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Compile Data Set for Download or QSAR

Found 2 hits of ki for monomerid = 50018415   
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))
BDBM50018415
PNG
(CHEMBL294185 | N-(2-Amino-ethyl)-2-[4-(6-oxo-1,3-d...)
Show SMILES CCCn1c2nc([nH]c2c(=O)n(CCC)c1=S)-c1ccc(OCC(=O)NCCN)cc1
Show InChI InChI=1S/C21H28N6O3S/c1-3-11-26-19-17(20(29)27(12-4-2)21(26)31)24-18(25-19)14-5-7-15(8-6-14)30-13-16(28)23-10-9-22/h5-8H,3-4,9-13,22H2,1-2H3,(H,23,28)(H,24,25)
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PC cid
PC sid
UniChem

Similars

PubMed
2.70n/an/an/an/an/an/an/an/a



NIDDK

Curated by ChEMBL


Assay Description
Inhibition of binding of 1 nM [3H]N-6-(phenylisopropyl)adenosine to adenosine A1 receptor in rat cortical membranes


J Med Chem 32: 1873-9 (1989)


BindingDB Entry DOI: 10.7270/Q2708213
More data for this
Ligand-Target Pair
Adenosine receptor A2a/A2b


(Rattus norvegicus-Rattus norvegicus (rat))
BDBM50018415
PNG
(CHEMBL294185 | N-(2-Amino-ethyl)-2-[4-(6-oxo-1,3-d...)
Show SMILES CCCn1c2nc([nH]c2c(=O)n(CCC)c1=S)-c1ccc(OCC(=O)NCCN)cc1
Show InChI InChI=1S/C21H28N6O3S/c1-3-11-26-19-17(20(29)27(12-4-2)21(26)31)24-18(25-19)14-5-7-15(8-6-14)30-13-16(28)23-10-9-22/h5-8H,3-4,9-13,22H2,1-2H3,(H,23,28)(H,24,25)
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
26n/an/an/an/an/an/an/an/a



NIDDK

Curated by ChEMBL


Assay Description
Inhibition of binding of [3H]5'-(N-ethylcarbamoyl)-adenosine to adenosine A2 receptor in rat striatal membranes


J Med Chem 32: 1873-9 (1989)


BindingDB Entry DOI: 10.7270/Q2708213
More data for this
Ligand-Target Pair