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GLASS

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Go to the GPCR, ligand, or experimental data tables.
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GPCR

Name	Alpha-1A adrenergic receptor
Species	Rattus norvegicus (Rat)
Gene	Adra1a
Synonym	alpha1c alpha1A-adrenoceptor alpha1a Alpha-1C adrenergic receptor Alpha-1A adrenoreceptor Alpha-1A adrenoceptor alpha-1A adrenergic receptor ADRA1C alpha 1C-adrenergic receptor alpha 1A-adrenoreceptor alpha 1A-adrenoceptor adrenergic receptor, alpha 1a adrenergic receptor alpha 1c adrenergic alpha 1c receptor ADRA1L1 [ Show all ]
Disease	N/A for non-human GPCRs
Length	466
Amino acid sequence	MVLLSENASEGSNCTHPPAPVNISKAILLGVILGGLIIFGVLGNILVILSVACHRHLHSVTHYYIVNLAVADLLLTSTVLPFSAIFEILGYWAFGRVFCNIWAAVDVLCCTASIMGLCIISIDRYIGVSYPLRYPTIVTQRRGVRALLCVWVLSLVISIGPLFGWRQPAPEDETICQINEEPGYVLFSALGSFYVPLAIILVMYCRVYVVAKRESRGLKSGLKTDKSDSEQVTLRIHRKNVPAEGGGVSSAKNKTHFSVRLLKFSREKKAAKTLGIVVGCFVLCWLPFFLVMPIGSFFPDFKPSETVFKIVFWLGYLNSCINPIIYPCSSQEFKKAFQNVLRIQCLRRRQSSKHALGYTLHPPSQALEGQHRDMVRIPVGSGETFYKISKTDGVCEWKFFSSMPQGSARITVPKDQSACTTARVRSKSFLQVCCCVGSSAPRPEENHQVPTIKIHTISLGENGEEV
UniProt	P43140
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	CHEMBL319
IUPHAR	22
DrugBank	N/A

Ligand

Name	CHEMBL58803
Molecular formula	C23H28N4O
IUPAC name	N-(1-benzylpiperidin-4-yl)-1-propan-2-ylindazole-3-carboxamide
Molecular weight	376.504
Hydrogen bond acceptor	3
Hydrogen bond donor	1
XlogP	4.0
Synonyms	BWNPJXJNWYUPES-UHFFFAOYSA-N N-(1-benzylpiperidin-4-yl)-1-isopropylindazole-3-carboxamide PDSP2_001650 N-(1-Benzylpiperidin-4-yl)-1-isopropylindazole-3-carboxamide Hydrochloride BDBM85227 SCHEMBL3161642 1-Isopropyl-N-(1-benzylpiperidine-4alpha-yl)-1H-indazole-3-carboxamide PDSP1_001666 [ Show all ]
Inchi Key	BWNPJXJNWYUPES-UHFFFAOYSA-N
Inchi ID	InChI=1S/C23H28N4O/c1-17(2)27-21-11-7-6-10-20(21)22(25-27)23(28)24-19-12-14-26(15-13-19)16-18-8-4-3-5-9-18/h3-11,17,19H,12-16H2,1-2H3,(H,24,28)
PubChem CID	10499786
ChEMBL	CHEMBL58803
IUPHAR	N/A
BindingDB	85227
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand satisfies Lipinski's rule of five.

Experimental Data

Parameter	Value	Reference	Database source
Ki	<10000.0 nM	PMID9599243	BindingDB

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