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BDBM160721 US9682980, 8-Chloro-3-(cyclopropylmethyl)-7-(4-(pyrimidin-2-yl)piperazin-1-yl)-[1,2,4]triazolo[4,3-b]pyridazine

SMILES: Clc1c(cnn2c(CC3CC3)nnc12)N1CCC(CC1)c1ncccn1

InChI Key: InChIKey=VFKYUCXPSFFELL-UHFFFAOYSA-N

Data: 1 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 1 hit for monomerid = 160721   
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))
BDBM160721
PNG
(US9682980, 8-Chloro-3-(cyclopropylmethyl)-7-(4-(py...)
Show SMILES Clc1c(cnn2c(CC3CC3)nnc12)N1CCC(CC1)c1ncccn1
Show InChI InChI=1S/C18H20ClN7/c19-16-14(11-22-26-15(10-12-2-3-12)23-24-18(16)26)25-8-4-13(5-9-25)17-20-6-1-7-21-17/h1,6-7,11-13H,2-5,8-10H2
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/an/an/a 280n/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