BindingDB logo
myBDB logout

PubMed code 20338757

Compile data set for download or QSAR
Found 6 hits of Enzyme Inhibition Constant Data   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Sigma non-opioid intracellular receptor 1


(RAT)
BDBM50315831
PNG
(1-(3-Phenylpropyl)-4-(3-pyridyl)piperazine | CHEMB...)
Show SMILES C(CN1CCN(CC1)c1cccnc1)Cc1ccccc1
Show InChI InChI=1S/C18H23N3/c1-2-6-17(7-3-1)8-5-11-20-12-14-21(15-13-20)18-9-4-10-19-16-18/h1-4,6-7,9-10,16H,5,8,11-15H2
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
21n/an/an/an/an/an/an/an/a



University of Maryland

Curated by ChEMBL


Assay Description
Displacement of [3H](+)-pentazocin from rat brain membrane sigma 1receptor after 120 mins


Bioorg Med Chem Lett 20: 2564-5 (2010)


Article DOI: 10.1016/j.bmcl.2010.02.087
BindingDB Entry DOI: 10.7270/Q2833S6G
More data for this
Ligand-Target Pair
Sigma non-opioid intracellular receptor 1


(RAT)
BDBM50315829
PNG
(1-(3-Phenylpropyl)-4-(4-pyridyl)piperazine | CHEMB...)
Show SMILES C(CN1CCN(CC1)c1ccncc1)Cc1ccccc1
Show InChI InChI=1S/C18H23N3/c1-2-5-17(6-3-1)7-4-12-20-13-15-21(16-14-20)18-8-10-19-11-9-18/h1-3,5-6,8-11H,4,7,12-16H2
PDB

UniProtKB/SwissProt

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



University of Maryland

Curated by ChEMBL


Assay Description
Displacement of [3H](+)-pentazocin from rat brain membrane sigma 1receptor after 120 mins


Bioorg Med Chem Lett 20: 2564-5 (2010)


Article DOI: 10.1016/j.bmcl.2010.02.087
BindingDB Entry DOI: 10.7270/Q2833S6G
More data for this
Ligand-Target Pair
Sigma non-opioid intracellular receptor 1


(RAT)
BDBM50315828
PNG
(1-(2-Phenylethyl)-4-(4-pyridyl)piperazine | CHEMBL...)
Show SMILES C(Cc1ccccc1)N1CCN(CC1)c1ccncc1
Show InChI InChI=1S/C17H21N3/c1-2-4-16(5-3-1)8-11-19-12-14-20(15-13-19)17-6-9-18-10-7-17/h1-7,9-10H,8,11-15H2
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
42n/an/an/an/an/an/an/an/a



University of Maryland

Curated by ChEMBL


Assay Description
Displacement of [3H](+)-pentazocin from rat brain membrane sigma 1receptor after 120 mins


Bioorg Med Chem Lett 20: 2564-5 (2010)


Article DOI: 10.1016/j.bmcl.2010.02.087
BindingDB Entry DOI: 10.7270/Q2833S6G
More data for this
Ligand-Target Pair
Sigma non-opioid intracellular receptor 1


(RAT)
BDBM50109383
PNG
(1-(3-Phenyl-propyl)-4-pyridin-2-yl-piperazine | 1-...)
Show SMILES C(CN1CCN(CC1)c1ccccn1)Cc1ccccc1
Show InChI InChI=1S/C18H23N3/c1-2-7-17(8-3-1)9-6-12-20-13-15-21(16-14-20)18-10-4-5-11-19-18/h1-5,7-8,10-11H,6,9,12-16H2
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
Purchase

CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
83n/an/an/an/an/an/an/an/a



University of Maryland

Curated by ChEMBL


Assay Description
Displacement of [3H](+)-pentazocin from rat brain membrane sigma 1receptor after 120 mins


Bioorg Med Chem Lett 20: 2564-5 (2010)


Article DOI: 10.1016/j.bmcl.2010.02.087
BindingDB Entry DOI: 10.7270/Q2833S6G
More data for this
Ligand-Target Pair
Sigma non-opioid intracellular receptor 1


(RAT)
BDBM50315830
PNG
(1-(2-Phenylethyl)-4-(3-pyridyl)piperazine | CHEMBL...)
Show SMILES C(Cc1ccccc1)N1CCN(CC1)c1cccnc1
Show InChI InChI=1S/C17H21N3/c1-2-5-16(6-3-1)8-10-19-11-13-20(14-12-19)17-7-4-9-18-15-17/h1-7,9,15H,8,10-14H2
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
Purchase

CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
97n/an/an/an/an/an/an/an/a



University of Maryland

Curated by ChEMBL


Assay Description
Displacement of [3H](+)-pentazocin from rat brain membrane sigma 1receptor after 120 mins


Bioorg Med Chem Lett 20: 2564-5 (2010)


Article DOI: 10.1016/j.bmcl.2010.02.087
BindingDB Entry DOI: 10.7270/Q2833S6G
More data for this
Ligand-Target Pair
Sigma non-opioid intracellular receptor 1


(RAT)
BDBM50109388
PNG
(1-(2-phenylethyl)-4-(2-pyridyl)piperazine | 1-Phen...)
Show SMILES C(Cc1ccccc1)N1CCN(CC1)c1ccccn1
Show InChI InChI=1S/C17H21N3/c1-2-6-16(7-3-1)9-11-19-12-14-20(15-13-19)17-8-4-5-10-18-17/h1-8,10H,9,11-15H2
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
Purchase

CHEMBL
PC cid
PC sid
UniChem

Patents

Article
PubMed
326n/an/an/an/an/an/an/an/a



University of Maryland

Curated by ChEMBL


Assay Description
Displacement of [3H](+)-pentazocin from rat brain membrane sigma 1receptor after 120 mins


Bioorg Med Chem Lett 20: 2564-5 (2010)


Article DOI: 10.1016/j.bmcl.2010.02.087
BindingDB Entry DOI: 10.7270/Q2833S6G
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%