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BDBM50331295 (+/-)-7-(benzyloxy)-3-(3-phenoxypropyl)-2,3,4,5-tetrahydro-1H-benzo[d]azepin-1-ol::CHEMBL1290052

SMILES: OC1CN(CCCOc2ccccc2)CCc2cc(OCc3ccccc3)ccc12

InChI Key: InChIKey=MUPLYZRZMPPYMK-UHFFFAOYSA-N

Data: 2 KI

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 = 50331295   
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
GluN1/GluN2B NMDA receptor


(Homo sapiens (Human))
BDBM50331295
PNG
((+/-)-7-(benzyloxy)-3-(3-phenoxypropyl)-2,3,4,5-te...)
Show SMILES OC1CN(CCCOc2ccccc2)CCc2cc(OCc3ccccc3)ccc12
Show InChI InChI=1S/C26H29NO3/c28-26-19-27(15-7-17-29-23-10-5-2-6-11-23)16-14-22-18-24(12-13-25(22)26)30-20-21-8-3-1-4-9-21/h1-6,8-13,18,26,28H,7,14-17,19-20H2
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
93n/an/an/an/an/an/an/an/a



Institut für Pharmazeutische und Medizinische Chemie der Westfälischen Wilhelms-Universität Münster

Curated by ChEMBL


Assay Description
Displacement of [3H]ifenprodil from human recombinant NR1-1a/NR2B receptor expressed in mouse L(tk-) cells after 120 mins by scintillation counting


Bioorg Med Chem 18: 8005-15 (2010)


Article DOI: 10.1016/j.bmc.2010.09.026
BindingDB Entry DOI: 10.7270/Q28W3DJB
More data for this
Ligand-Target Pair
Sigma non-opioid intracellular receptor 1


(Cavia porcellus (Guinea pig))
BDBM50331295
PNG
((+/-)-7-(benzyloxy)-3-(3-phenoxypropyl)-2,3,4,5-te...)
Show SMILES OC1CN(CCCOc2ccccc2)CCc2cc(OCc3ccccc3)ccc12
Show InChI InChI=1S/C26H29NO3/c28-26-19-27(15-7-17-29-23-10-5-2-6-11-23)16-14-22-18-24(12-13-25(22)26)30-20-21-8-3-1-4-9-21/h1-6,8-13,18,26,28H,7,14-17,19-20H2
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
193n/an/an/an/an/an/an/an/a



Institut für Pharmazeutische und Medizinische Chemie der Westfälischen Wilhelms-Universität Münster

Curated by ChEMBL


Assay Description
Displacement of [3H]-(+)-pentazocine from sigma1 receptor guinea pig brain after 180 mins scintillation counting


Bioorg Med Chem 18: 8005-15 (2010)


Article DOI: 10.1016/j.bmc.2010.09.026
BindingDB Entry DOI: 10.7270/Q28W3DJB
More data for this
Ligand-Target Pair