BDBM50353283 CHEMBL1830687

SMILES: COc1cc(Br)cc(C(=O)NCCCN2CCN(CC2)C2CCCCC2)c1OC

InChI Key: InChIKey=WLGIYODPDVNPST-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 = 50353283   

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 (Cavia porcellus (Guinea pig))	BDBM50353283 (CHEMBL1830687) Show SMILES COc1cc(Br)cc(C(=O)NCCCN2CCN(CC2)C2CCCCC2)c1OC Show InChI InChI=1S/C22H34BrN3O3/c1-28-20-16-17(23)15-19(21(20)29-2)22(27)24-9-6-10-25-11-13-26(14-12-25)18-7-4-3-5-8-18/h15-16,18H,3-14H2,1-2H3,(H,24,27)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	25.8	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi di Bari ALDO MORO Curated by ChEMBL					Assay Description Displacement of [3H]-pentazocine from sigma 1 receptor in guinea pig brain after 30 mins by radioligand binding assay				Eur J Med Chem 46: 4733-41 (2011) Article DOI: 10.1016/j.ejmech.2011.05.057 BindingDB Entry DOI: 10.7270/Q2B56KQ5
					More data for this Ligand-Target Pair