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Name | Adenosine receptor A1 |
---|---|
Species | Cavia porcellus (Guinea pig) |
Gene | ADORA1 |
Synonym | N/A |
Disease | N/A for non-human GPCRs |
Length | 326 |
Amino acid sequence | MPHSVSAFQAAYIGIEVLIALVSVPGNVLVIWAVKVNQALRDATFCFIASLAVADVAVGALVIPLAILINIGPQTYFHTCLMVACPVLILTQSSILALLAIAVDRYLRVKIPLRYKTVVTPRRAAVAIAGCWILSLVVGLTPMFGWNNLSKIEMAWAANGSVGEPVIKCEFEKVISMEYMVYFNFFVWVLPPLLLMVLIYLEVFYLIRKQLSKKVSASSGDPQKYYGKELKIAKSLALILFLFALSWLPLHILNCITLFCPTCHKPTILTYIAIFLTHGNSAMNPIVYAFRIQKFRVTFLKIWNDHFRCQPEPPIDEDLPEEKVDD |
UniProt | P47745 |
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 | CHEMBL2304404 |
IUPHAR | N/A |
DrugBank | N/A |
Name | CHEMBL321507 |
---|---|
Molecular formula | C19H26N4O2 |
IUPAC name | 1-methyl-3-(2-methylpropyl)-8-(3-tricyclo[3.3.1.03,7]nonanyl)-7H-purine-2,6-dione |
Molecular weight | 342.443 |
Hydrogen bond acceptor | 3 |
Hydrogen bond donor | 1 |
XlogP | 3.5 |
Synonyms | BDBM50004588 SCHEMBL7279878 8-(Hexahydro-2,5-methano-pentalen-3a-yl)-3-isobutyl-1-methyl-3,7-dihydro-purine-2,6-dione |
Inchi Key | FVGRCQWVXKAUCG-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C19H26N4O2/c1-10(2)9-23-15-14(16(24)22(3)18(23)25)20-17(21-15)19-7-11-4-12(8-19)6-13(19)5-11/h10-13H,4-9H2,1-3H3,(H,20,21) |
PubChem CID | 15667106 |
ChEMBL | CHEMBL321507 |
IUPHAR | N/A |
BindingDB | 50004588 |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand satisfies Lipinski's rule of five. |
Parameter | Value | Reference | Database source |
---|---|---|---|
Ki | 15.0 nM | PMID1501234, PMID1548682 | BindingDB,ChEMBL |
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