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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Sodium- and chloride-dependent glycine transporter 2' and Ligand = 'BDBM50195177'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Sodium- and chloride-dependent glycine transporter 2


(Homo sapiens (Human))
BDBM50195177
PNG
(CHEMBL373556 | N-((4-(morpholine-4-carbonyl)-1-(pr...)
Show SMILES CCCS(=O)(=O)N1CCC(CNC(=O)CC)(CC1)C(=O)N1CCOCC1
Show InChI InChI=1S/C17H31N3O5S/c1-3-13-26(23,24)20-7-5-17(6-8-20,14-18-15(21)4-2)16(22)19-9-11-25-12-10-19/h3-14H2,1-2H3,(H,18,21)
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PC cid
PC sid
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Similars

Article
PubMed
n/an/a>3.00E+4n/an/an/an/an/an/a



Merck and Co.

Curated by ChEMBL


Assay Description
Inhibition of human GlyT2


Bioorg Med Chem Lett 16: 5968-72 (2006)


Article DOI: 10.1016/j.bmcl.2006.08.131
BindingDB Entry DOI: 10.7270/Q2C82B31
More data for this
Ligand-Target Pair