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BDBM372982 3-methyl-5-[6-(5-::US10246432, Example 23::US10584111, Ex No. 23

SMILES: Cc1ccc(nc1)-c1cc(ncn1)-c1cc(C)cc(c1)C#N

InChI Key: InChIKey=QFPRCSPLBPCSFF-UHFFFAOYSA-N

Data: 2 KI

Find this compound or compounds like it in BindingDB or PDB:
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 372982   
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))
BDBM372982
PNG
(3-methyl-5-[6-(5- | US10246432, Example 23 | US105...)
Show SMILES Cc1ccc(nc1)-c1cc(ncn1)-c1cc(C)cc(c1)C#N
Show InChI InChI=1S/C18H14N4/c1-12-3-4-16(20-10-12)18-8-17(21-11-22-18)15-6-13(2)5-14(7-15)9-19/h3-8,10-11H,1-2H3
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
2.14n/an/an/an/an/an/an/an/a



Heptares Therapeutics Limited

US Patent


Assay Description
Membrane PreparationcDNA encoding the human mGlu5 receptor was transfected into HEK293 cells using the transfection reagent Genejuice (Novagen). Fort...


US Patent US10584111 (2020)


BindingDB Entry DOI: 10.7270/Q2BR8VK9
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Homo sapiens (Human))
BDBM372982
PNG
(3-methyl-5-[6-(5- | US10246432, Example 23 | US105...)
Show SMILES Cc1ccc(nc1)-c1cc(ncn1)-c1cc(C)cc(c1)C#N
Show InChI InChI=1S/C18H14N4/c1-12-3-4-16(20-10-12)18-8-17(21-11-22-18)15-6-13(2)5-14(7-15)9-19/h3-8,10-11H,1-2H3
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
2.14n/an/an/an/an/an/an/an/a



Research Triangle Institute



Assay Description
After thawing, membrane homogenates were re-suspended in the binding buffer (50 mM HEPES pH 7.5, 150 mM NaCl) to a final assay concentration of 2.5 &...


J Med Chem 50: 3686-95 (2007)


BindingDB Entry DOI: 10.7270/Q2ZS2ZVS
More data for this
Ligand-Target Pair