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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 | CHEMBL76585 |
---|---|
Molecular formula | C21H26N4O2 |
IUPAC name | 7-methyl-8-[(E)-1-phenylprop-1-en-2-yl]-1,3-dipropylpurine-2,6-dione |
Molecular weight | 366.465 |
Hydrogen bond acceptor | 3 |
Hydrogen bond donor | 0 |
XlogP | 4.3 |
Synonyms | 1,3-Dipropyl-7-methyl-8-[(E)-1-methyl-2-phenylethenyl]xanthine BDBM50006718 SCHEMBL8372562 SCHEMBL8372571 7-Methyl-8-(1-methyl-2-phenyl-vinyl)-1,3-dipropyl-3,7-dihydro-purine-2,6-dione |
Inchi Key | COSOPUIFIBWWGN-CCEZHUSRSA-N |
Inchi ID | InChI=1S/C21H26N4O2/c1-5-12-24-19-17(20(26)25(13-6-2)21(24)27)23(4)18(22-19)15(3)14-16-10-8-7-9-11-16/h7-11,14H,5-6,12-13H2,1-4H3/b15-14+ |
PubChem CID | 44315365 |
ChEMBL | CHEMBL76585 |
IUPHAR | N/A |
BindingDB | 50006718 |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand satisfies Lipinski's rule of five. |
Parameter | Value | Reference | Database source |
---|---|---|---|
Ki | <10000.0 nM | PMID1613758 | BindingDB,ChEMBL |
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