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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	Cysteinyl leukotriene receptor 2
Species	Homo sapiens (Human)
Gene	CYSLTR2
Synonym	CysLTR2 CysLT2 receptor LTC4 HPN321 hGPCR21 HG57 G-protein coupled receptor HG57 CYSLT2R G-protein coupled receptor GPCR21 [ Show all ]
Disease	Unspecified Asthma
Length	346
Amino acid sequence	MERKFMSLQPSISVSEMEPNGTFSNNNSRNCTIENFKREFFPIVYLIIFFWGVLGNGLSIYVFLQPYKKSTSVNVFMLNLAISDLLFISTLPFRADYYLRGSNWIFGDLACRIMSYSLYVNMYSSIYFLTVLSVVRFLAMVHPFRLLHVTSIRSAWILCGIIWILIMASSIMLLDSGSEQNGSVTSCLELNLYKIAKLQTMNYIALVVGCLLPFFTLSICYLLIIRVLLKVEVPESGLRVSHRKALTTIIITLIIFFLCFLPYHTLRTVHLTTWKVGLCKDRLHKALVITLALAAANACFNPLLYYFAGENFKDRLKSALRKGHPQKAKTKCVFPVSVWLRKETRV
UniProt	Q9NS75
Protein Data Bank	N/A
GPCR-HGmod model	Q9NS75
3D structure model	This predicted structure model is from GPCR-EXP Q9NS75.
BioLiP	N/A
Therapeutic Target Database	T74238
ChEMBL	CHEMBL4330
IUPHAR	270
DrugBank	BE0000099

Ligand

Name	CHEMBL3597528
Molecular formula	C33H35NO5
IUPAC name	4-[1-(carboxymethyl)-2-methyl-7-[(E)-2-[4-(4-phenylbutoxy)phenyl]ethenyl]indol-3-yl]butanoic acid
Molecular weight	525.645
Hydrogen bond acceptor	5
Hydrogen bond donor	2
XlogP	7.1
Synonyms	BDBM50104865 4-(1-Carboxymethyl-2-methyl-7-(4-(4-phenylbutyloxy)styryl)-1H-indole-3-yl)butyric acid
Inchi Key	OSDCTRXECXZIED-KNTRCKAVSA-N
Inchi ID	InChI=1S/C33H35NO5/c1-24-29(13-8-15-31(35)36)30-14-7-12-27(33(30)34(24)23-32(37)38)19-16-26-17-20-28(21-18-26)39-22-6-5-11-25-9-3-2-4-10-25/h2-4,7,9-10,12,14,16-21H,5-6,8,11,13,15,22-23H2,1H3,(H,35,36)(H,37,38)/b19-16+
PubChem CID	122183685
ChEMBL	CHEMBL3597528
IUPHAR	N/A
BindingDB	50104865
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
IC50	4.7 nM	PMID26200813	BindingDB,ChEMBL

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