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SMILES: CC(=O)C1=CCC[C@@H]2CC[C@H]1N2

InChI Key: InChIKey=SGNXVBOIDPPRJJ-PSASIEDQSA-N

PDB links: 2 PDB IDs match this monomer.

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 = 50428369   
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


(Homo sapiens (Human))
BDBM50428369
PNG
((+)-Anatoxin-A | CHEMBL2332144)
Show SMILES CC(=O)C1=CCC[C@@H]2CC[C@H]1N2 |r,t:3|
Show InChI InChI=1S/C10H15NO/c1-7(12)9-4-2-3-8-5-6-10(9)11-8/h4,8,10-11H,2-3,5-6H2,1H3/t8-,10-/m1/s1
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
antibodypedia
GoogleScholar
AffyNet 
Purchase

CHEMBL
MCE
KEGG
PC cid
PC sid
PDB
UniChem

Similars

Article
PubMed
0.340n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Genova

Curated by ChEMBL


Assay Description
Displacement of [3H]nicotine from alpha4beta2 nAChR (unknown origin)


J Nat Prod 76: 727-31 (2013)


Article DOI: 10.1021/np3007028
BindingDB Entry DOI: 10.7270/Q2F1912Q
More data for this
Ligand-Target Pair
Neuronal acetylcholine receptor subunit alpha-7


(Homo sapiens (Human))
BDBM50428369
PNG
((+)-Anatoxin-A | CHEMBL2332144)
Show SMILES CC(=O)C1=CCC[C@@H]2CC[C@H]1N2 |r,t:3|
Show InChI InChI=1S/C10H15NO/c1-7(12)9-4-2-3-8-5-6-10(9)11-8/h4,8,10-11H,2-3,5-6H2,1H3/t8-,10-/m1/s1
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
Purchase

CHEMBL
MCE
KEGG
PC cid
PC sid
PDB
UniChem

Similars

Article
PubMed
91n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Genova

Curated by ChEMBL


Assay Description
Displacement of [125I]alpha-bungarotoxin from alpha7 nAChR (unknown origin)


J Nat Prod 76: 727-31 (2013)


Article DOI: 10.1021/np3007028
BindingDB Entry DOI: 10.7270/Q2F1912Q
More data for this
Ligand-Target Pair