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SMILES: CCN(C)c1ccnc2sc3c(ncn(-c4ccc(CC)cc4)c3=O)c12

InChI Key: InChIKey=IPMMMSQQYJZTAG-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 = 50177074   
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 1


(Homo sapiens (Human))
BDBM50177074
PNG
(9-(Ethyl-methyl-amino)-3-(4-ethyl-phenyl)-3H-pyrid...)
Show SMILES CCN(C)c1ccnc2sc3c(ncn(-c4ccc(CC)cc4)c3=O)c12
Show InChI InChI=1S/C20H20N4OS/c1-4-13-6-8-14(9-7-13)24-12-22-17-16-15(23(3)5-2)10-11-21-19(16)26-18(17)20(24)25/h6-12H,4-5H2,1-3H3
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/a 37n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Antagonist activity at human mGluR1 expressed in 1321N1 cells assessed as effect on L-glutamate-induced calcium mobilization


J Med Chem 48: 7374-88 (2005)


Article DOI: 10.1021/jm0504407
BindingDB Entry DOI: 10.7270/Q27P8XX0
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 1


(RAT)
BDBM50177074
PNG
(9-(Ethyl-methyl-amino)-3-(4-ethyl-phenyl)-3H-pyrid...)
Show SMILES CCN(C)c1ccnc2sc3c(ncn(-c4ccc(CC)cc4)c3=O)c12
Show InChI InChI=1S/C20H20N4OS/c1-4-13-6-8-14(9-7-13)24-12-22-17-16-15(23(3)5-2)10-11-21-19(16)26-18(17)20(24)25/h6-12H,4-5H2,1-3H3
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/a 37n/an/an/an/an/an/a



Biocampus

Curated by ChEMBL


Assay Description
Inhibition of rat mGluR1


Eur J Med Chem 43: 1025-34 (2008)


Article DOI: 10.1016/j.ejmech.2007.06.024
BindingDB Entry DOI: 10.7270/Q2V987VM
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 5


(Homo sapiens (Human))
BDBM50177074
PNG
(9-(Ethyl-methyl-amino)-3-(4-ethyl-phenyl)-3H-pyrid...)
Show SMILES CCN(C)c1ccnc2sc3c(ncn(-c4ccc(CC)cc4)c3=O)c12
Show InChI InChI=1S/C20H20N4OS/c1-4-13-6-8-14(9-7-13)24-12-22-17-16-15(23(3)5-2)10-11-21-19(16)26-18(17)20(24)25/h6-12H,4-5H2,1-3H3
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/a 2.57E+3n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Antagonist activity at human mGluR5 expressed in 1321N1 cells assessed as effect on L-glutamate-induced calcium mobilization


J Med Chem 48: 7374-88 (2005)


Article DOI: 10.1021/jm0504407
BindingDB Entry DOI: 10.7270/Q27P8XX0
More data for this
Ligand-Target Pair