BDBM50188124 1-(2-(2-ethoxyphenyl)-1-(3-fluorophenyl)ethyl)piperazine::CHEMBL214395

SMILES: CCOc1ccccc1CC(N1CCNCC1)c1cccc(F)c1

InChI Key: InChIKey=QXDADQKWVQYGSQ-UHFFFAOYSA-N

Data: 2 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 2 hits for monomerid = 50188124   

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
Sodium-dependent noradrenaline transporter (Homo sapiens (Human))	BDBM50188124 (1-(2-(2-ethoxyphenyl)-1-(3-fluorophenyl)ethyl)pipe...) Show SMILES CCOc1ccccc1CC(N1CCNCC1)c1cccc(F)c1 Show InChI InChI=1S/C20H25FN2O/c1-2-24-20-9-4-3-6-17(20)15-19(23-12-10-22-11-13-23)16-7-5-8-18(21)14-16/h3-9,14,19,22H,2,10-13,15H2,1H3	Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	22	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Global Research and Development Curated by ChEMBL					Assay Description Inhibition of [3H]NA reuptake at NA transporter in HEK293 cells				Bioorg Med Chem Lett 16: 4349-53 (2006) Article DOI: 10.1016/j.bmcl.2006.05.049 BindingDB Entry DOI: 10.7270/Q2SQ916H
					More data for this Ligand-Target Pair
Sodium-dependent serotonin transporter (Homo sapiens (Human))	BDBM50188124 (1-(2-(2-ethoxyphenyl)-1-(3-fluorophenyl)ethyl)pipe...) Show SMILES CCOc1ccccc1CC(N1CCNCC1)c1cccc(F)c1 Show InChI InChI=1S/C20H25FN2O/c1-2-24-20-9-4-3-6-17(20)15-19(23-12-10-22-11-13-23)16-7-5-8-18(21)14-16/h3-9,14,19,22H,2,10-13,15H2,1H3	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	28	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Global Research and Development Curated by ChEMBL					Assay Description Inhibition of [3H]5-HT reuptake at 5HT transporter in HEK293 cells				Bioorg Med Chem Lett 16: 4349-53 (2006) Article DOI: 10.1016/j.bmcl.2006.05.049 BindingDB Entry DOI: 10.7270/Q2SQ916H
					More data for this Ligand-Target Pair