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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.
Go to the GPCR page and check other ligands which interact with it.
Go to the ligand page and check other GPCRs which it interacts with.
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GPCR

Name	C-X-C chemokine receptor type 3
Species	Homo sapiens (Human)
Gene	CXCR3
Synonym	MigR IP-10 receptor Interferon-inducible protein 10 receptor GPR9 G protein-coupled receptor 9 Cxcr3 CXCR-3 CXC-R3 CKR-L2 chemokine (C-X-C motif) receptor 3 CD183 [ Show all ]
Disease	Inflammatory disease Autoimmune diabetes Inflammatory disorder Rheumatoid arthritis Psoriatic disorder
Length	368
Amino acid sequence	MVLEVSDHQVLNDAEVAALLENFSSSYDYGENESDSCCTSPPCPQDFSLNFDRAFLPALYSLLFLLGLLGNGAVAAVLLSRRTALSSTDTFLLHLAVADTLLVLTLPLWAVDAAVQWVFGSGLCKVAGALFNINFYAGALLLACISFDRYLNIVHATQLYRRGPPARVTLTCLAVWGLCLLFALPDFIFLSAHHDERLNATHCQYNFPQVGRTALRVLQLVAGFLLPLLVMAYCYAHILAVLLVSRGQRRLRAMRLVVVVVVAFALCWTPYHLVVLVDILMDLGALARNCGRESRVDVAKSVTSGLGYMHCCLNPLLYAFVGVKFRERMWMLLLRLGCPNQRGLQRQPSSSRRDSSWSETSEASYSGL
UniProt	P49682
Protein Data Bank	N/A
GPCR-HGmod model	P49682
3D structure model	This predicted structure model is from GPCR-EXP P49682.
BioLiP	N/A
Therapeutic Target Database	T25315
ChEMBL	CHEMBL4441
IUPHAR	70
DrugBank	N/A

Ligand

Name	NSC674257
Molecular formula	C17H13ClN2O2
IUPAC name	2-(2-acetylbenzimidazol-1-yl)-1-(4-chlorophenyl)ethanone
Molecular weight	312.753
Hydrogen bond acceptor	3
Hydrogen bond donor	0
XlogP	3.6
Synonyms	2-(2-acetylbenzimidazol-1-yl)-1-(4-chlorophenyl)ethanone NCI60_026323 BDBM50371865 ZINC13214608 CTK8C9631 NSC-674257 2-(2-acetyl-1h-benzimidazol-1-yl)-1-(4-chlorophenyl)ethanone Ethanone, 2-(2-acetyl-1H-benzimidazol-1-yl)-1-(4-chlorophenyl)- AC1L8NHE CHEMBL403905 [ Show all ]
Inchi Key	AABPSESTZLBZAJ-UHFFFAOYSA-N
Inchi ID	InChI=1S/C17H13ClN2O2/c1-11(21)17-19-14-4-2-3-5-15(14)20(17)10-16(22)12-6-8-13(18)9-7-12/h2-9H,10H2,1H3
PubChem CID	384455
ChEMBL	CHEMBL403905
IUPHAR	N/A
BindingDB	50371865
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	8000.0 nM	PMID18242988	BindingDB,ChEMBL

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