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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 | CHEMBL283908 |
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Molecular formula | C19H22N4O2 |
IUPAC name | 8-[(E)-2-phenylethenyl]-1,3-dipropyl-7H-purine-2,6-dione |
Molecular weight | 338.411 |
Hydrogen bond acceptor | 3 |
Hydrogen bond donor | 1 |
XlogP | 4.6 |
Synonyms | BDBM50006713 1,3-Dipropyl-8-(2-phenylethenyl)xanthine SCHEMBL7396869 1,3-Dipropyl-8-[(E)-2-phenylethenyl]xanthine 1,3-Dipropyl-8-(E)-styrylxanthine [ Show all ] |
Inchi Key | AQJSRAHLXWDLEG-ZHACJKMWSA-N |
Inchi ID | InChI=1S/C19H22N4O2/c1-3-12-22-17-16(18(24)23(13-4-2)19(22)25)20-15(21-17)11-10-14-8-6-5-7-9-14/h5-11H,3-4,12-13H2,1-2H3,(H,20,21)/b11-10+ |
PubChem CID | 10065736 |
ChEMBL | CHEMBL283908 |
IUPHAR | N/A |
BindingDB | N/A |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand satisfies Lipinski's rule of five. |
Parameter | Value | Reference | Database source |
---|---|---|---|
Ki | 22.0 nM | PMID8496902 | ChEMBL |
Ki | 22.2 nM | PMID2016719 | ChEMBL |
Ki | 35.0 nM | PMID1613758 | ChEMBL |
Ki | 55.0 nM | PMID8496902 | ChEMBL |
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