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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Excitatory amino acid transporter 1' and Monomerid = 50328518   
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
Excitatory amino acid transporter 1


(Homo sapiens (Human))
BDBM50328518
PNG
(CHEMBL1259081 | syn-2-amino-5-oxo-4,7-diphenyl-5,6...)
Show SMILES N=C1OC2=C([C@@H](C1C#N)c1ccccc1)C(=O)N[C@H](C2)c1ccccc1
Show InChI InChI=1/C21H17N3O2/c22-12-15-18(14-9-5-2-6-10-14)19-17(26-20(15)23)11-16(24-21(19)25)13-7-3-1-4-8-13/h1-10,15-16,18,23H,11H2,(H,24,25)/t15?,16-,18-/s2
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a>3.00E+5n/an/an/an/an/an/a



University of Copenhagen

Curated by ChEMBL


Assay Description
Inhibition of human EAAT1 expressed in HEK293 cells assessed as inhibition of 3[H]-D-Aspartate uptake after 6 mins by scintillation counting method


J Med Chem 55: 5403-12 (2012)


Article DOI: 10.1021/jm300345z
BindingDB Entry DOI: 10.7270/Q2Q81F5W
More data for this
Ligand-Target Pair
Excitatory amino acid transporter 1


(Homo sapiens (Human))
BDBM50328518
PNG
(CHEMBL1259081 | syn-2-amino-5-oxo-4,7-diphenyl-5,6...)
Show SMILES N=C1OC2=C([C@@H](C1C#N)c1ccccc1)C(=O)N[C@H](C2)c1ccccc1
Show InChI InChI=1/C21H17N3O2/c22-12-15-18(14-9-5-2-6-10-14)19-17(26-20(15)23)11-16(24-21(19)25)13-7-3-1-4-8-13/h1-10,15-16,18,23H,11H2,(H,24,25)/t15?,16-,18-/s2
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a>3.00E+5n/an/an/an/an/an/a



University of Copenhagen

Curated by ChEMBL


Assay Description
Inhibition of human EAAT1 expressed in HEK293 cells by [3H]D-Asp uptake assay


J Med Chem 53: 7180-91 (2010)


Article DOI: 10.1021/jm1009154
BindingDB Entry DOI: 10.7270/Q2VM4CGX
More data for this
Ligand-Target Pair