BindingDB logo
myBDB logout

BDBM50382167 CHEMBL2023826

SMILES: C(N1CCN(CC1)c1ccc(cc1)C(c1ccccc1)C12CC3CC(CC(C3)C1)C2)c1ccccc1

InChI Key: InChIKey=WSPLMIUNFMARHE-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 = 50382167   
Target/Host
(Institution)		LigandTarget/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		pHTemp
°C
Sigma non-opioid intracellular receptor 1


(Homo sapiens (Human))		BDBM50382167
PNG
(CHEMBL2023826)
Show SMILES C(N1CCN(CC1)c1ccc(cc1)C(c1ccccc1)C12CC3CC(CC(C3)C1)C2)c1ccccc1 |TLB:13:20:23.22.27:25,THB:21:22:25:29.20.28,21:20:23.22.27:25,28:20:23:27.26.25,28:26:23:29.21.20,13:20:23:27.26.25|
Show InChI InChI=1S/C34H40N2/c1-3-7-26(8-4-1)25-35-15-17-36(18-16-35)32-13-11-31(12-14-32)33(30-9-5-2-6-10-30)34-22-27-19-28(23-34)21-29(20-27)24-34/h1-14,27-29,33H,15-25H2
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars
Article
PubMed
n/an/a 63.3n/an/an/an/an/an/a



National and Kapodistrian University of Athens

Curated by ChEMBL


Assay Description
Displacement of [3H](+)pentazocine from sigma-1 receptor expressed in human Jurkat cell membranes after 2 hrs by liquid scintillation spectroscopy

Bioorg Med Chem 20: 3323-31 (2012)


Article DOI: 10.1016/j.bmc.2012.03.038
BindingDB Entry DOI: 10.7270/Q20V8DT0
More data for this
Ligand-Target Pair