Target
Adenosine receptor A1
Ligand
BDBM50176817
Substrate
n/a
Meas. Tech.
ChEMBL_430784 (CHEMBL920040)
Ki
1822±n/a nM
Citation
 Manetti, FSchenone, SBondavalli, FBrullo, CBruno, ORanise, AMosti, LMenozzi, GFossa, PTrincavelli, MLMartini, CMartinelli, ATintori, CBotta, M Synthesis and 3D QSAR of new pyrazolo[3,4-b]pyridines: potent and selective inhibitors of A1 adenosine receptors. J Med Chem 48:7172-85 (2005) [PubMed]  Article 
Target
Name:
Adenosine receptor A1
Synonyms:
AA1R_BOVIN | ADENOSINE A1 | ADENOSINE A1 high | ADENOSINE A1 low | ADORA1 | Adenosine A1 receptor
Type:
Enzyme Catalytic Domain
Mol. Mass.:
36602.99
Organism:
BOVINE
Description:
ADENOSINE 0 BOVINE::P28190
Residue:
326
Sequence:
MPPSISAFQAAYIGIEVLIALVSVPGNVLVIWAVKVNQALRDATFCFIVSLAVADVAVGALVIPLAILINIGPRTYFHTCLKVACPVLILTQSSILALLAIAVDRYLRVKIPLRYKTVVTPRRAVVAITGCWILSFVVGLTPMFGWNNLSAVERDWLANGSVGEPVIECQFEKVISMEYMVYFNFFVWVLPPLLLMVLIYMEVFYLIRKQLNKKVSASSGDPQKYYGKELKIAKSLALILFLFALSWLPLHILNCITLFCPSCHMPRILIYIAIFLSHGNSAMNPIVYAFRIQKFRVTFLKIWNDHFRCQPAPPVDEDAPAERPDD
  
Inhibitor
Name:
BDBM50176817
Synonyms:
CHEMBL388388 | isopropyl 1-(2-chloro-2-phenylethyl)-4-morpholino-1H-pyrazolo[3,4-b]pyridine-5-carboxylate
Type:
Small organic molecule
Emp. Form.:
C22H25ClN4O3
Mol. Mass.:
428.912
SMILES:
CC(C)OC(=O)c1cnc2n(CC(Cl)c3ccccc3)ncc2c1N1CCOCC1
Structure:
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