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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	Cavia porcellus (Guinea pig)
Gene	CYSLTR1
Synonym	CysLTR1 Cysteinyl leukotriene D4 receptor LTD4 receptor
Disease	N/A for non-human GPCRs
Length	340
Amino acid sequence	MDETGNPTIPPASNNTCYDSIDDFRNQVYSTLYSMISVVGFFGNGFVLYVLVKTYHEKSAFQVYMINLAVADLLCVCTLPLRVAYYVHKGIWLFGDFLCRLSTYALYVNLYCSIFFMTAMSFFRCVAIVFPVQNISLVTQKKARLVCIAIWMFVILTSSPFLMANTYKDEKNNTKCFEPPQDNQAKNYVLILHYVSLFIGFIIPFITIIVCYTMIIFTLLKSSMKKNLSSRKRAIGMIIVVTAAFLVSFMPYHIQRTIHLHFLHNKTKPCDSILRMQKSVVITLSLAASNCCFDPLLYFFSGGNFRRRLSTIRKYSLSSMTYIPKKKTSLPQKGKDICKE
UniProt	Q2NNR5
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	CHEMBL5645
IUPHAR	N/A
DrugBank	N/A

Ligand

Name	Pranlukast
Molecular formula	C27H23N5O4
IUPAC name	N-[4-oxo-2-(2H-tetrazol-5-yl)chromen-8-yl]-4-(4-phenylbutoxy)benzamide
Molecular weight	481.512
Hydrogen bond acceptor	7
Hydrogen bond donor	2
XlogP	4.2
Synonyms	SMR004701229 AC1L1J6B ZINC1542146 BC220515 CHEBI:94810 DB01411 HMS2089H16 LS-194966 N-[4-Oxo-2-(1H-tetrazol-5-yl)-4H-1-benzopyran-8-yl]-P-(4-phenylbutoxy)benzamide;N-[4-Oxo-2-(1H-tetrazol-5-yl)-4H-1-benzopyran-8-yl]-P-(4-phenylbutoxy)benzamide NCGC00181765-01 Pranlukast (INN) 4-Oxo-8-(4-(4-phenylbutoxy)benzoylamino)-2-(tetrazol-5-yl)-4H-1-benzopyran 8-[4(4-phenylbutoxy)benzoyl]amino-2-(5-tetrazolyl)-4-oxo-4H-1-benzopyran;8-[4(4-phenylbutoxy)benzoyl]amino-2-(5-tetrazolyl)-4-oxo-4H-1-benzopyran SR-05000001474-2 AN-15615 BRD-K97045029-001-01-9 CS-2304 DSSTox_RID_80074 HY-B0290 MolPort-003-849-959 N-[4-Oxo-2-(1H-tetrazol-5-yl)-4H-chromen-8-yl]-4-(4-phenyl-butoxy)-benzamide(ONO-RS-411) Ono-1078 103177-37-3 SB-205312 SCHEMBL18058592 AB2000316 Tox21_112952 Azlaire CCG-220661 D08QIP GP8160 L013134 N-(4-oxo-2-(2H-tetrazol-5-yl)-4H-chromen-8-yl)-4-(4-phenylbutoxy)benzamide N-[4-oxo-2-(2H-tetrazol-5-yl)chromen-8-yl]-4-(4-phenylbutoxy)benzamide P2115 177P373 SR-05000001474 AK481332 BCP04577 DSSTox_CID_23782 HMS3650A14 MFCD24539454 N-[4-Oxo-2-(1H-tetrazol-5-yl)-4H-chromen-8-yl]-4-(4-phenyl-butoxy)-benzamide O046 pranlukast hydrate 8-[4-(4-phenylbutyloxy)benzoyl]amino-2-(tetrazol-5-yl)-4-oxo-4H-1-benzopyran SR-05000001474-3 API0009100 BRD-K97045029-001-04-3 CTK7F7297 DTXSID3043782 K-0349 MolPort-035-394-920 N-[4-Oxo-2-(1H-tetrazol-5-yl)-4H-chromen-8-yl]-4-(4-phenylbutoxy)benzamide Ono-RS-411 103177-37-3 (anhyd.) SB19080 SCHEMBL3693 AC-696 UNII-TB8Z891092 Azlaire (TN) CCN 00401 GTPL3634 LS-194954 N-[4-Oxo-2-(1H-tetrazol-5-yl)-4H-1-benzopyran-8-yl]-4(4-phenylbutoxy)benzamide NBQKINXMPLXUET-UHFFFAOYSA-N 8-[4(4-phenylbutoxy)benzoyl]amino-2-(5-tetrazolyl)-4-oxo-4H-1-benzopyran SR-05000001474-1 AKOS015967342 BDBM50023198 CHEMBL21333 DSSTox_GSID_43782 HMS3714E03 MLS006010078 N-[4-Oxo-2-(1H-tetrazol-5-yl)-4H-chromen-8-yl]-4-(4-phenyl-butoxy)-benzamide (ONO-RS-411) ONO RS-411 Pranlukast [INN:BAN] SC-15917 AB01275471-01 TB8Z891092 AS-15105 CAS-103177-37-3 D08408 FT-0652673 KS-00000YQJ N-(4-OXO-2-(1H-TETRAZOL-5-YL)-4H-CHROMEN-8-YL)-4-(4-PHENYLBUTOXY)BENZAMIDE N-[4-oxo-2-(2H-tetrazol-5-yl)-1-benzopyran-8-yl]-4-(4-phenylbutoxy)benzamide Onon 150821-03-7 [ Show all ]
Inchi Key	NBQKINXMPLXUET-UHFFFAOYSA-N
Inchi ID	InChI=1S/C27H23N5O4/c33-23-17-24(26-29-31-32-30-26)36-25-21(23)10-6-11-22(25)28-27(34)19-12-14-20(15-13-19)35-16-5-4-9-18-7-2-1-3-8-18/h1-3,6-8,10-15,17H,4-5,9,16H2,(H,28,34)(H,29,30,31,32)
PubChem CID	4887
ChEMBL	CHEMBL21333
IUPHAR	3634
BindingDB	50023198
DrugBank	DB01411
Structure SDF download
Lipinski's druglikeness	This ligand satisfies Lipinski's rule of five.

Experimental Data

Parameter	Value	Reference	Database source
IC50	1.0 nM	PMID9554877	BindingDB,ChEMBL
Kd	0.000214 nM	N/A	BindingDB
Kd	214000.0 nM	Bioorg. Med. Chem. Lett., (1997) 7:10:1331	ChEMBL
Ki	0.8 nM	PMID10509933, PMID9934474	BindingDB
Ki	0.8 nM	PMID10509933, PMID9934474	ChEMBL

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