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BDBM50464238 CHEMBL4287695

SMILES: O=S(=O)(N1CCN(CC1)c1ccccc1)c1ccc2OCOc2c1

InChI Key: InChIKey=UUQPVOSOSQITKE-UHFFFAOYSA-N

Data: 1 EC50

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   Substructure
Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50464238   
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
Glycine receptor alpha-3/beta


(Homo sapiens (Human))
BDBM50464238
PNG
(CHEMBL4287695)
Show SMILES O=S(=O)(N1CCN(CC1)c1ccccc1)c1ccc2OCOc2c1
Show InChI InChI=1S/C17H18N2O4S/c20-24(21,15-6-7-16-17(12-15)23-13-22-16)19-10-8-18(9-11-19)14-4-2-1-3-5-14/h1-7,12H,8-11,13H2
PDB

UniProtKB/SwissProt

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PC cid
PC sid
UniChem
Article
PubMed
n/an/an/an/a>2.00E+4n/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Positive allosteric modulation of human GlyRalpha3beta expressed in HEK293T cells assessed as increase in glycine-induced chloride ion flux measured ...


Eur J Med Chem 137: 63-75 (2017)


Article DOI: 10.1016/j.ejmech.2017.05.036
BindingDB Entry DOI: 10.7270/Q2H134PC
More data for this
Ligand-Target Pair