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PubMed code 25941557

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-7


(Rattus norvegicus (Rat))
BDBM82070
PNG
(CAS_29790-52-1 | NICOTINE-L (BASE) | Nicotine-D sa...)
Show SMILES CN1CCC[C@H]1c1cccnc1 |r|
Show InChI InChI=1S/C10H14N2/c1-12-7-3-5-10(12)9-4-2-6-11-8-9/h2,4,6,8,10H,3,5,7H2,1H3/t10-/m0/s1
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PDB
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PDB
Article
PubMed
1.50E+4n/an/an/an/an/an/an/an/a



University of Copenhagen

Curated by ChEMBL


Assay Description
Displacement of [3H]MLA from rat alpha7 nAChR transfected in tsA201 cell membrane


ACS Med Chem Lett 6: 472-5 (2015)


Article DOI: 10.1021/acsmedchemlett.5b00028
BindingDB Entry DOI: 10.7270/Q2WS8W0D
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Neuronal acetylcholine receptor subunit alpha-7


(Rattus norvegicus (Rat))
BDBM50089638
PNG
(CHEMBL3578315)
Show SMILES [H][C@]12CCCN1CCc1ccncc21 |r|
Show InChI InChI=1S/C11H14N2/c1-2-11-10-8-12-5-3-9(10)4-7-13(11)6-1/h3,5,8,11H,1-2,4,6-7H2/t11-/m1/s1
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PubMed
3.00E+5n/an/an/an/an/an/an/an/a



University of Copenhagen

Curated by ChEMBL


Assay Description
Displacement of [3H]MLA from rat alpha7 nAChR transfected in tsA201 cell membrane


ACS Med Chem Lett 6: 472-5 (2015)


Article DOI: 10.1021/acsmedchemlett.5b00028
BindingDB Entry DOI: 10.7270/Q2WS8W0D
More data for this
Ligand-Target Pair
Neuronal acetylcholine receptor subunit alpha-7


(Rattus norvegicus (Rat))
BDBM50089639
PNG
(CHEMBL3578316)
Show SMILES [H][C@@]12CCCN1CCc1ccncc21 |r|
Show InChI InChI=1S/C11H14N2/c1-2-11-10-8-12-5-3-9(10)4-7-13(11)6-1/h3,5,8,11H,1-2,4,6-7H2/t11-/m0/s1
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PubMed
>3.00E+5n/an/an/an/an/an/an/an/a



University of Copenhagen

Curated by ChEMBL


Assay Description
Displacement of [3H]MLA from rat alpha7 nAChR transfected in tsA201 cell membrane


ACS Med Chem Lett 6: 472-5 (2015)


Article DOI: 10.1021/acsmedchemlett.5b00028
BindingDB Entry DOI: 10.7270/Q2WS8W0D
More data for this
Ligand-Target Pair
Neuronal acetylcholine receptor subunit alpha-7


(Rattus norvegicus (Rat))
BDBM50089637
PNG
(CHEMBL3578314)
Show SMILES C1CC2N(C1)CCc1ccncc21
Show InChI InChI=1S/C11H14N2/c1-2-11-10-8-12-5-3-9(10)4-7-13(11)6-1/h3,5,8,11H,1-2,4,6-7H2
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PC cid
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UniChem

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Article
PubMed
5.00E+5n/an/an/an/an/an/an/an/a



University of Copenhagen

Curated by ChEMBL


Assay Description
Displacement of [3H]MLA from rat alpha7 nAChR transfected in tsA201 cell membrane


ACS Med Chem Lett 6: 472-5 (2015)


Article DOI: 10.1021/acsmedchemlett.5b00028
BindingDB Entry DOI: 10.7270/Q2WS8W0D
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%