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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Adenosine receptor A1' and Ligand = 'BDBM50368355'   
Target/Host
(Institution)		LigandTarget/Host
Links		Ligand
Links		Trg + Lig
Links		Ki
nM		ΔG°
kJ/mole		IC50
nM		Kd
nM		EC50/IC50
nM		koff
s-1		kon
M-1s-1		pHTemp
°C
Adenosine receptor A1


(Rattus norvegicus (rat))		BDBM50368355
PNG
(CHEMBL609475)
Show SMILES CCCCC#Cc1nc(N)c2ncn(C3O[C@@H]([C@@H](O)[C@H]3O)C(=O)NCCC)c2n1 |r|
Show InChI InChI=1S/C19H26N6O4/c1-3-5-6-7-8-11-23-16(20)12-17(24-11)25(10-22-12)19-14(27)13(26)15(29-19)18(28)21-9-4-2/h10,13-15,19,26-27H,3-6,9H2,1-2H3,(H,21,28)(H2,20,23,24)/t13-,14+,15-,19?/m0/s1
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Similars
PubMed
 19n/an/an/an/an/an/an/an/a



Hokkaido University

Curated by ChEMBL


Assay Description
Binding affinity against adenosine A1 receptor from rat brain membranes using [3H]cyclohexyladenosine as radioligand.

J Med Chem 35: 2881-90 (1992)


BindingDB Entry DOI: 10.7270/Q22B8ZMC
More data for this
Ligand-Target Pair