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BDBM50066666 CHEMBL3403086

SMILES: Cc1ccc(cc1)-c1c(sc2ncccc12)S(=O)(=O)c1ccc(Cl)cc1

InChI Key: InChIKey=CVIMEWTXMHZUHE-UHFFFAOYSA-N

Data: 1 KI  1 IC50

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 = 50066666   
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


(Rattus norvegicus (Rat))
BDBM50066666
PNG
(CHEMBL3403086)
Show SMILES Cc1ccc(cc1)-c1c(sc2ncccc12)S(=O)(=O)c1ccc(Cl)cc1
Show InChI InChI=1S/C20H14ClNO2S2/c1-13-4-6-14(7-5-13)18-17-3-2-12-22-19(17)25-20(18)26(23,24)16-10-8-15(21)9-11-16/h2-12H,1H3
PDB
MMDB

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KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
21n/an/an/an/an/an/an/an/a



Gedeon Richter Plc

Curated by ChEMBL


Assay Description
Displacement of [3H]-M-MPEP from rat cerebrocortical mGluR5 receptor


Bioorg Med Chem Lett 25: 1724-9 (2015)


Article DOI: 10.1016/j.bmcl.2015.02.073
BindingDB Entry DOI: 10.7270/Q2JS9S47
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor


(Rattus norvegicus (Rat))
BDBM50066666
PNG
(CHEMBL3403086)
Show SMILES Cc1ccc(cc1)-c1c(sc2ncccc12)S(=O)(=O)c1ccc(Cl)cc1
Show InChI InChI=1S/C20H14ClNO2S2/c1-13-4-6-14(7-5-13)18-17-3-2-12-22-19(17)25-20(18)26(23,24)16-10-8-15(21)9-11-16/h2-12H,1H3
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 111n/an/an/an/an/an/a



Gedeon Richter Plc

Curated by ChEMBL


Assay Description
Negative allosteric modulation of mGlu5 receptor in primary E17 rat embryo neuron assessed as ca2+ level by fluo-4/AM assay


Bioorg Med Chem Lett 25: 1724-9 (2015)


Article DOI: 10.1016/j.bmcl.2015.02.073
BindingDB Entry DOI: 10.7270/Q2JS9S47
More data for this
Ligand-Target Pair