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BDBM50321807 (R)-1-benzyl-6',7'-dihydrospiro[piperidine-4,4'-thieno[3,2-c]pyran]-6'-carboxamide::CHEMBL1169739

SMILES: NC(=O)[C@H]1Cc2sccc2C2(CCN(Cc3ccccc3)CC2)O1

InChI Key: InChIKey=UGWBPJCGWLMJQZ-MRXNPFEDSA-N

Data: 2 KI

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50321807   
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


(Cavia porcellus (Guinea pig))
BDBM50321807
PNG
((R)-1-benzyl-6',7'-dihydrospiro[piperidine-4,4'-th...)
Show SMILES NC(=O)[C@H]1Cc2sccc2C2(CCN(Cc3ccccc3)CC2)O1 |r|
Show InChI InChI=1S/C19H22N2O2S/c20-18(22)16-12-17-15(6-11-24-17)19(23-16)7-9-21(10-8-19)13-14-4-2-1-3-5-14/h1-6,11,16H,7-10,12-13H2,(H2,20,22)/t16-/m1/s1
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
350n/an/an/an/an/an/an/an/a



Institut f£r Pharmazeutische und Medizinische Chemie der Universit£t M£nster

Curated by ChEMBL


Assay Description
Displacement of [3H]-(+)pentazocine from guinea pig brain sigma 1-type opioid receptor after 120 mins by scintillation counting analysis


J Med Chem 55: 5350-60 (2012)


Article DOI: 10.1021/jm300302p
BindingDB Entry DOI: 10.7270/Q2VX0HMZ
More data for this
Ligand-Target Pair
Sigma non-opioid intracellular receptor 1


(Cavia porcellus (Guinea pig))
BDBM50321807
PNG
((R)-1-benzyl-6',7'-dihydrospiro[piperidine-4,4'-th...)
Show SMILES NC(=O)[C@H]1Cc2sccc2C2(CCN(Cc3ccccc3)CC2)O1 |r|
Show InChI InChI=1S/C19H22N2O2S/c20-18(22)16-12-17-15(6-11-24-17)19(23-16)7-9-21(10-8-19)13-14-4-2-1-3-5-14/h1-6,11,16H,7-10,12-13H2,(H2,20,22)/t16-/m1/s1
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
350n/an/an/an/an/an/an/an/a



Institut f£r Pharmazeutische und Medizinische Chemie der Universit£t M£nster

Curated by ChEMBL


Assay Description
Displacement of [3H]-(+)-pentazocine from sigma 1 receptor in guinea pig brain membrane


Eur J Med Chem 45: 3116-24 (2010)


Article DOI: 10.1016/j.ejmech.2010.03.048
BindingDB Entry DOI: 10.7270/Q2XD11V4
More data for this
Ligand-Target Pair