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GPCR

Name	Alpha-2A adrenergic receptor
Species	Homo sapiens (Human)
Gene	ADRA2A
Synonym	alpha2D alpha2A-AR alpha2A-adrenoceptor alpha2A-adrenergic receptor alpha2A Alpha-2AAR Adra-2 Adra-2a ADRA2 ADRA2R Adrenergic alpha 2A receptor adrenergic receptor Alpha-2 adrenergic receptor subtype C10 Alpha-2A adrenoceptor Alpha-2A adrenoreceptor [ Show all ]
Disease	Attention deficit hyperactivity disorder Sexual dysfunction Pain
Length	450
Amino acid sequence	MGSLQPDAGNASWNGTEAPGGGARATPYSLQVTLTLVCLAGLLMLLTVFGNVLVIIAVFTSRALKAPQNLFLVSLASADILVATLVIPFSLANEVMGYWYFGKAWCEIYLALDVLFCTSSIVHLCAISLDRYWSITQAIEYNLKRTPRRIKAIIITVWVISAVISFPPLISIEKKGGGGGPQPAEPRCEINDQKWYVISSCIGSFFAPCLIMILVYVRIYQIAKRRTRVPPSRRGPDAVAAPPGGTERRPNGLGPERSAGPGGAEAEPLPTQLNGAPGEPAPAGPRDTDALDLEESSSSDHAERPPGPRRPERGPRGKGKARASQVKPGDSLPRRGPGATGIGTPAAGPGEERVGAAKASRWRGRQNREKRFTFVLAVVIGVFVVCWFPFFFTYTLTAVGCSVPRTLFKFFFWFGYCNSSLNPVIYTIFNHDFRRAFKKILCRGDRKRIV
UniProt	P08913
Protein Data Bank	N/A
GPCR-HGmod model	P08913
3D structure model	This predicted structure model is from GPCR-EXP P08913.
BioLiP	N/A
Therapeutic Target Database	T11448
ChEMBL	CHEMBL1867
IUPHAR	25
DrugBank	BE0000289

Ligand

Name	naphazoline
Molecular formula	C14H14N2
IUPAC name	2-(naphthalen-1-ylmethyl)-4,5-dihydro-1H-imidazole
Molecular weight	210.28
Hydrogen bond acceptor	1
Hydrogen bond donor	1
XlogP	2.1
Synonyms	Naphthizine AC1L1I5Y Prestwick1_000046 BDBM50001922 SPBio_001008 C-23907 STK300042 Ciba 2020/R DivK1c_000456 IDI1_000456 KBio2_006591 2-(1-Naphthalenylmethyl)-2-imidazoline Nadaplatin 2-(Naphthyl-(1')-methyl)imidazolin [German] 550-99-2 (mono-hydrochloride) A840596 NCGC00016506-03 AKOS000295230 Privine (Salt/Mix) BRD-K77641333-003-15-6 Spectrum3_000513 CCG-250339 Z56762888 CNIIGCLFLJGOGP-UHFFFAOYSA-N FT-0725973 K490 KBioSS_001455 2-(1-Naphthylmethyl)-4,5-dihydro-1H-imidazole Nafazolin (TN) 2-Naphthalen-1-ylmethyl-4,5-dihydro-1H-imidazole; hydrochloride Naphazoline [INN:BAN] Naphazolinum [Latin] AB00053505_13 NINDS_000456 Antan SBI-0051454.P003 BSPBio_000171 Spectrum_000975 HMS1394P03 KBio2_001455 1H-Imidazole, 4,5-dihydro-2-(1-naphthalenylmethyl)- MCULE-9097339235 2-(naphthalen-1-ylmethyl)-4,5-dihydro-1H-imidazole Nafazoline 5-23-08-00293 (Beilstein Handbook Reference) 550N992 NCGC00016506-01 AJ-11616 Prestwick2_000046 BPBio1_000189 SPBio_002092 C14H14N2 T8212 cid_11079 EINECS 212-641-5 IMI033 KBio3_001565 2-(1-naphthalenylmethyl)-4,5-dihydro-1H-imidazole NAFAZAIR 2-(naphthylmethyl)-2-imidazoline Naphazoline (INN) AB00053505-11 NCGC00016506-04 alpha-Naphthylmethyl imidazoline Rhinazine BRD-K77641333-003-25-5 Spectrum4_000068 CHEBI:93363 ZINC119717 D08253 GTPL5509 KB-224262 L000878 2-(1-Naphthylmethyl)-4,5-dihydro-1H-imidazole # Nafazolina 2-[(naphthalen-1-yl)methyl]-4,5-dihydro-1H-imidazole Naphazolinum Naphcon AB00053505_14 Prestwick0_000046 BBL012612 SCHEMBL34532 BSPBio_002065 ST45061546 CHEMBL761 DB06711 HMS2090D15 KBio2_004023 2-(.alpha.-Naphthylmethyl)-imidazoline MolPort-001-641-043 2-(Naphthyl-(1')-methyl)imidazolin Nafazoline [Spanish] 835-31-4 NCGC00016506-02 AK-968/41090774 Prestwick3_000046 BRD-K77641333-003-05-7 Spectrum2_001054 CC-32429 UNII-H231GF11BV Clearine Enamine_000333 Imidin KBioGR_000595 2-(1-Naphthylmethyl)-2-imidazoline Nafazolin 2-Imidazoline, 2-(1-naphthylmethyl)- Naphazoline Monohydrochloride Naphazolinum [INN-Latin] AB00053505-12 NCGC00016506-05 AN-47765 Sanorin (Salt/Mix) BRN 0151864 Spectrum5_001424 CHEMBL1706 D0O6IZ H231GF11BV KBio1_000456 .alpha.-Naphthylmethyl imidazoline LS-79666 2-(alpha-Naphthylmethyl)-imidazoline Nafazolina [DCIT] 4,5-Dihydro-2-(1-naphthylmethyl)imidazole [ Show all ]
Inchi Key	CNIIGCLFLJGOGP-UHFFFAOYSA-N
Inchi ID	InChI=1S/C14H14N2/c1-2-7-13-11(4-1)5-3-6-12(13)10-14-15-8-9-16-14/h1-7H,8-10H2,(H,15,16)
PubChem CID	4436
ChEMBL	CHEMBL761
IUPHAR	N/A
BindingDB	50001922
DrugBank	DB06711
Structure SDF download
Lipinski's druglikeness	This ligand satisfies Lipinski's rule of five.

Experimental Data

Parameter	Value	Reference	Database source
	N/A	N/A	DrugBank
Ki	20.89 nM	PMID9605427	BindingDB
Ki	20.893 nM	PMID9605427	PDSP

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