BDBM50324089 CHEMBL1214958::N-(Benzofuran-2-ylmethyl)-N'-(3'-(2''-fluoroethoxy)benzyl)-piperazine

SMILES: FCCOc1cccc(CN2CCN(Cc3cc4ccccc4o3)CC2)c1

InChI Key: InChIKey=YCXKREHMDGDOCM-UHFFFAOYSA-N

Data: 4 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 4 hits for monomerid = 50324089   

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
Sigma non-opioid intracellular receptor 1 (RAT)	BDBM50324089 (CHEMBL1214958 | N-(Benzofuran-2-ylmethyl)-N'-(3'-(...) Show SMILES FCCOc1cccc(CN2CCN(Cc3cc4ccccc4o3)CC2)c1 Show InChI InChI=1S/C22H25FN2O2/c23-8-13-26-20-6-3-4-18(14-20)16-24-9-11-25(12-10-24)17-21-15-19-5-1-2-7-22(19)27-21/h1-7,14-15H,8-13,16-17H2	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	49.7	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Sydney Curated by ChEMBL					Assay Description Displacement of [3H]pentazocine from sigma1 receptor in rat brain homogenate				J Med Chem 53: 6228-39 (2010) Article DOI: 10.1021/jm100639f BindingDB Entry DOI: 10.7270/Q2V1250J
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 2B (Homo sapiens (Human))	BDBM50324089 (CHEMBL1214958 | N-(Benzofuran-2-ylmethyl)-N'-(3'-(...) Show SMILES FCCOc1cccc(CN2CCN(Cc3cc4ccccc4o3)CC2)c1 Show InChI InChI=1S/C22H25FN2O2/c23-8-13-26-20-6-3-4-18(14-20)16-24-9-11-25(12-10-24)17-21-15-19-5-1-2-7-22(19)27-21/h1-7,14-15H,8-13,16-17H2	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	244	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Sydney Curated by ChEMBL					Assay Description Binding affinity to 5HT2B				J Med Chem 53: 6228-39 (2010) Article DOI: 10.1021/jm100639f BindingDB Entry DOI: 10.7270/Q2V1250J
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 1A (Homo sapiens (Human))	BDBM50324089 (CHEMBL1214958 | N-(Benzofuran-2-ylmethyl)-N'-(3'-(...) Show SMILES FCCOc1cccc(CN2CCN(Cc3cc4ccccc4o3)CC2)c1 Show InChI InChI=1S/C22H25FN2O2/c23-8-13-26-20-6-3-4-18(14-20)16-24-9-11-25(12-10-24)17-21-15-19-5-1-2-7-22(19)27-21/h1-7,14-15H,8-13,16-17H2	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	469	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Sydney Curated by ChEMBL					Assay Description Binding affinity to 5HT1A				J Med Chem 53: 6228-39 (2010) Article DOI: 10.1021/jm100639f BindingDB Entry DOI: 10.7270/Q2V1250J
					More data for this Ligand-Target Pair
D(2) dopamine receptor (Homo sapiens (Human))	BDBM50324089 (CHEMBL1214958 | N-(Benzofuran-2-ylmethyl)-N'-(3'-(...) Show SMILES FCCOc1cccc(CN2CCN(Cc3cc4ccccc4o3)CC2)c1 Show InChI InChI=1S/C22H25FN2O2/c23-8-13-26-20-6-3-4-18(14-20)16-24-9-11-25(12-10-24)17-21-15-19-5-1-2-7-22(19)27-21/h1-7,14-15H,8-13,16-17H2	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	2.28E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Sydney Curated by ChEMBL					Assay Description Binding affinity to dopamine D2				J Med Chem 53: 6228-39 (2010) Article DOI: 10.1021/jm100639f BindingDB Entry DOI: 10.7270/Q2V1250J
					More data for this Ligand-Target Pair