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BDBM160556 US9682980, 3-(Cyclopropylmethyl)-7-(4-(4-fluorophenyl)piperidin-1-yl)-8-methoxy-[1,2,4]triazolo[4,3-c]pyrimidine::US9682980, 3-(Cyclopropylmethyl)-8-methoxy-7-(4-phenylpiperidin-1-yl)-[1,2,4]triazolo[4,3-c]pyrimidine

SMILES: COc1c(ncn2c(CC3CC3)nnc12)N1CCC(CC1)c1ccccc1

InChI Key: InChIKey=JLPZUFLAKWMESU-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 = 160556   
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))
BDBM160556
PNG
(US9682980, 3-(Cyclopropylmethyl)-7-(4-(4-fluorophe...)
Show SMILES COc1c(ncn2c(CC3CC3)nnc12)N1CCC(CC1)c1ccccc1
Show InChI InChI=1S/C21H25N5O/c1-27-19-20(22-14-26-18(13-15-7-8-15)23-24-21(19)26)25-11-9-17(10-12-25)16-5-3-2-4-6-16/h2-6,14-15,17H,7-13H2,1H3
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/an/an/a 519n/an/a7.0n/a



Bristol-Myers Squibb Company

US Patent


Assay Description
Clonally expressed human mGluR2 in HEK293 background was glutamate starved overnight in media without glutamine (GIBCO MEM 12360), containing 10% FBS...


US Patent US9682980 (2017)


BindingDB Entry DOI: 10.7270/Q2J964JS
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 2


(Homo sapiens (Human))
BDBM160556
PNG
(US9682980, 3-(Cyclopropylmethyl)-7-(4-(4-fluorophe...)
Show SMILES COc1c(ncn2c(CC3CC3)nnc12)N1CCC(CC1)c1ccccc1
Show InChI InChI=1S/C21H25N5O/c1-27-19-20(22-14-26-18(13-15-7-8-15)23-24-21(19)26)25-11-9-17(10-12-25)16-5-3-2-4-6-16/h2-6,14-15,17H,7-13H2,1H3
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/an/an/a 540n/an/a7.0n/a



Bristol-Myers Squibb Company

US Patent


Assay Description
Clonally expressed human mGluR2 in HEK293 background was glutamate starved overnight in media without glutamine (GIBCO MEM 12360), containing 10% FBS...


US Patent US9682980 (2017)


BindingDB Entry DOI: 10.7270/Q2J964JS
More data for this
Ligand-Target Pair