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SMILES: [H][C@]1(CCCN1C)[C@]1([H])COc2cc(O)ccc2O1

InChI Key:

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 = 50549603   
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-3/beta-4


(Homo sapiens (Human))
BDBM50549603
PNG
(CHEMBL4778976)
Show SMILES [H][C@]1(CCCN1C)[C@]1([H])COc2cc(O)ccc2O1 |r|
PDB

KEGG

UniProtKB/SwissProt

antibodypedia
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
1.90E+3n/an/an/an/an/an/an/an/a


TBA

Assay Description
Displacement of [3H]-epibatidine from human alpha3beta4 transfected in HEK293 cell membranes preincubated for 5 mins followed by [3H]-epibatidine add...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c01150
BindingDB Entry DOI: 10.7270/Q2K93C4G
More data for this
Ligand-Target Pair
Neuronal acetylcholine receptor subunit alpha-7


(Rattus norvegicus (Rat))
BDBM50549603
PNG
(CHEMBL4778976)
Show SMILES [H][C@]1(CCCN1C)[C@]1([H])COc2cc(O)ccc2O1 |r|
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
2.68E+4n/an/an/an/an/an/an/an/a


TBA

Assay Description
Displacement of [125I]alpha-bungarotoxin from alpha7nAChR in rat hippocampus membranes preincubated for 5 mins followed by [125I]alpha-bungarotoxin a...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c01150
BindingDB Entry DOI: 10.7270/Q2K93C4G
More data for this
Ligand-Target Pair
Neuronal acetylcholine receptor subunit alpha-4/beta-2


(Rattus norvegicus (Rat))
BDBM50549603
PNG
(CHEMBL4778976)
Show SMILES [H][C@]1(CCCN1C)[C@]1([H])COc2cc(O)ccc2O1 |r|
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
5.00E+4n/an/an/an/an/an/an/an/a


TBA

Assay Description
Displacement of [3H]-Epibatidine from alpha4beta2 nAChR in rat cerebral cortex membrane preincubated for 5 mins followed by [3H]-Epibatidine addition...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c01150
BindingDB Entry DOI: 10.7270/Q2K93C4G
More data for this
Ligand-Target Pair