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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 = 'BDBM162236'   
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))
BDBM162236
PNG
(US9051280, 194)
Show SMILES Cn1cnc(c1)S(=O)(=O)NCCOc1ccc2CC[C@@H](CN)[C@@H](Cc3ccccc3)c2c1 |r|
Show InChI InChI=1S/C24H30N4O3S/c1-28-16-24(26-17-28)32(29,30)27-11-12-31-21-10-9-19-7-8-20(15-25)22(23(19)14-21)13-18-5-3-2-4-6-18/h2-6,9-10,14,16-17,20,22,27H,7-8,11-13,15,25H2,1H3/t20-,22+/m0/s1
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Similars

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



AbbVie Deutschland GmbH & Co. KG; AbbVie Inc.

US Patent


Assay Description
Radioligand binding to human GlyT1c transporter-expressing membranes was determined as described in Mezler et al., Molecular Pharmacology 74:1705-171...


US Patent US9051280 (2015)


BindingDB Entry DOI: 10.7270/Q2930RXN
More data for this
Ligand-Target Pair