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PubMed code 12643898

Compile data set for download or QSAR
Found 4 hits of Enzyme Inhibition Constant Data   
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
Neuronal acetylcholine receptor subunit alpha-4/beta-2


(Rattus norvegicus (Rat))
BDBM50049757
PNG
(()-2-(6-Chloro-pyridin-3-yl)-7-aza-bicyclo[2.2.1]h...)
Show SMILES Clc1ccc(cn1)C1CC2CCC1N2 |TLB:4:7:11.10:13|
Show InChI InChI=1S/C11H13ClN2/c12-11-4-1-7(6-13-11)9-5-8-2-3-10(9)14-8/h1,4,6,8-10,14H,2-3,5H2
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Similars

PubMed
0.180n/an/an/an/an/an/an/an/a



Universit£ Louis Pasteur Strasbourg BP 24

Curated by ChEMBL


Assay Description
In vitro inhibitory potency for preventing ET-1 induced constriction of rat aortic rings (ETA receptor)


Bioorg Med Chem Lett 13: 1001-4 (2003)


BindingDB Entry DOI: 10.7270/Q2WW7JV4
More data for this
Ligand-Target Pair
Neuronal acetylcholine receptor subunit alpha-4/beta-2


(Rattus norvegicus (Rat))
BDBM50125187
PNG
(2-(2-Chloro-pyrimidin-5-yl)-7-aza-bicyclo[2.2.1]he...)
Show SMILES Clc1ncc(cn1)C1CC2CCC1N2 |THB:4:7:13:11.10|
Show InChI InChI=1S/C10H12ClN3/c11-10-12-4-6(5-13-10)8-3-7-1-2-9(8)14-7/h4-5,7-9,14H,1-3H2
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PubMed
0.310n/an/an/an/an/an/an/an/a



Universit£ Louis Pasteur Strasbourg BP 24

Curated by ChEMBL


Assay Description
In vitro inhibitory potency for preventing sarafotoxin S6c induced constriction of rat tracheal rings (ETB receptor)


Bioorg Med Chem Lett 13: 1001-4 (2003)


BindingDB Entry DOI: 10.7270/Q2WW7JV4
More data for this
Ligand-Target Pair
Neuronal acetylcholine receptor subunit alpha-4/beta-2


(Rattus norvegicus (Rat))
BDBM50125188
PNG
(CHEMBL268176 | N-[5-(7-Aza-bicyclo[2.2.1]hept-2-yl...)
Show SMILES ClCC(=O)Nc1ccc(cn1)C1CC2CCC1N2 |THB:8:11:17:15.14|
Show InChI InChI=1S/C13H16ClN3O/c14-6-13(18)17-12-4-1-8(7-15-12)10-5-9-2-3-11(10)16-9/h1,4,7,9-11,16H,2-3,5-6H2,(H,15,17,18)
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16n/an/an/an/an/an/an/an/a



Universit£ Louis Pasteur Strasbourg BP 24

Curated by ChEMBL


Assay Description
In vitro inhibitory potency for preventing ET-1 induced constriction of rat aortic rings (ETA receptor)


Bioorg Med Chem Lett 13: 1001-4 (2003)


BindingDB Entry DOI: 10.7270/Q2WW7JV4
More data for this
Ligand-Target Pair
Neuronal acetylcholine receptor subunit alpha-4/beta-2


(Rattus norvegicus (Rat))
BDBM50125189
PNG
(CHEMBL267191 | [5-(7-Aza-bicyclo[2.2.1]hept-2-yl)-...)
Show SMILES COC(=O)Nc1ccc(cn1)C1CC2CCC1N2 |THB:8:11:17:15.14|
Show InChI InChI=1S/C13H17N3O2/c1-18-13(17)16-12-5-2-8(7-14-12)10-6-9-3-4-11(10)15-9/h2,5,7,9-11,15H,3-4,6H2,1H3,(H,14,16,17)
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PubMed
8.10E+3n/an/an/an/an/an/an/an/a



Universit£ Louis Pasteur Strasbourg BP 24

Curated by ChEMBL


Assay Description
In vitro inhibitory potency for preventing ET-1 induced constriction of rat aortic rings (ETA receptor)


Bioorg Med Chem Lett 13: 1001-4 (2003)


BindingDB Entry DOI: 10.7270/Q2WW7JV4
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%