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Name | Adenosine receptor A1 |
---|---|
Species | Rattus norvegicus (Rat) |
Gene | Adora1 |
Synonym | A1 receptor A1-AR A1R adenosine receptor A1 RDC7 |
Disease | N/A for non-human GPCRs |
Length | 326 |
Amino acid sequence | MPPYISAFQAAYIGIEVLIALVSVPGNVLVIWAVKVNQALRDATFCFIVSLAVADVAVGALVIPLAILINIGPQTYFHTCLMVACPVLILTQSSILALLAIAVDRYLRVKIPLRYKTVVTQRRAAVAIAGCWILSLVVGLTPMFGWNNLSVVEQDWRANGSVGEPVIKCEFEKVISMEYMVYFNFFVWVLPPLLLMVLIYLEVFYLIRKQLNKKVSASSGDPQKYYGKELKIAKSLALILFLFALSWLPLHILNCITLFCPTCQKPSILIYIAIFLTHGNSAMNPIVYAFRIHKFRVTFLKIWNDHFRCQPKPPIDEDLPEEKAED |
UniProt | P25099 |
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 | CHEMBL318 |
IUPHAR | 18 |
DrugBank | N/A |
Name | 3-Isobutyl-1-methylxanthine |
---|---|
Molecular formula | C10H14N4O2 |
IUPAC name | 1-methyl-3-(2-methylpropyl)-7H-purine-2,6-dione |
Molecular weight | 222.248 |
Hydrogen bond acceptor | 3 |
Hydrogen bond donor | 1 |
XlogP | 1.5 |
Synonyms | Spectrum3_001958 TBT296U68M [Eur J Pharmacol 170: 35 (1989)] MolPort-001-737-339 NCGC00015559-07 [ Show all ] |
Inchi Key | APIXJSLKIYYUKG-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C10H14N4O2/c1-6(2)4-14-8-7(11-5-12-8)9(15)13(3)10(14)16/h5-6H,4H2,1-3H3,(H,11,12) |
PubChem CID | 3758 |
ChEMBL | CHEMBL275084 |
IUPHAR | 388 |
BindingDB | 15336 |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand satisfies Lipinski's rule of five. |
Parameter | Value | Reference | Database source |
---|---|---|---|
IC50 | 7000.0 nM | PMID2374150 | BindingDB,ChEMBL |
Ki | 2460.0 nM | PMID3010074 | BindingDB |
Ki | 2500.0 nM | PMID2795597 | BindingDB,ChEMBL |
Ki | 3200.0 nM | PMID2997628 | BindingDB |
Ki | 6700.0 nM | PMID2213834 | BindingDB,ChEMBL |
Ki | 7000.0 nM | PMID8410976, PMID8230124, PMID3806581 | BindingDB,ChEMBL |
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