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BDBM50264917 3-(2-chloro-6-fluorophenyl)-5-(5-methyl-1-(piperidin-4-yl)-1H-pyrazol-4-yl)isoxazole::CHEMBL497162

SMILES: Cc1c(cnn1C1CCNCC1)-c1cc(no1)-c1c(F)cccc1Cl

InChI Key: InChIKey=PVEBSIDPZPWPTL-UHFFFAOYSA-N

Data: 1 EC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50264917   
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-4


(Homo sapiens (Human))
BDBM50264917
PNG
(3-(2-chloro-6-fluorophenyl)-5-(5-methyl-1-(piperid...)
Show SMILES Cc1c(cnn1C1CCNCC1)-c1cc(no1)-c1c(F)cccc1Cl
Show InChI InChI=1S/C18H18ClFN4O/c1-11-13(10-22-24(11)12-5-7-21-8-6-12)17-9-16(23-25-17)18-14(19)3-2-4-15(18)20/h2-4,9-10,12,21H,5-8H2,1H3
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 6n/an/an/an/a



Amgen Inc

Curated by ChEMBL


Assay Description
Activation of human alpha4beta2 nAChR assessed as potentiation of submaximal response to nicotine induced current


Bioorg Med Chem Lett 18: 5209-12 (2008)


Article DOI: 10.1016/j.bmcl.2008.08.080
BindingDB Entry DOI: 10.7270/Q2SX6D26
More data for this
Ligand-Target Pair