BDBM50384292 CHEMBL2030624

SMILES: COc1ccc(CN2C3CCC2CC3)cc1OC

InChI Key: InChIKey=MFKYGKXYJBKSQN-UHFFFAOYSA-N

Data: 3 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 3 hits for monomerid = 50384292   

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 (Homo sapiens (Human))	BDBM50384292 (CHEMBL2030624) Show SMILES COc1ccc(CN2C3CCC2CC3)cc1OC Show InChI InChI=1S/C15H21NO2/c1-17-14-8-3-11(9-15(14)18-2)10-16-12-4-5-13(16)7-6-12/h3,8-9,12-13H,4-7,10H2,1-2H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Washington University School of Medicine Curated by ChEMBL					Assay Description Binding affinity to sigma-1 opioid receptor (unknown origin)				J Med Chem 56: 7137-60 (2013) Article DOI: 10.1021/jm301545c BindingDB Entry DOI: 10.7270/Q22R3T54
					More data for this Ligand-Target Pair
Sodium-dependent serotonin transporter (Homo sapiens (Human))	BDBM50384292 (CHEMBL2030624) Show SMILES COc1ccc(CN2C3CCC2CC3)cc1OC Show InChI InChI=1S/C15H21NO2/c1-17-14-8-3-11(9-15(14)18-2)10-16-12-4-5-13(16)7-6-12/h3,8-9,12-13H,4-7,10H2,1-2H3	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
The University of Sydney Curated by ChEMBL					Assay Description Inhibition of SERT				Bioorg Med Chem Lett 22: 4059-63 (2012) Article DOI: 10.1016/j.bmcl.2012.04.077 BindingDB Entry DOI: 10.7270/Q2CF9R4T
					More data for this Ligand-Target Pair
D(2) dopamine receptor (Homo sapiens (Human))	BDBM50384292 (CHEMBL2030624) Show SMILES COc1ccc(CN2C3CCC2CC3)cc1OC Show InChI InChI=1S/C15H21NO2/c1-17-14-8-3-11(9-15(14)18-2)10-16-12-4-5-13(16)7-6-12/h3,8-9,12-13H,4-7,10H2,1-2H3	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
The University of Sydney Curated by ChEMBL					Assay Description Inhibition of D2 dopamine receptor				Bioorg Med Chem Lett 22: 4059-63 (2012) Article DOI: 10.1016/j.bmcl.2012.04.077 BindingDB Entry DOI: 10.7270/Q2CF9R4T
					More data for this Ligand-Target Pair