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SMILES: OCc1ccc(s1)-c1ccc(cc1)-c1cn(nn1)[C@H]1CN2CCC1CC2

InChI Key: InChIKey=LKFDYEFBPSJATA-IBGZPJMESA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50513580   
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 subunit alpha-7


(Rattus norvegicus (Rat))		BDBM50513580
PNG
(CHEMBL4464805)
Show SMILES OCc1ccc(s1)-c1ccc(cc1)-c1cn(nn1)[C@H]1CN2CCC1CC2 |r,wU:18.20,(44.61,-20.52,;43.2,-19.9,;41.96,-20.81,;41.96,-22.35,;40.5,-22.82,;39.59,-21.58,;40.49,-20.33,;38.05,-21.58,;37.28,-22.92,;35.74,-22.92,;34.97,-21.58,;35.73,-20.25,;37.27,-20.24,;33.43,-21.58,;32.37,-22.77,;30.91,-22.12,;31.08,-20.53,;32.64,-20.21,;29.52,-22.91,;29.52,-24.5,;28.14,-25.3,;26.77,-24.5,;26.77,-22.91,;28.14,-22.11,;28.53,-23.49,;27.66,-23.95,)|
Show InChI InChI=1S/C20H22N4OS/c25-13-17-5-6-20(26-17)16-3-1-14(2-4-16)18-11-24(22-21-18)19-12-23-9-7-15(19)8-10-23/h1-6,11,15,19,25H,7-10,12-13H2/t19-/m0/s1
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 120n/an/an/an/an/an/an/an/a



Universit£ d'Orl£ans

Curated by ChEMBL


Assay Description
Displacement of [125I]-alpha-bungarotoxin from alpha7 nAChR in Wistar rat brain membrane incubated for 3 hrs by gamma counting analysis

Eur J Med Chem 179: 449-469 (2019)


Article DOI: 10.1016/j.ejmech.2019.06.049
More data for this
Ligand-Target Pair