BDBM50069830 CHEMBL84537::Ethyl-[5-((S)-1-methyl-pyrrolidin-2-ylmethoxy)-pyridin-3-yl]-amine

SMILES: CCNc1cncc(OC[C@@H]2CCCN2C)c1

InChI Key: InChIKey=VFJRCOBUZDBCFV-LBPRGKRZSA-N

Data: 1 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 1 hit for monomerid = 50069830   

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 protein alpha-4/beta-2 subunit (Rattus norvegicus (Rat))	BDBM50069830 (CHEMBL84537 | Ethyl-[5-((S)-1-methyl-pyrrolidin-2-...) Show SMILES CCNc1cncc(OC[C@@H]2CCCN2C)c1 Show InChI InChI=1S/C13H21N3O/c1-3-15-11-7-13(9-14-8-11)17-10-12-5-4-6-16(12)2/h7-9,12,15H,3-6,10H2,1-2H3/t12-/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	3.70	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Binding affinity towards nAChR (alpha4-beta2) by the displacement of [3H]-(-)-cytisine in whole rat brain membranes.				Bioorg Med Chem Lett 8: 249-54 (1999) BindingDB Entry DOI: 10.7270/Q2P26X90
					More data for this Ligand-Target Pair