BDBM50320553 3-(3-Methoxybenzylidene)anabaseine::CHEMBL1164724

SMILES: COc1cccc(\C=C2/CCCN=C2c2cccnc2)c1

InChI Key: InChIKey=LCPAGINWWFBDNO-RVDMUPIBSA-N

Data: 4 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 4 hits for monomerid = 50320553   

Target/Host (Institution)	Ligand	Target/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	pH	Temp °C
Neuronal acetylcholine receptor (Rattus norvegicus (Rat))	BDBM50320553 (3-(3-Methoxybenzylidene)anabaseine | CHEMBL1164724) Show SMILES COc1cccc(\C=C2/CCCN=C2c2cccnc2)c1 |c:12| Show InChI InChI=1S/C18H18N2O/c1-21-17-8-2-5-14(12-17)11-15-6-4-10-20-18(15)16-7-3-9-19-13-16/h2-3,5,7-9,11-13H,4,6,10H2,1H3/b15-11+	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	460	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Florida Curated by ChEMBL					Assay Description Displacement of [125I]-alpha-bungarotoxin from alpha7 nAChR in rat brain membrane after 3 hrs				Eur J Med Chem 45: 2433-46 (2010) Article DOI: 10.1016/j.ejmech.2010.02.027 BindingDB Entry DOI: 10.7270/Q27081M9
					More data for this Ligand-Target Pair
Neuronal acetylcholine receptor (Rattus norvegicus (Rat))	BDBM50320553 (3-(3-Methoxybenzylidene)anabaseine | CHEMBL1164724) Show SMILES COc1cccc(\C=C2/CCCN=C2c2cccnc2)c1 |c:12| Show InChI InChI=1S/C18H18N2O/c1-21-17-8-2-5-14(12-17)11-15-6-4-10-20-18(15)16-7-3-9-19-13-16/h2-3,5,7-9,11-13H,4,6,10H2,1H3/b15-11+	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	460	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Florida Curated by ChEMBL					Assay Description Displacement of [125I]-alpha-bungarotoxin from alpha7 nAChR in rat brain membrane after 3 hrs				Eur J Med Chem 45: 2433-46 (2010) Article DOI: 10.1016/j.ejmech.2010.02.027 BindingDB Entry DOI: 10.7270/Q27081M9
					More data for this Ligand-Target Pair
Neuronal acetylcholine receptor protein alpha-4/beta-2 subunit (Rattus norvegicus (Rat))	BDBM50320553 (3-(3-Methoxybenzylidene)anabaseine | CHEMBL1164724) Show SMILES COc1cccc(\C=C2/CCCN=C2c2cccnc2)c1 |c:12| Show InChI InChI=1S/C18H18N2O/c1-21-17-8-2-5-14(12-17)11-15-6-4-10-20-18(15)16-7-3-9-19-13-16/h2-3,5,7-9,11-13H,4,6,10H2,1H3/b15-11+	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	847	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Florida Curated by ChEMBL					Assay Description Displacement of [3H]cytisine from alpha4beta2 nAChR in rat brain membrane after 3 hrs				Eur J Med Chem 45: 2433-46 (2010) Article DOI: 10.1016/j.ejmech.2010.02.027 BindingDB Entry DOI: 10.7270/Q27081M9
					More data for this Ligand-Target Pair
Neuronal acetylcholine receptor protein alpha-4/beta-2 subunit (Rattus norvegicus (Rat))	BDBM50320553 (3-(3-Methoxybenzylidene)anabaseine | CHEMBL1164724) Show SMILES COc1cccc(\C=C2/CCCN=C2c2cccnc2)c1 |c:12| Show InChI InChI=1S/C18H18N2O/c1-21-17-8-2-5-14(12-17)11-15-6-4-10-20-18(15)16-7-3-9-19-13-16/h2-3,5,7-9,11-13H,4,6,10H2,1H3/b15-11+	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	847	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Florida Curated by ChEMBL					Assay Description Displacement of [3H]cytisine from alpha4beta2 nAChR in rat brain membrane after 3 hrs				Eur J Med Chem 45: 2433-46 (2010) Article DOI: 10.1016/j.ejmech.2010.02.027 BindingDB Entry DOI: 10.7270/Q27081M9
					More data for this Ligand-Target Pair