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SMILES: FC(F)(F)c1c(ccn2c(CC3CC3)nnc12)-c1ccc(CNC(=O)c2ccc(cc2)S(F)(=O)=O)cc1

InChI Key: InChIKey=ALLKYFRFVNIHGD-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 3 hits for monomerid = 50503158   
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 2


(Homo sapiens (Human))
BDBM50503158
PNG
(CHEMBL4589377)
Show SMILES FC(F)(F)c1c(ccn2c(CC3CC3)nnc12)-c1ccc(CNC(=O)c2ccc(cc2)S(F)(=O)=O)cc1
Show InChI InChI=1S/C25H20F4N4O3S/c26-25(27,28)22-20(11-12-33-21(13-15-1-2-15)31-32-23(22)33)17-5-3-16(4-6-17)14-30-24(34)18-7-9-19(10-8-18)37(29,35)36/h3-12,15H,1-2,13-14H2,(H,30,34)
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
4.20n/an/an/an/an/an/an/an/a



Leiden University

Curated by ChEMBL


Assay Description
Displacement of [3H]JNJ-46281222 from human mGlu2 receptor expressed in CHOK1 cell membranes preincubated for 3 hrs followed by [3H]JNJ-46281222 addi...


J Med Chem 62: 223-233 (2019)


Article DOI: 10.1021/acs.jmedchem.8b00051
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 2


(Homo sapiens (Human))
BDBM50503158
PNG
(CHEMBL4589377)
Show SMILES FC(F)(F)c1c(ccn2c(CC3CC3)nnc12)-c1ccc(CNC(=O)c2ccc(cc2)S(F)(=O)=O)cc1
Show InChI InChI=1S/C25H20F4N4O3S/c26-25(27,28)22-20(11-12-33-21(13-15-1-2-15)31-32-23(22)33)17-5-3-16(4-6-17)14-30-24(34)18-7-9-19(10-8-18)37(29,35)36/h3-12,15H,1-2,13-14H2,(H,30,34)
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
5.80n/an/an/an/an/an/an/an/a



Leiden University

Curated by ChEMBL


Assay Description
Displacement of [3H]JNJ-46281222 from human mGlu2 receptor expressed in CHOK1 cell membranes after 1 hr by microbeta scintillation counting method


J Med Chem 62: 223-233 (2019)


Article DOI: 10.1021/acs.jmedchem.8b00051
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 2


(Homo sapiens (Human))
BDBM50503158
PNG
(CHEMBL4589377)
Show SMILES FC(F)(F)c1c(ccn2c(CC3CC3)nnc12)-c1ccc(CNC(=O)c2ccc(cc2)S(F)(=O)=O)cc1
Show InChI InChI=1S/C25H20F4N4O3S/c26-25(27,28)22-20(11-12-33-21(13-15-1-2-15)31-32-23(22)33)17-5-3-16(4-6-17)14-30-24(34)18-7-9-19(10-8-18)37(29,35)36/h3-12,15H,1-2,13-14H2,(H,30,34)
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/an/an/a 15n/an/an/an/a



Leiden University

Curated by ChEMBL


Assay Description
Positive allosteric modulation of human mGlu2 receptor expressed in CHOK1 cell membranes assessed as increase in glutamate-induced [35S]GTPgammaS bin...


J Med Chem 62: 223-233 (2019)


Article DOI: 10.1021/acs.jmedchem.8b00051
More data for this
Ligand-Target Pair