BDBM50039821 CHEMBL93421::Cyclohexanecarboxylic acid {2-[4-(2,3-dihydro-benzo[1,4]dioxin-5-yl)-piperazin-1-yl]-ethyl}-amide

SMILES: O=C(NCCN1CCN(CC1)c1cccc2OCCOc12)C1CCCCC1

InChI Key: InChIKey=AULWQIXLYRHZTL-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 = 50039821   

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))	BDBM50039821 (CHEMBL93421 | Cyclohexanecarboxylic acid {2-[4-(2,...) Show SMILES O=C(NCCN1CCN(CC1)c1cccc2OCCOc12)C1CCCCC1 Show InChI InChI=1S/C21H31N3O3/c25-21(17-5-2-1-3-6-17)22-9-10-23-11-13-24(14-12-23)18-7-4-8-19-20(18)27-16-15-26-19/h4,7-8,17H,1-3,5-6,9-16H2,(H,22,25)	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	0.440	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Solvay Duphar Research Laboratories Curated by ChEMBL					Assay Description Binding affinity to displace [3H]2-(di-N-propylamino)-8-hydroxy-tetralin from 5-hydroxytryptamine 1A (5-HT1A) receptor in rat frontal cortex homogena...				J Med Chem 37: 2761-73 (1994) BindingDB Entry DOI: 10.7270/Q2DJ5G84
					More data for this Ligand-Target Pair