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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 | CHEMBL142383 |
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Molecular formula | C30H35N5O8 |
IUPAC name | methyl 3-[3-(4-methoxycarbonyl-4-phenylpiperidin-1-yl)propylcarbamoyl]-6-methyl-4-(4-nitrophenyl)-2-oxo-1,4-dihydropyrimidine-5-carboxylate |
Molecular weight | 593.637 |
Hydrogen bond acceptor | 9 |
Hydrogen bond donor | 2 |
XlogP | 3.4 |
Synonyms | 1-[[3-(4-Methoxycarbonyl-4-phenylpiperidino)propyl]carbamoyl]-2-oxo-4-methyl-6-(4-nitrophenyl)-1,2,3,6-tetrahydropyrimidine-5-carboxylic acid methyl ester BDBM50082787 L016755 3-[3-(4-Methoxycarbonyl-4-phenyl-piperidin-1-yl)-propylcarbamoyl]-6-methyl-4-(4-nitro-phenyl)-2-oxo-1,2,3,4-tetrahydro-pyrimidine-5-carboxylic acid methyl ester |
Inchi Key | AXXIDQZJAQSNEN-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C30H35N5O8/c1-20-24(26(36)42-2)25(21-10-12-23(13-11-21)35(40)41)34(29(39)32-20)28(38)31-16-7-17-33-18-14-30(15-19-33,27(37)43-3)22-8-5-4-6-9-22/h4-6,8-13,25H,7,14-19H2,1-3H3,(H,31,38)(H,32,39) |
PubChem CID | 10393665 |
ChEMBL | CHEMBL142383 |
IUPHAR | N/A |
BindingDB | 50082787 |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand is heavier than 500 daltons. |
Parameter | Value | Reference | Database source |
---|---|---|---|
Ki | 0.4 nM | PMID10579840 | ChEMBL |
Ki | 0.5 nM | PMID10579840 | ChEMBL |
Ki | 2.1 nM | PMID10579840 | BindingDB,ChEMBL |
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