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BDBM50202128 CHEMBL247950::N-(4-chloro-2-((1,3-dioxoisoindolin-2-yl)methyl)phenyl)pyridazine-3-carboxamide

SMILES: Clc1ccc(NC(=O)c2cccnn2)c(CN2C(=O)c3ccccc3C2=O)c1

InChI Key: InChIKey=PHMXSCYSMAICDA-UHFFFAOYSA-N

Data: 2 EC50

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 2 hits for monomerid = 50202128   
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


(Homo sapiens (Human))
BDBM50202128
PNG
(CHEMBL247950 | N-(4-chloro-2-((1,3-dioxoisoindolin...)
Show SMILES Clc1ccc(NC(=O)c2cccnn2)c(CN2C(=O)c3ccccc3C2=O)c1
Show InChI InChI=1S/C20H13ClN4O3/c21-13-7-8-16(23-18(26)17-6-3-9-22-24-17)12(10-13)11-25-19(27)14-4-1-2-5-15(14)20(25)28/h1-10H,11H2,(H,23,26)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/an/an/a>1.00E+5n/an/an/an/a



Merck& Co.

Curated by ChEMBL


Assay Description
Activity at human mGluR5 expressed in CHO cells assessed as potentiation of glutamate response by FLIPR assay


Bioorg Med Chem Lett 17: 1386-91 (2007)


Article DOI: 10.1016/j.bmcl.2006.11.081
BindingDB Entry DOI: 10.7270/Q22V2GXH
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor


(Rattus norvegicus (Rat))
BDBM50202128
PNG
(CHEMBL247950 | N-(4-chloro-2-((1,3-dioxoisoindolin...)
Show SMILES Clc1ccc(NC(=O)c2cccnn2)c(CN2C(=O)c3ccccc3C2=O)c1
Show InChI InChI=1S/C20H13ClN4O3/c21-13-7-8-16(23-18(26)17-6-3-9-22-24-17)12(10-13)11-25-19(27)14-4-1-2-5-15(14)20(25)28/h1-10H,11H2,(H,23,26)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/an/an/a<1.00E+3n/an/an/an/a



Merck& Co.

Curated by ChEMBL


Assay Description
Activity at rat mGluR5 expressed in CHO cells assessed as potentiation of glutamate response by FLIPR assay


Bioorg Med Chem Lett 17: 1386-91 (2007)


Article DOI: 10.1016/j.bmcl.2006.11.081
BindingDB Entry DOI: 10.7270/Q22V2GXH
More data for this
Ligand-Target Pair