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BDBM50287824 (S)-1-Methyl-2-phenoxymethyl-pyrrolidine::CHEMBL73786

SMILES: CN1CCC[C@H]1COc1ccccc1

InChI Key: InChIKey=GXHUWYAGVDTPAX-NSHDSACASA-N

Data: 2 KI

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50287824   
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/beta-2


(Rattus norvegicus (Rat))
BDBM50287824
PNG
((S)-1-Methyl-2-phenoxymethyl-pyrrolidine | CHEMBL7...)
Show SMILES CN1CCC[C@H]1COc1ccccc1
Show InChI InChI=1S/C12H17NO/c1-13-9-5-6-11(13)10-14-12-7-3-2-4-8-12/h2-4,7-8,11H,5-6,9-10H2,1H3/t11-/m0/s1
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
42n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Milano

Curated by ChEMBL


Assay Description
Displacement of [3H]-cytisine from alpha4beta2-nACHR in rat whole brain


Bioorg Med Chem Lett 26: 5613-5617 (2016)


Article DOI: 10.1016/j.bmcl.2016.10.078
BindingDB Entry DOI: 10.7270/Q2RJ4MFR
More data for this
Ligand-Target Pair
Neuronal acetylcholine receptor subunit alpha-10


(Rattus norvegicus)
BDBM50287824
PNG
((S)-1-Methyl-2-phenoxymethyl-pyrrolidine | CHEMBL7...)
Show SMILES CN1CCC[C@H]1COc1ccccc1
Show InChI InChI=1S/C12H17NO/c1-13-9-5-6-11(13)10-14-12-7-3-2-4-8-12/h2-4,7-8,11H,5-6,9-10H2,1H3/t11-/m0/s1
KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
42n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Binding affinity against neuronal nicotinic acetylcholine receptor(nAChR) by using [3H]-Cytisine as radioligand in whole rat brain


Bioorg Med Chem Lett 6: 2283-2288 (1996)


Article DOI: 10.1016/0960-894X(96)00416-7
BindingDB Entry DOI: 10.7270/Q2C82999
More data for this
Ligand-Target Pair