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GLASS

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Go to the GPCR, ligand, or experimental data tables.
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GPCR

Name	Cysteinyl leukotriene receptor 1
Species	Mus musculus (Mouse)
Gene	Cysltr1
Synonym	CYSLT1R CysLTR1 Cysteinyl leukotriene D4 receptor CysLT1 receptor HG55 leukotriene D4 receptor LTD4 LTD4 receptor [ Show all ]
Disease	N/A for non-human GPCRs
Length	352
Amino acid sequence	MYLQGTKQTFLENMNGTENLTTSLINNTCHDTIDEFRNQVYSTMYSVISVVGFFGNSFVLYVLIKTYHEKSAFQVYMINLAIADLLCVCTLPLRVVYYVHKGKWLFGDFLCRLTTYALYVNLYCSIFFMTAMSFFRCVAIVFPVQNINLVTQKKARFVCIGIWIFVILTSSPFLMYKSYQDEKNNTKCFEPPQNNQAKKYVLILHYVSLFFGFIIPFVTIIVCYTMIILTLLKNTMKKNMPSRRKAIGMIIVVTAAFLVSFMPYHIQRTIHLHLLHSETRPCDSVLRMQKSVVITLSLAASNCCFDPLLYFFSGGNFRRRLSTFRKHSLSSMTYVPKKKASLPEKGEEICNE
UniProt	Q99JA4
Protein Data Bank	N/A
GPCR-HGmod model	N/A
3D structure model	No available structures or models
BioLiP	N/A
Therapeutic Target Database	N/A
ChEMBL	CHEMBL3808269
IUPHAR	N/A
DrugBank	N/A

Ligand

Name	CHEMBL3808623
Molecular formula	C30H19Cl3N2O4
IUPAC name	4,6-dichloro-3-[(E)-3-[[3-[(E)-2-(7-chloroquinolin-2-yl)ethenyl]phenyl]methoxy]-3-oxoprop-1-enyl]-1H-indole-2-carboxylic acid
Molecular weight	577.842
Hydrogen bond acceptor	5
Hydrogen bond donor	2
XlogP	8.1
Synonyms	BDBM50172333
Inchi Key	UCASXYXKIOSALC-IBYINHFXSA-N
Inchi ID	InChI=1S/C30H19Cl3N2O4/c31-20-7-5-19-6-9-22(34-25(19)14-20)8-4-17-2-1-3-18(12-17)16-39-27(36)11-10-23-28-24(33)13-21(32)15-26(28)35-29(23)30(37)38/h1-15,35H,16H2,(H,37,38)/b8-4+,11-10+
PubChem CID	127043252
ChEMBL	CHEMBL3808623
IUPHAR	N/A
BindingDB	50172333
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand is heavier than 500 daltons. This ligand has a partition coefficient log P greater than 5.

Experimental Data

Parameter	Value	Reference	Database source
Inhibition	50.0 %	PMID26985325	ChEMBL

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