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BDBM50234091 CHEMBL4084974

SMILES: Cl.OC(=O)[C@@H]1C[C@@H](CN1)Oc1cccc(c1)C(O)=O

InChI Key: InChIKey=IWNYVPCMSYWACS-IYPAPVHQSA-N

Data: 3 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 3 hits for monomerid = 50234091   
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
Ionotropic glutamate receptor kainate 2/5


(Rattus norvegicus)
BDBM50234091
PNG
(CHEMBL4084974)
Show SMILES Cl.OC(=O)[C@@H]1C[C@@H](CN1)Oc1cccc(c1)C(O)=O |r|
Show InChI InChI=1S/C12H13NO5.ClH/c14-11(15)7-2-1-3-8(4-7)18-9-5-10(12(16)17)13-6-9;/h1-4,9-10,13H,5-6H2,(H,14,15)(H,16,17);1H/t9-,10-;/m0./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 [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
Glutamate receptor ionotropic, kainate 1


(RAT)
BDBM50234091
PNG
(CHEMBL4084974)
Show SMILES Cl.OC(=O)[C@@H]1C[C@@H](CN1)Oc1cccc(c1)C(O)=O |r|
Show InChI InChI=1S/C12H13NO5.ClH/c14-11(15)7-2-1-3-8(4-7)18-9-5-10(12(16)17)13-6-9;/h1-4,9-10,13H,5-6H2,(H,14,15)(H,16,17);1H/t9-,10-;/m0./s1
PDB

UniProtKB/SwissProt

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]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


(Rattus norvegicus)
BDBM50234091
PNG
(CHEMBL4084974)
Show SMILES Cl.OC(=O)[C@@H]1C[C@@H](CN1)Oc1cccc(c1)C(O)=O |r|
Show InChI InChI=1S/C12H13NO5.ClH/c14-11(15)7-2-1-3-8(4-7)18-9-5-10(12(16)17)13-6-9;/h1-4,9-10,13H,5-6H2,(H,14,15)(H,16,17);1H/t9-,10-;/m0./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