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Compile Data Set for Download or QSAR

Found 5 hits of ki for monomerid = 50368347   
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 A2a/A2b


(Rattus norvegicus-Rattus norvegicus (rat))
BDBM50368347
PNG
(CHEMBL610655)
Show SMILES CCCCCC#Cc1nc(N)c2ncn(C3O[C@@H]([C@@H](O)[C@H]3O)C(=O)NCC)c2n1 |r|
Show InChI InChI=1S/C19H26N6O4/c1-3-5-6-7-8-9-11-23-16(20)12-17(24-11)25(10-22-12)19-14(27)13(26)15(29-19)18(28)21-4-2/h10,13-15,19,26-27H,3-7H2,1-2H3,(H,21,28)(H2,20,23,24)/t13-,14+,15-,19?/m0/s1
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PubMed
4.70n/an/an/an/an/an/an/an/a



Universit£ di Camerino

Curated by ChEMBL


Assay Description
Binding affinity against adenosine A1 receptors from rat brain membranes using [3H]CCPA


J Med Chem 35: 2363-8 (1992)


BindingDB Entry DOI: 10.7270/Q2M9098M
More data for this
Ligand-Target Pair
Adenosine receptor A2a/A2b


(Homo sapiens (Human))
BDBM50368347
PNG
(CHEMBL610655)
Show SMILES CCCCCC#Cc1nc(N)c2ncn(C3O[C@@H]([C@@H](O)[C@H]3O)C(=O)NCC)c2n1 |r|
Show InChI InChI=1S/C19H26N6O4/c1-3-5-6-7-8-9-11-23-16(20)12-17(24-11)25(10-22-12)19-14(27)13(26)15(29-19)18(28)21-4-2/h10,13-15,19,26-27H,3-7H2,1-2H3,(H,21,28)(H2,20,23,24)/t13-,14+,15-,19?/m0/s1
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antibodypedia
antibodypedia
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37n/an/an/an/an/an/an/an/a



Universit£ di Camerino

Curated by ChEMBL


Assay Description
Binding affinity against low affinity component of adenosine A1 receptors from rat brain membranes using [3H]-DPCPX


J Med Chem 35: 2363-8 (1992)


BindingDB Entry DOI: 10.7270/Q2M9098M
More data for this
Ligand-Target Pair
Adenosine receptor A1


(Rattus norvegicus (rat))
BDBM50368347
PNG
(CHEMBL610655)
Show SMILES CCCCCC#Cc1nc(N)c2ncn(C3O[C@@H]([C@@H](O)[C@H]3O)C(=O)NCC)c2n1 |r|
Show InChI InChI=1S/C19H26N6O4/c1-3-5-6-7-8-9-11-23-16(20)12-17(24-11)25(10-22-12)19-14(27)13(26)15(29-19)18(28)21-4-2/h10,13-15,19,26-27H,3-7H2,1-2H3,(H,21,28)(H2,20,23,24)/t13-,14+,15-,19?/m0/s1
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89n/an/an/an/an/an/an/an/a



Universit£ di Camerino

Curated by ChEMBL


Assay Description
Binding affinity against Adenosine A1 receptor from rat brain membranes using [3H]CCPA


J Med Chem 35: 2363-8 (1992)


BindingDB Entry DOI: 10.7270/Q2M9098M
More data for this
Ligand-Target Pair
Adenosine receptor A1


(Rattus norvegicus (rat))
BDBM50368347
PNG
(CHEMBL610655)
Show SMILES CCCCCC#Cc1nc(N)c2ncn(C3O[C@@H]([C@@H](O)[C@H]3O)C(=O)NCC)c2n1 |r|
Show InChI InChI=1S/C19H26N6O4/c1-3-5-6-7-8-9-11-23-16(20)12-17(24-11)25(10-22-12)19-14(27)13(26)15(29-19)18(28)21-4-2/h10,13-15,19,26-27H,3-7H2,1-2H3,(H,21,28)(H2,20,23,24)/t13-,14+,15-,19?/m0/s1
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171n/an/an/an/an/an/an/an/a



Universit£ di Camerino

Curated by ChEMBL


Assay Description
Binding affinity against adenosine A1 receptors from rat brain membranes using [3H]CCPA


J Med Chem 35: 2363-8 (1992)


BindingDB Entry DOI: 10.7270/Q2M9098M
More data for this
Ligand-Target Pair
Adenosine receptor A1


(Rattus norvegicus (rat))
BDBM50368347
PNG
(CHEMBL610655)
Show SMILES CCCCCC#Cc1nc(N)c2ncn(C3O[C@@H]([C@@H](O)[C@H]3O)C(=O)NCC)c2n1 |r|
Show InChI InChI=1S/C19H26N6O4/c1-3-5-6-7-8-9-11-23-16(20)12-17(24-11)25(10-22-12)19-14(27)13(26)15(29-19)18(28)21-4-2/h10,13-15,19,26-27H,3-7H2,1-2H3,(H,21,28)(H2,20,23,24)/t13-,14+,15-,19?/m0/s1
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PubMed
2.91E+3n/an/an/an/an/an/an/an/a



Universit£ di Camerino

Curated by ChEMBL


Assay Description
Inhibition of adenylate cyclase via adenosine A1 receptors in rat fat cell membranes


J Med Chem 35: 2363-8 (1992)


BindingDB Entry DOI: 10.7270/Q2M9098M
More data for this
Ligand-Target Pair