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Compile Data Set for Download or QSAR

Found 3 hits Enz. Inhib. hit(s) with all data for entry = 50037415   
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 8


(Homo sapiens (Human))
BDBM50004051
PNG
(2-Amino-4-phosphono-butyric acid | 2-Amino-4-phosp...)
Show SMILES NC(CCP(O)(O)=O)C(O)=O
Show InChI InChI=1S/C4H10NO5P/c5-3(4(6)7)1-2-11(8,9)10/h3H,1-2,5H2,(H,6,7)(H2,8,9,10)
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UniProtKB/SwissProt

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CHEMBL
MCE
PC cid
PC sid
PDB
UniChem

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PDB
Article
PubMed
n/an/a 5.10n/an/an/an/an/an/a



Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Inhibitory concentration against [3H]1 binding to recombinant human Metabotropic glutamate receptor 8


Bioorg Med Chem Lett 15: 349-51 (2004)


Article DOI: 10.1016/j.bmcl.2004.10.093
BindingDB Entry DOI: 10.7270/Q2G161M2
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Metabotropic glutamate receptor 8


(Homo sapiens (Human))
BDBM17657
PNG
((2S)-2-aminopentanedioic acid | (S)-Glu | D-Glutam...)
Show SMILES N[C@@H](CCC(O)=O)C(O)=O
Show InChI InChI=1S/C5H9NO4/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H,7,8)(H,9,10)/t3-/m0/s1
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antibodypedia
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DrugBank
MCE
KEGG
MMDB
PC cid
PC sid
PDB
UniChem

Patents


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Article
PubMed
n/an/a 5.70n/an/an/an/an/an/a



Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Inhibitory concentration against [3H]1 binding to recombinant human Metabotropic glutamate receptor 8


Bioorg Med Chem Lett 15: 349-51 (2004)


Article DOI: 10.1016/j.bmcl.2004.10.093
BindingDB Entry DOI: 10.7270/Q2G161M2
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 8


(Homo sapiens (Human))
BDBM50157910
PNG
((2S,3R)-2-((S)-Amino-carboxy-methyl)-3-hydroxymeth...)
Show SMILES N[C@@H]([C@H]1[C@@H](CO)C1C(O)=O)C(O)=O
Show InChI InChI=1S/C7H11NO5/c8-5(7(12)13)3-2(1-9)4(3)6(10)11/h2-5,9H,1,8H2,(H,10,11)(H,12,13)/t2-,3+,4?,5+/m1/s1
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/a 6.30n/an/an/an/an/a



Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Dissociation constant of radiolabeled compound against recombinant human Metabotropic glutamate receptor 8


Bioorg Med Chem Lett 15: 349-51 (2004)


Article DOI: 10.1016/j.bmcl.2004.10.093
BindingDB Entry DOI: 10.7270/Q2G161M2
More data for this
Ligand-Target Pair