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SMILES: CCCCN(CC1CCN(Cc2ccc(Cl)cc2)CC1)C(C)=O

InChI Key: InChIKey=FABQVDQZHZCIOK-UHFFFAOYSA-N

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 = 50466984   
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


(RAT)
BDBM50466984
PNG
(CHEMBL4284597)
Show SMILES CCCCN(CC1CCN(Cc2ccc(Cl)cc2)CC1)C(C)=O
Show InChI InChI=1S/C19H29ClN2O/c1-3-4-11-22(16(2)23)15-18-9-12-21(13-10-18)14-17-5-7-19(20)8-6-17/h5-8,18H,3-4,9-15H2,1-2H3
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
34n/an/an/an/an/an/an/an/a



University of Trieste

Curated by ChEMBL


Assay Description
Displacement of [3H]-(+)-pentazocine from sigma1 receptor in rat liver membranes after 120 mins by liquid scintillation counting


Bioorg Med Chem Lett 28: 3206-3209 (2018)


Article DOI: 10.1016/j.bmcl.2018.08.016
BindingDB Entry DOI: 10.7270/Q2QN69FH
More data for this
Ligand-Target Pair
Sigma intracellular receptor 2


(Rattus norvegicus (Rat))
BDBM50466984
PNG
(CHEMBL4284597)
Show SMILES CCCCN(CC1CCN(Cc2ccc(Cl)cc2)CC1)C(C)=O
Show InChI InChI=1S/C19H29ClN2O/c1-3-4-11-22(16(2)23)15-18-9-12-21(13-10-18)14-17-5-7-19(20)8-6-17/h5-8,18H,3-4,9-15H2,1-2H3
UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
1.38E+3n/an/an/an/an/an/an/an/a



University of Trieste

Curated by ChEMBL


Assay Description
Displacement of [3H]-DTG from sigma2 receptor in rat liver membranes after 120 mins by liquid scintillation counting


Bioorg Med Chem Lett 28: 3206-3209 (2018)


Article DOI: 10.1016/j.bmcl.2018.08.016
BindingDB Entry DOI: 10.7270/Q2QN69FH
More data for this
Ligand-Target Pair