BDBM50079953 3-({[1-(2-Methoxy-phenyl)-piperidin-4-ylmethyl]-amino}-methyl)-2,3-dihydro-benzo[1,4]dioxin-5-ol::CHEMBL115931

SMILES: COc1ccccc1N1CCC(CNCC2COc3cccc(O)c3O2)CC1

InChI Key: InChIKey=CHBUDRVHEPFQKH-UHFFFAOYSA-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 = 50079953   

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
D(2) dopamine receptor (Rattus norvegicus (rat))	BDBM50079953 (3-({[1-(2-Methoxy-phenyl)-piperidin-4-ylmethyl]-am...) Show SMILES COc1ccccc1N1CCC(CNCC2COc3cccc(O)c3O2)CC1 Show InChI InChI=1S/C22H28N2O4/c1-26-20-7-3-2-5-18(20)24-11-9-16(10-12-24)13-23-14-17-15-27-21-8-4-6-19(25)22(21)28-17/h2-8,16-17,23,25H,9-15H2,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	25	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Knoll Pharmaceuticals Curated by ChEMBL					Assay Description Binding affinity of the compound to the dopamine receptor D2L in rat brain membranes				J Med Chem 42: 3342-55 (1999) Article DOI: 10.1021/jm9910122 BindingDB Entry DOI: 10.7270/Q2WH2P6K
					More data for this Ligand-Target Pair