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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.
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	Alpha-1D adrenergic receptor
Species	Rattus norvegicus (Rat)
Gene	Adra1d
Synonym	ADRA1A Gpcr8 Adra-1 alpha1D-AR alpha1D-adrenoceptor alpha1a/d-adrenoceptor alpha1A/D alpha1A-adrenoceptor Alpha-1D adrenoreceptor Alpha-1D adrenoceptor ADRA1 Alpha-1A adrenergic receptor alpha 1D-adrenoreceptor alpha 1D-adrenoceptor adrenergic receptor delta1 Adrd1 ADRA1R RA42 [ Show all ]
Disease	N/A for non-human GPCRs
Length	561
Amino acid sequence	MTFRDILSVTFEGPRSSSSTGGSGAGGGAGTVGPEGGAVGGVPGATGGGAVVGTGSGEDNQSSTGEPGAAASGEVNGSAAVGGLVVSAQGVGVGVFLAAFILTAVAGNLLVILSVACNRHLQTVTNYFIVNLAVADLLLSAAVLPFSATMEVLGFWAFGRTFCDVWAAVDVLCCTASILSLCTISVDRYVGVRHSLKYPAIMTERKAAAILALLWAVALVVSVGPLLGWKEPVPPDERFCGITEEVGYAIFSSVCSFYLPMAVIVVMYCRVYVVARSTTRSLEAGIKREPGKASEVVLRIHCRGAATSAKGYPGTQSSKGHTLRSSLSVRLLKFSREKKAAKTLAIVVGVFVLCWFPFFFVLPLGSLFPQLKPSEGVFKVIFWLGYFNSCVNPLIYPCSSREFKRAFLRLLRCQCRRRRRRLWAVYGHHWRASTGDARSDCAPSPRIAPPGAPLALTAHPGAGSADTPETQDSVSSSRKPASALREWRLLGPLQRPTTQLRAKVSSLSHKIRSGARRAETACALRSEVEAVSLNVPQDGAEAVICQAYEPGDYSNLRETDI
UniProt	P23944
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	CHEMBL326
IUPHAR	24
DrugBank	N/A

Ligand

Name	CHEMBL66432
Molecular formula	C16H14N2O2
IUPAC name	4-[(4-methoxyphenyl)methyl]-2H-phthalazin-1-one
Molecular weight	266.3
Hydrogen bond acceptor	3
Hydrogen bond donor	1
XlogP	2.6
Synonyms	1(2H)-Phthalazinone, 4-[(4-methoxyphenyl)methyl]- DTXSID00490821 4-(4-methoxybenzyl)phthalazin-1(2H)-one BDBM50131404 4-[(4-Methoxyphenyl)methyl]phthalazin-1(2H)-one CTK1F1145 4-(4-Methoxy-benzyl)-2H-phthalazin-1-one 57835-95-7 SCHEMBL581787 4-(4-Methoxybenzyl)phthalazine-1(2H)-one 4-{[4-(Methyloxy)phenyl]methyl}-1(2H)-phthalazinone CUGWYAVRVHQTNG-UHFFFAOYSA-N 4-(4-methoxybenzyl)phthalazin-1 (2H)-one AKOS022631757 ZINC26263301 4-[(4-methoxyphenyl)methyl]-2H-phthalazin-1-one [ Show all ]
Inchi Key	CUGWYAVRVHQTNG-UHFFFAOYSA-N
Inchi ID	InChI=1S/C16H14N2O2/c1-20-12-8-6-11(7-9-12)10-15-13-4-2-3-5-14(13)16(19)18-17-15/h2-9H,10H2,1H3,(H,18,19)
PubChem CID	12332850
ChEMBL	CHEMBL66432
IUPHAR	N/A
BindingDB	50131404
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand satisfies Lipinski's rule of five.

Experimental Data

Parameter	Value	Reference	Database source
Activity	39.3 %	PMID16513345	ChEMBL
EC50	<10000.0 nM	PMID16513345	BindingDB,ChEMBL

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