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BDBM50260564 CHEMBL4101921

SMILES: C(CN1CCCN(Cc2ccccc2)[C@@H](Cc2ccccc2)C1)Cc1ccccc1

InChI Key: InChIKey=OEDKVALKSDLTND-NDEPHWFRSA-N

Data: 2 KI

Find this compound or compounds like it in BindingDB or PDB:
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Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50260564   
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-1 receptor


(Cavia porcellus (Guinea pig))
BDBM50260564
PNG
(CHEMBL4101921)
Show SMILES C(CN1CCCN(Cc2ccccc2)[C@@H](Cc2ccccc2)C1)Cc1ccccc1 |r|
Show InChI InChI=1S/C28H34N2/c1-4-12-25(13-5-1)18-10-19-29-20-11-21-30(23-27-16-8-3-9-17-27)28(24-29)22-26-14-6-2-7-15-26/h1-9,12-17,28H,10-11,18-24H2/t28-/m0/s1
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

Article
PubMed
73n/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 sigma1 receptor in guinea pig brain membranes after 120 mins by liquid scintillation counting


Bioorg Med Chem 25: 4778-4799 (2017)


Article DOI: 10.1016/j.bmc.2017.07.027
BindingDB Entry DOI: 10.7270/Q26M3984
More data for this
Ligand-Target Pair
Sigma-2 receptor


(Rattus norvegicus (Rat))
BDBM50260564
PNG
(CHEMBL4101921)
Show SMILES C(CN1CCCN(Cc2ccccc2)[C@@H](Cc2ccccc2)C1)Cc1ccccc1 |r|
Show InChI InChI=1S/C28H34N2/c1-4-12-25(13-5-1)18-10-19-29-20-11-21-30(23-27-16-8-3-9-17-27)28(24-29)22-26-14-6-2-7-15-26/h1-9,12-17,28H,10-11,18-24H2/t28-/m0/s1
UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

Article
PubMed
193n/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]-DTG from sigma2 receptor in rat liver membranes in presence of (+)-pentazocine


Bioorg Med Chem 25: 4778-4799 (2017)


Article DOI: 10.1016/j.bmc.2017.07.027
BindingDB Entry DOI: 10.7270/Q26M3984
More data for this
Ligand-Target Pair