BindingDB PrimarySearch

BDBM50209213 (S)-9-Hydroxy-1,2,10-trimethoxy-6,6-dimethyl-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinolinium; iodide::CHEMBL112640::N-methyllaurotetanine methiodide

SMILES: COc1cc-2c(C[C@H]3c4c(CC[N+]3(C)C)cc(OC)c(OC)c-24)cc1O

InChI Key: InChIKey=FGUCOPALAZXICJ-HNNXBMFYSA-O

Data: 2 KI 2 IC50

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 50209213
Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50/IC50 nM	k_off s^-1	k_on M^-1s^-1	pH	Temp °C
Neuronal acetylcholine receptor subunit alpha-4/beta-2 (Homo sapiens (Human))	BDBM50209213 ((S)-9-Hydroxy-1,2,10-trimethoxy-6,6-dimethyl-5,6,6...) Show SMILES Show InChI	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	910	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Chile Curated by ChEMBL					Assay Description Displacement of [3H]cytisine from human alpha4beta2 nAChR expressed in SH-EP1 cells				Bioorg Med Chem 15: 3368-72 (2007) Article DOI: 10.1016/j.bmc.2007.03.023 BindingDB Entry DOI: 10.7270/Q2G73DDV
University of Chile Curated by ChEMBL					More data for this Ligand-Target Pair
Neuronal acetylcholine receptor subunit alpha-7 (Homo sapiens (Human))	BDBM50209213 ((S)-9-Hydroxy-1,2,10-trimethoxy-6,6-dimethyl-5,6,6...) Show SMILES Show InChI	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Chile Curated by ChEMBL					Assay Description Displacement of [125I]alpha-bungarotoxin from human alpha7 nAChR expressed in SH-SY5Y cells				Bioorg Med Chem 15: 3368-72 (2007) Article DOI: 10.1016/j.bmc.2007.03.023 BindingDB Entry DOI: 10.7270/Q2G73DDV
University of Chile Curated by ChEMBL					More data for this Ligand-Target Pair
Neuronal acetylcholine receptor subunit alpha-4/beta-2 (Homo sapiens (Human))	BDBM50209213 ((S)-9-Hydroxy-1,2,10-trimethoxy-6,6-dimethyl-5,6,6...) Show SMILES Show InChI	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Chile Curated by ChEMBL					Assay Description Displacement of [3H]cytisine from human alpha4beta2 nAChR expressed in SH-EP1 cells				Bioorg Med Chem 15: 3368-72 (2007) Article DOI: 10.1016/j.bmc.2007.03.023 BindingDB Entry DOI: 10.7270/Q2G73DDV
University of Chile Curated by ChEMBL					More data for this Ligand-Target Pair
Neuronal acetylcholine receptor subunit alpha-7 (Homo sapiens (Human))	BDBM50209213 ((S)-9-Hydroxy-1,2,10-trimethoxy-6,6-dimethyl-5,6,6...) Show SMILES Show InChI	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.20E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Chile Curated by ChEMBL					Assay Description Displacement of [125I]alpha-bungarotoxin from human alpha7 nAChR expressed in SH-SY5Y cells				Bioorg Med Chem 15: 3368-72 (2007) Article DOI: 10.1016/j.bmc.2007.03.023 BindingDB Entry DOI: 10.7270/Q2G73DDV
University of Chile Curated by ChEMBL					More data for this Ligand-Target Pair