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SMILES: Cc1ccc(cc1)-n1ccc2c(sc3ncnc(NC4CC4)c23)c1=O

InChI Key: InChIKey=IZXQPAIBAFLWPA-UHFFFAOYSA-N

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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50364718   
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 1


(RAT)
BDBM50364718
PNG
(CHEMBL1951890)
Show SMILES Cc1ccc(cc1)-n1ccc2c(sc3ncnc(NC4CC4)c23)c1=O
Show InChI InChI=1S/C19H16N4OS/c1-11-2-6-13(7-3-11)23-9-8-14-15-17(22-12-4-5-12)20-10-21-18(15)25-16(14)19(23)24/h2-3,6-10,12H,4-5H2,1H3,(H,20,21,22)
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
22n/an/an/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Antagonist activity at rat metabotropic glutamate receptor 1


Bioorg Med Chem Lett 22: 1575-8 (2012)


Article DOI: 10.1016/j.bmcl.2011.12.131
BindingDB Entry DOI: 10.7270/Q2F19063
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 1


(Homo sapiens (Human))
BDBM50364718
PNG
(CHEMBL1951890)
Show SMILES Cc1ccc(cc1)-n1ccc2c(sc3ncnc(NC4CC4)c23)c1=O
Show InChI InChI=1S/C19H16N4OS/c1-11-2-6-13(7-3-11)23-9-8-14-15-17(22-12-4-5-12)20-10-21-18(15)25-16(14)19(23)24/h2-3,6-10,12H,4-5H2,1H3,(H,20,21,22)
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/a 12n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Antagonist activity at human metabotropic glutamate receptor 1


Bioorg Med Chem Lett 22: 1575-8 (2012)


Article DOI: 10.1016/j.bmcl.2011.12.131
BindingDB Entry DOI: 10.7270/Q2F19063
More data for this
Ligand-Target Pair