69
DrugBank	N/A

Ligand

Name	CHEMBL3354830
Molecular formula	C18H19ClN4O4S
IUPAC name	2-(4-chloro-2-hydroxy-3-propan-2-ylsulfonylanilino)-4-(1-methylpyrrol-2-yl)-1H-pyrimidin-6-one
Molecular weight	422.884
Hydrogen bond acceptor	5
Hydrogen bond donor	3
XlogP	1.9
Synonyms	BDBM50036788
Inchi Key	BXTAEAOBDRNKGO-UHFFFAOYSA-N
Inchi ID	InChI=1S/C18H19ClN4O4S/c1-10(2)28(26,27)17-11(19)6-7-12(16(17)25)20-18-21-13(9-15(24)22-18)14-5-4-8-23(14)3/h4-10,25H,1-3H3,(H2,20,21,22,24)
PubChem CID	136087075
ChEMBL	CHEMBL3354830
IUPHAR	N/A
BindingDB	50036788
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	2511.89 nM	PMID25455491	ChEMBL
IC50	2512.0 nM	PMID25455491	BindingDB

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