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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 1' and Ligand = 'BDBM133262'   
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 1


(Homo sapiens (Human))
BDBM133262
PNG
(US8846741, 9)
Show SMILES O=S(=O)(CC1CC1)NCc1ccc2CCC(NC3(COC3)C#N)C(Cc3ccccc3)c2c1
Show InChI InChI=1S/C26H31N3O3S/c27-16-26(17-32-18-26)29-25-11-10-22-9-8-21(14-28-33(30,31)15-20-6-7-20)13-23(22)24(25)12-19-4-2-1-3-5-19/h1-5,8-9,13,20,24-25,28-29H,6-7,10-12,14-15,17-18H2
PDB

KEGG

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PC cid
PC sid
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Similars

US Patent
<100n/an/an/an/an/an/an/an/a



AbbVie Inc.; AbbVie Deutschland GmbH & Co. KG

US Patent


Assay Description
Radioligand Binding Assays Using Recombinant CHO Cell Membranes Expressing Human GlyT1:Radioligand binding to human GlyT1c transporter-expressing mem...


US Patent US8846741 (2014)


BindingDB Entry DOI: 10.7270/Q23T9FW8
More data for this
Ligand-Target Pair