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GLASS

You can:

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	Beta-2 adrenergic receptor
Species	Canis lupus familiaris (Dog)
Gene	ADRB2
Synonym	Beta-2 adrenoceptor Beta-2 adrenoreceptor
Disease	N/A for non-human GPCRs
Length	415
Amino acid sequence	MGQPANRSVFLLAPNGSHAPDQGDSQERSEAWVVGMGIVMSLIVLAIVFGNVLVITAIARFERLQTVTNYFITSLACADLVMGLAVVPFGASHILMKMWTFGNFWCEFWTSIDVLCVTASIETLCVIAVDRYFAITSPFKYQSLLTKNKARVVILMVWIVSGLTSFLPIQMHWYRATHQEAINCYAKETCCDFFTNQAYAIASSIVSFYLPLVVMVFVYSRVFQVAQRQLQKIDRSEGRFHAQNLSQVEQDGRSGHGHRRSSKFCLKEHKALKTLGIIMGTFTLCWLPFFIVNIVHVIQDNLIPKEVYILLNWVGYVNSAFNPLIYCRSPDFRIAFQELLCLRRSSLKAYGNGYSNNSNSRSDYAGEHSGCHLGQEKDSELLCEDPPGTEDRQGTVPSDSVDSQGRNCSTNDSLL
UniProt	P54833
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	CHEMBL2289
IUPHAR	N/A
DrugBank	N/A

Ligand

Name	CHEMBL40412
Molecular formula	C16H21IN2O2
IUPAC name	1-(dicyclopropylmethylideneamino)oxy-3-(3-iodoanilino)propan-2-ol
Molecular weight	400.26
Hydrogen bond acceptor	4
Hydrogen bond donor	2
XlogP	3.2
Synonyms	Dicyclopropyl-methanone O-[2-hydroxy-3-(3-iodo-phenylamino)-propyl]-oxime BDBM50064227 Dicyclopropyl ketone O-[2-hydroxy-3-[(3-iodophenyl)amino]propyl]oxime
Inchi Key	GMZATGRCGRFPLK-UHFFFAOYSA-N
Inchi ID	InChI=1S/C16H21IN2O2/c17-13-2-1-3-14(8-13)18-9-15(20)10-21-19-16(11-4-5-11)12-6-7-12/h1-3,8,11-12,15,18,20H,4-7,9-10H2
PubChem CID	10525002
ChEMBL	CHEMBL40412
IUPHAR	N/A
BindingDB	50064227
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	<10000.0 nM	PMID9572886	BindingDB,ChEMBL

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