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BDBM50331310 (+/-)-4-(7-Benzyloxy-1-hydroxy-2,3,4,5-tetrahydro-1H-3-benzazepin-3-yl)-1-(4-methoxyphenyl)butan-1-one::CHEMBL1289287

SMILES: COc1ccc(cc1)C(=O)CCCN1CCc2cc(OCc3ccccc3)ccc2C(O)C1

InChI Key: InChIKey=OYLYZHZQJGNNIP-UHFFFAOYSA-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 = 50331310   
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))
BDBM50331310
PNG
((+/-)-4-(7-Benzyloxy-1-hydroxy-2,3,4,5-tetrahydro-...)
Show SMILES COc1ccc(cc1)C(=O)CCCN1CCc2cc(OCc3ccccc3)ccc2C(O)C1
Show InChI InChI=1S/C28H31NO4/c1-32-24-11-9-22(10-12-24)27(30)8-5-16-29-17-15-23-18-25(13-14-26(23)28(31)19-29)33-20-21-6-3-2-4-7-21/h2-4,6-7,9-14,18,28,31H,5,8,15-17,19-20H2,1H3
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
>1.00E+3n/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))
BDBM50331310
PNG
((+/-)-4-(7-Benzyloxy-1-hydroxy-2,3,4,5-tetrahydro-...)
Show SMILES COc1ccc(cc1)C(=O)CCCN1CCc2cc(OCc3ccccc3)ccc2C(O)C1
Show InChI InChI=1S/C28H31NO4/c1-32-24-11-9-22(10-12-24)27(30)8-5-16-29-17-15-23-18-25(13-14-26(23)28(31)19-29)33-20-21-6-3-2-4-7-21/h2-4,6-7,9-14,18,28,31H,5,8,15-17,19-20H2,1H3
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
>1.00E+3n/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