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BDBM50234102 CHEMBL4090052

SMILES: OC(=O)[C@@H]1C[C@H](CN1)Oc1cc2ccccc2cc1C(O)=O

InChI Key: InChIKey=DHPQJRYFIYLEEK-YPMHNXCESA-N

Data: 5 KI

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 5 hits for monomerid = 50234102   
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
Glutamate receptor ionotropic, kainate 1


(RAT)
BDBM50234102
PNG
(CHEMBL4090052)
Show SMILES OC(=O)[C@@H]1C[C@H](CN1)Oc1cc2ccccc2cc1C(O)=O |r|
Show InChI InChI=1S/C16H15NO5/c18-15(19)12-5-9-3-1-2-4-10(9)6-14(12)22-11-7-13(16(20)21)17-8-11/h1-6,11,13,17H,7-8H2,(H,18,19)(H,20,21)/t11-,13+/m1/s1
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
PubMed
3.50E+3n/an/an/an/an/an/an/an/a



McGill University

Curated by ChEMBL


Assay Description
Displacement of [3H]NF608 from eGFP-fused recombinant rat full length GluK1 receptor expressed in HEK293T/17 cells by liquid scintillation counting m...


J Med Chem 60: 441-457 (2017)


BindingDB Entry DOI: 10.7270/Q2G44SJJ
More data for this
Ligand-Target Pair
Glutamate receptor ionotropic, kainate 1


(RAT)
BDBM50234102
PNG
(CHEMBL4090052)
Show SMILES OC(=O)[C@@H]1C[C@H](CN1)Oc1cc2ccccc2cc1C(O)=O |r|
Show InChI InChI=1S/C16H15NO5/c18-15(19)12-5-9-3-1-2-4-10(9)6-14(12)22-11-7-13(16(20)21)17-8-11/h1-6,11,13,17H,7-8H2,(H,18,19)(H,20,21)/t11-,13+/m1/s1
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
PubMed
3.51E+3n/an/an/an/an/an/an/an/a



McGill University

Curated by ChEMBL


Assay Description
Displacement of [3H]NF608 from eGFP-fused recombinant rat full length GluK1 receptor expressed in HEK293T/17 cells by liquid scintillation counting m...


J Med Chem 60: 441-457 (2017)


BindingDB Entry DOI: 10.7270/Q2G44SJJ
More data for this
Ligand-Target Pair
Glutamate receptor ionotropic, AMPA 2


(Rattus norvegicus)
BDBM50234102
PNG
(CHEMBL4090052)
Show SMILES OC(=O)[C@@H]1C[C@H](CN1)Oc1cc2ccccc2cc1C(O)=O |r|
Show InChI InChI=1S/C16H15NO5/c18-15(19)12-5-9-3-1-2-4-10(9)6-14(12)22-11-7-13(16(20)21)17-8-11/h1-6,11,13,17H,7-8H2,(H,18,19)(H,20,21)/t11-,13+/m1/s1
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
PubMed
>1.00E+5n/an/an/an/an/an/an/an/a



McGill University

Curated by ChEMBL


Assay Description
Displacement of (RS)-[3H]AMPA from eGFP-fused recombinant rat full length GluA2 receptor expressed in HEK293T/17 cells by liquid scintillation counti...


J Med Chem 60: 441-457 (2017)


BindingDB Entry DOI: 10.7270/Q2G44SJJ
More data for this
Ligand-Target Pair
Glutamate receptor ionotropic, kainate


(Rattus norvegicus)
BDBM50234102
PNG
(CHEMBL4090052)
Show SMILES OC(=O)[C@@H]1C[C@H](CN1)Oc1cc2ccccc2cc1C(O)=O |r|
Show InChI InChI=1S/C16H15NO5/c18-15(19)12-5-9-3-1-2-4-10(9)6-14(12)22-11-7-13(16(20)21)17-8-11/h1-6,11,13,17H,7-8H2,(H,18,19)(H,20,21)/t11-,13+/m1/s1
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
PubMed
>1.00E+5n/an/an/an/an/an/an/an/a



McGill University

Curated by ChEMBL


Assay Description
Displacement of [3H]kainic acid from eGFP-fused recombinant rat full length GluK3 receptor expressed in HEK293T/17 cells by liquid scintillation coun...


J Med Chem 60: 441-457 (2017)


BindingDB Entry DOI: 10.7270/Q2G44SJJ
More data for this
Ligand-Target Pair
Ionotropic glutamate receptor kainate 2/5


(Rattus norvegicus)
BDBM50234102
PNG
(CHEMBL4090052)
Show SMILES OC(=O)[C@@H]1C[C@H](CN1)Oc1cc2ccccc2cc1C(O)=O |r|
Show InChI InChI=1S/C16H15NO5/c18-15(19)12-5-9-3-1-2-4-10(9)6-14(12)22-11-7-13(16(20)21)17-8-11/h1-6,11,13,17H,7-8H2,(H,18,19)(H,20,21)/t11-,13+/m1/s1
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
PubMed
>1.00E+6n/an/an/an/an/an/an/an/a



McGill University

Curated by ChEMBL


Assay Description
Displacement of [3H]kainic acid from eGFP-fused recombinant rat full length GluK2 receptor expressed in HEK293T/17 cells by liquid scintillation coun...


J Med Chem 60: 441-457 (2017)


BindingDB Entry DOI: 10.7270/Q2G44SJJ
More data for this
Ligand-Target Pair