Reaction Details Report a problem with these data
Target
Adenosine receptor A1
Ligand
BDBM50146790
Substrate
n/a
Meas. Tech.
ChEMBL_27487 (CHEMBL633815)
Ki
53800±n/a nM
Citation
 Fontaine, F; Pastor, M; Sanz, F Incorporating molecular shape into the alignment-free Grid-Independent Descriptors. J Med Chem 47:2805-15 (2004) [PubMed]  Article 
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:
BDBM50146790
Synonyms:
4,6-Dimethyl-2-(6-oxo-3-phenyl-5,6-dihydro-4H-pyridazin-1-ylmethyl)-1,4-dihydro-imidazo[4,5-b]pyridine-5,7-dione | CHEMBL97710
Type:
Small organic molecule
Emp. Form.:
C19H19N5O3
Mol. Mass.:
365.3859
SMILES:
Cc1c(O)c2[nH]c(CN3N=C(CCC3=O)c3ccccc3)nc2n(C)c1=O |c:9|
Structure:
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