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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	Cysteinyl leukotriene receptor 1
Species	Homo sapiens (Human)
Gene	CYSLTR1
Synonym	LTD4 receptor LTD4 leukotriene D4 receptor HMTMF81 HG55 G-protein coupled receptor HG55 CysLT1 receptor Cysteinyl leukotriene D4 receptor CysLTR1 CYSLT1R [ Show all ]
Disease	N/A
Length	337
Amino acid sequence	MDETGNLTVSSATCHDTIDDFRNQVYSTLYSMISVVGFFGNGFVLYVLIKTYHKKSAFQVYMINLAVADLLCVCTLPLRVVYYVHKGIWLFGDFLCRLSTYALYVNLYCSIFFMTAMSFFRCIAIVFPVQNINLVTQKKARFVCVGIWIFVILTSSPFLMAKPQKDEKNNTKCFEPPQDNQTKNHVLVLHYVSLFVGFIIPFVIIIVCYTMIILTLLKKSMKKNLSSHKKAIGMIMVVTAAFLVSFMPYHIQRTIHLHFLHNETKPCDSVLRMQKSVVITLSLAASNCCFDPLLYFFSGGNFRKRLSTFRKHSLSSVTYVPRKKASLPEKGEEICKV
UniProt	Q9Y271
Protein Data Bank	N/A
GPCR-HGmod model	Q9Y271
3D structure model	This predicted structure model is from GPCR-EXP Q9Y271.
BioLiP	N/A
Therapeutic Target Database	N/A
ChEMBL	CHEMBL1798
IUPHAR	269
DrugBank	BE0000705

Ligand

Name	CHEMBL417135
Molecular formula	C25H16N2O5
IUPAC name	4-oxo-2-[4-(quinazolin-2-ylmethoxy)phenyl]chromene-8-carboxylic acid
Molecular weight	424.412
Hydrogen bond acceptor	7
Hydrogen bond donor	1
XlogP	3.8
Synonyms	4-Oxo-2-[4-(quinazolin-2-ylmethoxy)-phenyl]-4H-chromene-8-carboxylic acid 2-[4-[(2-Quinazolinyl)methoxy]phenyl]-4-oxo-4H-1-benzopyran-8-carboxylic acid 4-oxo-2-(4-(quinazolin-2-ylmethoxy)phenyl)-4H-chromene-8-carboxylic acid BDBM50064069 SCHEMBL6177588
Inchi Key	AECCUSOSVDWESX-UHFFFAOYSA-N
Inchi ID	InChI=1S/C25H16N2O5/c28-21-12-22(32-24-18(21)5-3-6-19(24)25(29)30)15-8-10-17(11-9-15)31-14-23-26-13-16-4-1-2-7-20(16)27-23/h1-13H,14H2,(H,29,30)
PubChem CID	10764782
ChEMBL	CHEMBL417135
IUPHAR	N/A
BindingDB	50064069
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	1100.0 nM	PMID20621485	BindingDB,ChEMBL

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