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Name | Alpha-1A adrenergic receptor |
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Species | Homo sapiens (Human) |
Gene | ADRA1A |
Synonym | alpha1a ADRA1C ADRA1L1 adrenergic alpha 1c receptor adrenergic receptor alpha 1c [ Show all ] |
Disease | Urinary incontinence Benign prostatic hyperplasia Cognitive disorders Female sexual dysfunction Glaucoma [ Show all ] |
Length | 466 |
Amino acid sequence | MVFLSGNASDSSNCTQPPAPVNISKAILLGVILGGLILFGVLGNILVILSVACHRHLHSVTHYYIVNLAVADLLLTSTVLPFSAIFEVLGYWAFGRVFCNIWAAVDVLCCTASIMGLCIISIDRYIGVSYPLRYPTIVTQRRGLMALLCVWALSLVISIGPLFGWRQPAPEDETICQINEEPGYVLFSALGSFYLPLAIILVMYCRVYVVAKRESRGLKSGLKTDKSDSEQVTLRIHRKNAPAGGSGMASAKTKTHFSVRLLKFSREKKAAKTLGIVVGCFVLCWLPFFLVMPIGSFFPDFKPSETVFKIVFWLGYLNSCINPIIYPCSSQEFKKAFQNVLRIQCLCRKQSSKHALGYTLHPPSQAVEGQHKDMVRIPVGSRETFYRISKTDGVCEWKFFSSMPRGSARITVSKDQSSCTTARVRSKSFLQVCCCVGPSTPSLDKNHQVPTIKVHTISLSENGEEV |
UniProt | P35348 |
Protein Data Bank | N/A |
GPCR-HGmod model | P35348 |
3D structure model | This predicted structure model is from GPCR-EXP P35348. |
BioLiP | N/A |
Therapeutic Target Database | T92609 |
ChEMBL | CHEMBL229 |
IUPHAR | 22 |
DrugBank | BE0000501 |
Name | SCHEMBL8097715 |
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Molecular formula | C25H27NO5 |
IUPAC name | 2-(2,6-dimethoxyphenoxy)-N-[(3-phenyl-2,3-dihydro-1,4-benzodioxin-2-yl)methyl]ethanamine |
Molecular weight | 421.493 |
Hydrogen bond acceptor | 6 |
Hydrogen bond donor | 1 |
XlogP | 4.4 |
Synonyms | L001148 BDBM81444 NSC_185453 CAS_185453 |
Inchi Key | UVEKKXRFQCNLQE-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C25H27NO5/c1-27-21-13-8-14-22(28-2)25(21)29-16-15-26-17-23-24(18-9-4-3-5-10-18)31-20-12-7-6-11-19(20)30-23/h3-14,23-24,26H,15-17H2,1-2H3 |
PubChem CID | 14743454 |
ChEMBL | N/A |
IUPHAR | N/A |
BindingDB | 81444 |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand satisfies Lipinski's rule of five. |
Parameter | Value | Reference | Database source |
---|---|---|---|
Ki | 0.16 nM | PMID16420037 | BindingDB |
Ki | 0.23 nM | PMID8396931 | BindingDB |
Ki | 0.25 nM | PMID16420037 | BindingDB |
Ki | 1.25 nM | PMID7815325 | BindingDB |
Ki | 10.0 nM | PMID7815325 | BindingDB |
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