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BDBM50364907 CHEMBL1950138

SMILES: CCN(CC)CC#Cc1ccc2-c3ccc(cc3C(=O)c2c1)C#CCN(CC)CC

InChI Key: InChIKey=SEYBVAXQEGLZJV-UHFFFAOYSA-N

Data: 1 KI

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50364907   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Neuronal acetylcholine receptor


(Rattus norvegicus (Rat))
BDBM50364907
PNG
(CHEMBL1950138)
Show SMILES CCN(CC)CC#Cc1ccc2-c3ccc(cc3C(=O)c2c1)C#CCN(CC)CC
Show InChI InChI=1S/C27H30N2O/c1-5-28(6-2)17-9-11-21-13-15-23-24-16-14-22(12-10-18-29(7-3)8-4)20-26(24)27(30)25(23)19-21/h13-16,19-20H,5-8,17-18H2,1-4H3
PDB

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PC cid
PC sid
UniChem
Article
PubMed
87n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Displacement of [3H]methyllylcaconitine from alpha7 nAChR in rat brain


Bioorg Med Chem Lett 22: 1633-8 (2012)


Article DOI: 10.1016/j.bmcl.2011.12.126
BindingDB Entry DOI: 10.7270/Q2D21Z2W
More data for this
Ligand-Target Pair