BindingDB logo
myBDB logout

null

SMILES: O=C(Nc1nc(cs1)C#N)c1cc(Oc2cccnc2)ccn1

InChI Key: InChIKey=VMWCCEATIPEOHE-UHFFFAOYSA-N

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 107243   
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 5


(Rattus norvegicus (Rat))		BDBM107243
PNG
(US8598345, Table 1-29)
Show SMILES O=C(Nc1nc(cs1)C#N)c1cc(Oc2cccnc2)ccn1
Show InChI InChI=1S/C15H9N5O2S/c16-7-10-9-23-15(19-10)20-14(21)13-6-11(3-5-18-13)22-12-2-1-4-17-8-12/h1-6,8-9H,(H,19,20,21)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars
US Patent
n/an/a 2.64E+3n/an/an/an/an/an/a



Vanderbilt University

US Patent


Assay Description
mGluR5 activity was determined in a cell-based assay.

US Patent US8598345 (2013)


BindingDB Entry DOI: 10.7270/Q2RR1WX8
More data for this
Ligand-Target Pair