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BDBM50135593 2-(4-Phenyl-pyridin-3-yl)-9-aza-bicyclo[4.2.1]non-2-ene::CHEMBL93983

SMILES: C1CC2NC1CCC=C2c1cnccc1-c1ccccc1

InChI Key: InChIKey=XEJZOIZREAEWFT-UHFFFAOYSA-N

Data: 3 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 3 hits for monomerid = 50135593   
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))
BDBM50135593
PNG
(2-(4-Phenyl-pyridin-3-yl)-9-aza-bicyclo[4.2.1]non-...)
Show SMILES C1CC2NC1CCC=C2c1cnccc1-c1ccccc1 |c:8,THB:9:8:3:1.0|
Show InChI InChI=1S/C19H20N2/c1-2-5-14(6-3-1)16-11-12-20-13-18(16)17-8-4-7-15-9-10-19(17)21-15/h1-3,5-6,8,11-13,15,19,21H,4,7,9-10H2
PDB
MMDB

KEGG

UniProtKB/SwissProt

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

Similars

PubMed
234n/an/an/an/an/an/an/an/a



University of Bristol

Curated by ChEMBL


Assay Description
Binding affinity towards Nicotinic acetylcholine receptor alpha4-beta2 using [3H]-nicotine as radioligand


Bioorg Med Chem Lett 13: 2825-8 (2003)


BindingDB Entry DOI: 10.7270/Q2Z31Z26
More data for this
Ligand-Target Pair
Neuronal acetylcholine receptor subunit alpha-7


(Rattus norvegicus (Rat))
BDBM50135593
PNG
(2-(4-Phenyl-pyridin-3-yl)-9-aza-bicyclo[4.2.1]non-...)
Show SMILES C1CC2NC1CCC=C2c1cnccc1-c1ccccc1 |c:8,THB:9:8:3:1.0|
Show InChI InChI=1S/C19H20N2/c1-2-5-14(6-3-1)16-11-12-20-13-18(16)17-8-4-7-15-9-10-19(17)21-15/h1-3,5-6,8,11-13,15,19,21H,4,7,9-10H2
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
927n/an/an/an/an/an/an/an/a



University of Bristol

Curated by ChEMBL


Assay Description
Binding affinity towards Nicotinic acetylcholine receptor alpha7 using [3H]-MLA as radioligand


Bioorg Med Chem Lett 13: 2825-8 (2003)


BindingDB Entry DOI: 10.7270/Q2Z31Z26
More data for this
Ligand-Target Pair
Neuronal acetylcholine receptor subunit alpha-3/beta-2


(Homo sapiens (Human))
BDBM50135593
PNG
(2-(4-Phenyl-pyridin-3-yl)-9-aza-bicyclo[4.2.1]non-...)
Show SMILES C1CC2NC1CCC=C2c1cnccc1-c1ccccc1 |c:8,THB:9:8:3:1.0|
Show InChI InChI=1S/C19H20N2/c1-2-5-14(6-3-1)16-11-12-20-13-18(16)17-8-4-7-15-9-10-19(17)21-15/h1-3,5-6,8,11-13,15,19,21H,4,7,9-10H2
PDB

UniProtKB/SwissProt
UniProtKB/TrEMBL

antibodypedia
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
1.99E+3n/an/an/an/an/an/an/an/a



University of Bristol

Curated by ChEMBL


Assay Description
Binding affinity towards Nicotinic acetylcholine receptor alpha4-beta2 using [3H]-nicotine as radioligand


Bioorg Med Chem Lett 13: 2825-8 (2003)


BindingDB Entry DOI: 10.7270/Q2Z31Z26
More data for this
Ligand-Target Pair