BDBM50079946 (2,3-Dihydro-benzo[1,4]dioxin-2-ylmethyl)-[1-(2,3-dihydro-benzo[1,4]dioxin-5-yl)-piperidin-4-ylmethyl]-amine::CHEMBL115599

SMILES: C(NCC1COc2ccccc2O1)C1CCN(CC1)c1cccc2OCCOc12

InChI Key: InChIKey=OGFDOBGWVXITBG-UHFFFAOYSA-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 = 50079946   

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
5-hydroxytryptamine receptor 1A (Rattus norvegicus (rat))	BDBM50079946 ((2,3-Dihydro-benzo[1,4]dioxin-2-ylmethyl)-[1-(2,3-...) Show SMILES C(NCC1COc2ccccc2O1)C1CCN(CC1)c1cccc2OCCOc12 Show InChI InChI=1S/C23H28N2O4/c1-2-6-21-20(5-1)28-16-18(29-21)15-24-14-17-8-10-25(11-9-17)19-4-3-7-22-23(19)27-13-12-26-22/h1-7,17-18,24H,8-16H2	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	18	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 towards 5-hydroxytryptamine 1A receptor from rat brain using [3H]-8-OH-DPAT as radioligand				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
D(2) dopamine receptor (Rattus norvegicus (rat))	BDBM50079946 ((2,3-Dihydro-benzo[1,4]dioxin-2-ylmethyl)-[1-(2,3-...) Show SMILES C(NCC1COc2ccccc2O1)C1CCN(CC1)c1cccc2OCCOc12 Show InChI InChI=1S/C23H28N2O4/c1-2-6-21-20(5-1)28-16-18(29-21)15-24-14-17-8-10-25(11-9-17)19-4-3-7-22-23(19)27-13-12-26-22/h1-7,17-18,24H,8-16H2	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	23	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