BDBM50170271 (2S,6R)-10-(cyanoboranyl)-3-methyl-3,10-diazatricyclo[7.4.0.0^{2,6}]trideca-1(9),10,12-trien-10-ium::CHEMBL361372

SMILES: CN1CC[C@H]2CCc3c(ccc[n+]3BC#N)[C@@H]12

InChI Key: InChIKey=CHWHUBGBBOCOIO-MFKMUULPSA-N

Data: 2 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 2 hits for monomerid = 50170271   

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 subunit alpha-7 (Rattus norvegicus (Rat))	BDBM50170271 ((2S,6R)-10-(cyanoboranyl)-3-methyl-3,10-diazatricy...) Show SMILES CN1CC[C@H]2CCc3c(ccc[n+]3BC#N)[C@@H]12 Show InChI InChI=1S/C13H17BN3/c1-16-8-6-10-4-5-12-11(13(10)16)3-2-7-17(12)14-9-15/h2-3,7,10,13-14H,4-6,8H2,1H3/q+1/t10-,13+/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Florida Curated by ChEMBL					Assay Description Inhibition of [3H]-MLA binding to rat alpha7 nicotinic acetylcholine receptor				Bioorg Med Chem Lett 15: 3874-80 (2005) Article DOI: 10.1016/j.bmcl.2005.05.118 BindingDB Entry DOI: 10.7270/Q2ZK5G6J
					More data for this Ligand-Target Pair
Neuronal acetylcholine receptor subunit alpha-4/beta-2 (Rattus norvegicus (Rat))	BDBM50170271 ((2S,6R)-10-(cyanoboranyl)-3-methyl-3,10-diazatricy...) Show SMILES CN1CC[C@H]2CCc3c(ccc[n+]3BC#N)[C@@H]12 Show InChI InChI=1S/C13H17BN3/c1-16-8-6-10-4-5-12-11(13(10)16)3-2-7-17(12)14-9-15/h2-3,7,10,13-14H,4-6,8H2,1H3/q+1/t10-,13+/m1/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Florida Curated by ChEMBL					Assay Description Inhibition of [3H]-Nicotine binding to rat alpha4-beta2 nicotinic acetylcholine receptor				Bioorg Med Chem Lett 15: 3874-80 (2005) Article DOI: 10.1016/j.bmcl.2005.05.118 BindingDB Entry DOI: 10.7270/Q2ZK5G6J
					More data for this Ligand-Target Pair