BDBM50142642 8-{4-[4-(4-Fluoro-phenyl)-piperazin-1-yl]-pentyl}-8-aza-spiro[4.5]decane-7,9-dione::CHEMBL47419

SMILES: CC(CCCN1C(=O)CC2(CCCC2)CC1=O)N1CCN(CC1)c1ccc(F)cc1

InChI Key: InChIKey=YGNHEDMWLQZJBE-UHFFFAOYSA-N

Data: 1 IC50

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 = 50142642   

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 (Homo sapiens (Human))	BDBM50142642 (8-{4-[4-(4-Fluoro-phenyl)-piperazin-1-yl]-pentyl}-...) Show SMILES CC(CCCN1C(=O)CC2(CCCC2)CC1=O)N1CCN(CC1)c1ccc(F)cc1 Show InChI InChI=1S/C24H34FN3O2/c1-19(26-13-15-27(16-14-26)21-8-6-20(25)7-9-21)5-4-12-28-22(29)17-24(18-23(28)30)10-2-3-11-24/h6-9,19H,2-5,10-18H2,1H3	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	99	n/a	n/a	n/a	n/a	n/a	n/a
ArQule Inc Curated by ChEMBL					Assay Description In vitro binding affinity of the compound against 5-hydroxytryptamine 1A receptor using [3H]-8-OH-DPAT in human CYP3A4 assay				Bioorg Med Chem Lett 14: 1709-12 (2004) Article DOI: 10.1016/j.bmcl.2004.01.045 BindingDB Entry DOI: 10.7270/Q2ZW1KB5
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