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Compile Data Set for Download or QSAR

Found 2 hits of ic50 for monomerid = 50537019   
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))
BDBM50537019
PNG
(CHEMBL4526987)
Show SMILES CCCCCCCC\C=C/CCCCCCCC(=O)N[C@@H](CCCC)C(O)=O |r|
Show InChI InChI=1S/C24H45NO3/c1-3-5-7-8-9-10-11-12-13-14-15-16-17-18-19-21-23(26)25-22(24(27)28)20-6-4-2/h12-13,22H,3-11,14-21H2,1-2H3,(H,25,26)(H,27,28)/b13-12-/t22-/m0/s1
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 259n/an/an/an/an/an/a



University of Sydney

Curated by ChEMBL


Assay Description
Inhibition of recombinant human GlyT2a expressed in Xenopus laevis oocytes assessed as reduction in channel current by two-electrode voltage clamp el...


J Med Chem 62: 2466-2484 (2019)


Article DOI: 10.1021/acs.jmedchem.8b01775
BindingDB Entry DOI: 10.7270/Q21R6V1K
More data for this
Ligand-Target Pair
Sodium- and chloride-dependent glycine transporter 1


(Homo sapiens (Human))
BDBM50537019
PNG
(CHEMBL4526987)
Show SMILES CCCCCCCC\C=C/CCCCCCCC(=O)N[C@@H](CCCC)C(O)=O |r|
Show InChI InChI=1S/C24H45NO3/c1-3-5-7-8-9-10-11-12-13-14-15-16-17-18-19-21-23(26)25-22(24(27)28)20-6-4-2/h12-13,22H,3-11,14-21H2,1-2H3,(H,25,26)(H,27,28)/b13-12-/t22-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a>1.00E+4n/an/an/an/an/an/a



University of Sydney

Curated by ChEMBL


Assay Description
Inhibition of recombinant human GlyT1b expressed in Xenopus laevis oocytes assessed as reduction in channel current by two-electrode voltage clamp el...


J Med Chem 62: 2466-2484 (2019)


Article DOI: 10.1021/acs.jmedchem.8b01775
BindingDB Entry DOI: 10.7270/Q21R6V1K
More data for this
Ligand-Target Pair