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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 = 'BDBM50308500'   
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))
BDBM50308500
PNG
(CHEMBL590301 | Ethyl 5-(4-methoxybenzoyl)-4-phenyl...)
Show SMILES CCOC(=O)Nc1nc(c(s1)C(=O)c1ccc(OC)cc1)-c1ccccc1
Show InChI InChI=1S/C20H18N2O4S/c1-3-26-20(24)22-19-21-16(13-7-5-4-6-8-13)18(27-19)17(23)14-9-11-15(25-2)12-10-14/h4-12H,3H2,1-2H3,(H,21,22,24)
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PC cid
PC sid
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Similars

Article
PubMed
70n/an/an/an/an/an/an/an/a



University of Bonn

Curated by ChEMBL


Assay Description
Displacement of [3H]CCPA from adenosine A1 receptor in rat brain cortex membrane


Bioorg Med Chem 18: 2195-203 (2010)


Article DOI: 10.1016/j.bmc.2010.01.072
BindingDB Entry DOI: 10.7270/Q2BZ670J
More data for this
Ligand-Target Pair