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BDBM50009835 4-Hydroxy-5-oxo-1-pyridin-4-ylmethyl-2,5-dihydro-1H-pyrrole-3-carboxylic acid ethyl ester::CHEMBL266773

SMILES: CCOC(=O)C1CN(Cc2ccncc2)C(=O)C1=O

InChI Key: InChIKey=GOEUHBJSLVMWJJ-UHFFFAOYSA-N

Data: 2 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50009835   
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
Aldose reductase


(Rattus norvegicus)
BDBM50009835
PNG
(4-Hydroxy-5-oxo-1-pyridin-4-ylmethyl-2,5-dihydro-1...)
Show SMILES CCOC(=O)C1CN(Cc2ccncc2)C(=O)C1=O
Show InChI InChI=1S/C13H14N2O4/c1-2-19-13(18)10-8-15(12(17)11(10)16)7-9-3-5-14-6-4-9/h3-6,10H,2,7-8H2,1H3
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 110n/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Percent inhibition of sorbitol accumulation in rat lens was measured


J Med Chem 34: 1011-8 (1991)

Checked by Author
Article DOI: 10.1021/jm00107a020
BindingDB Entry DOI: 10.7270/Q2NK3FMZ
More data for this
Ligand-Target Pair
Aldose reductase (AR)


(Homo sapiens (Human))
BDBM50009835
PNG
(4-Hydroxy-5-oxo-1-pyridin-4-ylmethyl-2,5-dihydro-1...)
Show SMILES CCOC(=O)C1CN(Cc2ccncc2)C(=O)C1=O
Show InChI InChI=1S/C13H14N2O4/c1-2-19-13(18)10-8-15(12(17)11(10)16)7-9-3-5-14-6-4-9/h3-6,10H,2,7-8H2,1H3
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 200n/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
In vitro inhibition of human placental aldose reductase.


J Med Chem 34: 1011-8 (1991)

Checked by Author
Article DOI: 10.1021/jm00107a020
BindingDB Entry DOI: 10.7270/Q2NK3FMZ
More data for this
Ligand-Target Pair