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BDBM50129228 1-(3-Methoxy-propyl)-3,5-dimethyl-1H-pyrrole-2,4-dicarboxylic acid 4-tert-butyl ester 2-propyl ester::CHEMBL68305

SMILES: CCCOC(=O)c1c(C)c(C(=O)OC(C)(C)C)c(C)n1CCCO

InChI Key: InChIKey=LYXBRBRIEZRLIX-UHFFFAOYSA-N

Data: 1 IC50

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Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50129228   
Target/Host
(Institution)		LigandTarget/Host
Links		Ligand
Links		Trg + Lig
Links		Ki
nM		ΔG°
kcal/mole		IC50
nM		Kd
nM		EC50/IC50
nM		koff
s-1		kon
M-1s-1		pHTemp
°C
Metabotropic glutamate receptor


(RAT)		BDBM50129228
PNG
(1-(3-Methoxy-propyl)-3,5-dimethyl-1H-pyrrole-2,4-d...)
Show SMILES CCCOC(=O)c1c(C)c(C(=O)OC(C)(C)C)c(C)n1CCCO
Show InChI InChI=1S/C18H29NO5/c1-7-11-23-17(22)15-12(2)14(16(21)24-18(4,5)6)13(3)19(15)9-8-10-20/h20H,7-11H2,1-6H3
PDB

UniProtKB/SwissProt

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AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars
PubMed
n/an/a 5.80E+3n/an/an/an/an/an/a



GlaxoSmithKline Medicine Research Centre

Curated by ChEMBL


Assay Description
In vitro inhibition of rat metabotropic glutamate receptor 1 in CHO cells using the CDP-DAG accumulation method.

Bioorg Med Chem Lett 13: 2113-8 (2003)


BindingDB Entry DOI: 10.7270/Q2PN9519
More data for this
Ligand-Target Pair