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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 = 'BDBM141199'   
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))
BDBM141199
PNG
(US8653100, 100)
Show SMILES Cn1cc(cn1)S(=O)(=O)NCc1ccc2CCNC(c2c1)C(C)(C)c1ccc(Cl)cc1
Show InChI InChI=1S/C23H27ClN4O2S/c1-23(2,18-6-8-19(24)9-7-18)22-21-12-16(4-5-17(21)10-11-25-22)13-27-31(29,30)20-14-26-28(3)15-20/h4-9,12,14-15,22,25,27H,10-11,13H2,1-3H3
PDB

KEGG

UniProtKB/SwissProt

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PC cid
PC sid
UniChem

Similars

US Patent
<100n/an/an/an/an/an/a7.5n/a



AbbVie Inc.; AbbVie Deutschland GmbH & Co. KG

US Patent


Assay Description
Radioligand binding to human GlyT1c transporter-expressing membranes was carried out as described in Mezler et al., Molecular Pharmacology 74:1705-17...


US Patent US8653100 (2014)


BindingDB Entry DOI: 10.7270/Q2JD4VH9
More data for this
Ligand-Target Pair