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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Sodium- and chloride-dependent glycine transporter 1' and Ligand = 'BDBM50423231'   
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))
BDBM50423231
PNG
(CHEMBL238953)
Show SMILES O[C@@H](CNS(=O)(=O)c1cccc2ccccc12)CN1CCCC1C1CCCCC1
Show InChI InChI=1S/C23H32N2O3S/c26-20(17-25-15-7-13-22(25)19-9-2-1-3-10-19)16-24-29(27,28)23-14-6-11-18-8-4-5-12-21(18)23/h4-6,8,11-12,14,19-20,22,24,26H,1-3,7,9-10,13,15-17H2/t20-,22?/m0/s1
PDB

KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 6.31E+3n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Inhibition of [3H]glycine uptake in human GlyT1c expressed in HEK293 cells


Bioorg Med Chem Lett 17: 1741-5 (2007)


Article DOI: 10.1016/j.bmcl.2006.12.063
BindingDB Entry DOI: 10.7270/Q29W0GSG
More data for this
Ligand-Target Pair
Sodium- and chloride-dependent glycine transporter 1


(Homo sapiens (Human))
BDBM50423231
PNG
(CHEMBL238953)
Show SMILES O[C@@H](CNS(=O)(=O)c1cccc2ccccc12)CN1CCCC1C1CCCCC1
Show InChI InChI=1S/C23H32N2O3S/c26-20(17-25-15-7-13-22(25)19-9-2-1-3-10-19)16-24-29(27,28)23-14-6-11-18-8-4-5-12-21(18)23/h4-6,8,11-12,14,19-20,22,24,26H,1-3,7,9-10,13,15-17H2/t20-,22?/m0/s1
PDB

KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 6.31E+3n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Inhibition of [3H]glycine uptake in human GlyT1c expressed in HEK293 cells


Bioorg Med Chem Lett 17: 1741-5 (2007)


Article DOI: 10.1016/j.bmcl.2006.12.063
BindingDB Entry DOI: 10.7270/Q29W0GSG
More data for this
Ligand-Target Pair