Reaction Details
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Target
Adenosine receptor A1
Ligand
BDBM50149596
Substrate
n/a
Meas. Tech.
ChEMBL_1558359 (CHEMBL3772951)
IC50
37±n/a nM
Citation
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More Info.:
Target
Name:
Adenosine receptor A1
Synonyms:
A1 adenosine receptor (hA1) | A1AR | AA1R_HUMAN | ADENOSINE A1 | ADORA1 | Adenosine A1 receptor (A1AR) | Adenosine A1-receptor | Adenosine receptor A1 (A1) | Adenosine receptor A1 (hA1) | Adenosine transporter (AdT)
Type:
G Protein-Coupled Receptor (GPCR)
Mol. Mass.:
36520.92
Organism:
Homo sapiens (Human)
Description:
P30542
Residue:
326
Sequence:
MPPSISAFQAAYIGIEVLIALVSVPGNVLVIWAVKVNQALRDATFCFIVSLAVADVAVGALVIPLAILINIGPQTYFHTCLMVACPVLILTQSSILALLAIAVDRYLRVKIPLRYKMVVTPRRAAVAIAGCWILSFVVGLTPMFGWNNLSAVERAWAANGSMGEPVIKCEFEKVISMEYMVYFNFFVWVLPPLLLMVLIYLEVFYLIRKQLNKKVSASSGDPQKYYGKELKIAKSLALILFLFALSWLPLHILNCITLFCPSCHKPSILTYIAIFLTHGNSAMNPIVYAFRIQKFRVTFLKIWNDHFRCQPAPPIDEDLPEERPDD
Inhibitor
Name:
BDBM50149596
Synonyms:
CHEMBL3769641
Type:
Small organic molecule
Emp. Form.:
C22H30N6O5
Mol. Mass.:
458.5108
SMILES:
CCNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(NC34CC5CC(CC(O)(C5)C3)C4)ncnc12 |r,TLB:25:24:21:18.28.19,17:18:21.20.26:23,THB:27:18:21:26.24.23,27:24:21:18.28.19,19:18:21.20.26:23,19:20:18.28.27:23,17:18:21:26.24.23|