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SMILES: NS(=O)(=O)CCN1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2

InChI Key: InChIKey=PMXGBTXKWGGXHH-UHFFFAOYSA-N

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50279334   
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


(Rattus norvegicus (Rat))
BDBM50279334
PNG
(CHEMBL520478 | N-[2-(Methylsulfonyl)ethyl]cytisine)
Show SMILES NS(=O)(=O)CCN1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2 |r|
Show InChI InChI=1S/C13H19N3O3S/c14-20(18,19)5-4-15-7-10-6-11(9-15)12-2-1-3-13(17)16(12)8-10/h1-3,10-11H,4-9H2,(H2,14,18,19)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
564n/an/an/an/an/an/an/an/a



Università degli Studi di Genova

Curated by ChEMBL


Assay Description
Displacement of (+/-)-[3H]epibatidine from alpha4beta2 nicotinic acetylcholine receptor in rat brain cortex membrane homogenates


J Med Chem 52: 4345-57 (2009)


Article DOI: 10.1021/jm900225j
BindingDB Entry DOI: 10.7270/Q2K64J03
More data for this
Ligand-Target Pair
Neuronal acetylcholine receptor subunit alpha-7


(Rattus norvegicus (Rat))
BDBM50279334
PNG
(CHEMBL520478 | N-[2-(Methylsulfonyl)ethyl]cytisine)
Show SMILES NS(=O)(=O)CCN1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2 |r|
Show InChI InChI=1S/C13H19N3O3S/c14-20(18,19)5-4-15-7-10-6-11(9-15)12-2-1-3-13(17)16(12)8-10/h1-3,10-11H,4-9H2,(H2,14,18,19)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
>5.00E+4n/an/an/an/an/an/an/an/a



Università degli Studi di Genova

Curated by ChEMBL


Assay Description
Displacement of [125I]alpha-bungarotoxin from alpha7 nicotinic acetylcholine receptor in rat brain cortex membrane homogenates


J Med Chem 52: 4345-57 (2009)


Article DOI: 10.1021/jm900225j
BindingDB Entry DOI: 10.7270/Q2K64J03
More data for this
Ligand-Target Pair