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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Metabotropic glutamate receptor 1' and Ligand = 'BDBM50109658'   
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
Metabotropic glutamate receptor 1


(RAT)		BDBM50109658
PNG
(2-Amino-3-(3-hydroxy-4-phenethyl-isoxazol-5-yl)-pr...)
Show SMILES N[C@@H](Cc1o[nH]c(=O)c1CCc1ccccc1)C(O)=O
Show InChI InChI=1S/C14H16N2O4/c15-11(14(18)19)8-12-10(13(17)16-20-12)7-6-9-4-2-1-3-5-9/h1-5,11H,6-8,15H2,(H,16,17)(H,18,19)/t11-/m0/s1
PDB

UniProtKB/SwissProt

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AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars
PubMed
 9.20E+4n/an/an/an/an/an/an/an/a



The Royal Danish School of Pharmacy

Curated by ChEMBL


Assay Description
The compound was tested for the receptor binding affinity at Metabotropic glutamate receptor 1 using established second messenger assay systems.

J Med Chem 45: 988-91 (2002)


BindingDB Entry DOI: 10.7270/Q2M32V27
More data for this
Ligand-Target Pair