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Name | Adenosine receptor A1 |
---|---|
Species | Bos taurus (Bovine) |
Gene | ADORA1 |
Synonym | N/A |
Disease | N/A for non-human GPCRs |
Length | 326 |
Amino acid sequence | MPPSISAFQAAYIGIEVLIALVSVPGNVLVIWAVKVNQALRDATFCFIVSLAVADVAVGALVIPLAILINIGPRTYFHTCLKVACPVLILTQSSILALLAIAVDRYLRVKIPLRYKTVVTPRRAVVAITGCWILSFVVGLTPMFGWNNLSAVERDWLANGSVGEPVIECQFEKVISMEYMVYFNFFVWVLPPLLLMVLIYMEVFYLIRKQLNKKVSASSGDPQKYYGKELKIAKSLALILFLFALSWLPLHILNCITLFCPSCHMPRILIYIAIFLSHGNSAMNPIVYAFRIQKFRVTFLKIWNDHFRCQPAPPVDEDAPAERPDD |
UniProt | P28190 |
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 | CHEMBL4975 |
IUPHAR | N/A |
DrugBank | N/A |
Name | CHEMBL275793 |
---|---|
Molecular formula | C17H14N4O2 |
IUPAC name | 1,3-dimethyl-8-naphthalen-2-yl-7H-purine-2,6-dione |
Molecular weight | 306.325 |
Hydrogen bond acceptor | 3 |
Hydrogen bond donor | 1 |
XlogP | 3.4 |
Synonyms | 1,3-Dimethyl-8-naphthalen-2-yl-3,7-dihydro-purine-2,6-dione 1,3-Dimethyl-8-(2-naphthyl)xanthine BDBM50021007 |
Inchi Key | CYJBMSTXLBXFAZ-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C17H14N4O2/c1-20-15-13(16(22)21(2)17(20)23)18-14(19-15)12-8-7-10-5-3-4-6-11(10)9-12/h3-9H,1-2H3,(H,18,19) |
PubChem CID | 11779897 |
ChEMBL | CHEMBL275793 |
IUPHAR | N/A |
BindingDB | 50021007 |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand satisfies Lipinski's rule of five. |
Parameter | Value | Reference | Database source |
---|---|---|---|
IC50 | 5.5 nM | PMID2991519 | BindingDB,ChEMBL |
zhanglabzhanggroup.org | (734) 647-1549 | 100 Washtenaw Avenue, Ann Arbor, MI 48109-2218