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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 | I-Abopx |
---|---|
Molecular formula | C23H22IN5O5 |
IUPAC name | 2-[4-[3-[(4-amino-3-iodophenyl)methyl]-2,6-dioxo-1-propyl-7H-purin-8-yl]phenoxy]acetic acid |
Molecular weight | 575.363 |
Hydrogen bond acceptor | 7 |
Hydrogen bond donor | 3 |
XlogP | 4.4 |
Synonyms | AC1Q4PDB CAS_163889 L001152 3-(3-Iodo-4-aminobenzyl)-8-(4-oxyacetate)-1-propylxanthine ACMC-20cvfe [ Show all ] |
Inchi Key | DKJMGIXWGPEEFF-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C23H22IN5O5/c1-2-9-28-22(32)19-21(29(23(28)33)11-13-3-8-17(25)16(24)10-13)27-20(26-19)14-4-6-15(7-5-14)34-12-18(30)31/h3-8,10H,2,9,11-12,25H2,1H3,(H,26,27)(H,30,31) |
PubChem CID | 163889 |
ChEMBL | CHEMBL355370 |
IUPHAR | 446 |
BindingDB | 82558 |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand is heavier than 500 daltons. |
Parameter | Value | Reference | Database source |
---|---|---|---|
Bmax | 485.0 fM mg-1 | PMID3351851 | ChEMBL |
IC50 | 3.0 nM | PMID3351850 | BindingDB,ChEMBL |
IC50 | 37.0 nM | PMID3351850 | BindingDB,ChEMBL |
Kd | 0.8 nM | PMID3351851 | BindingDB,ChEMBL |
Ki | 37.0 nM | PMID7932565 | BindingDB,ChEMBL |
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