BindingDB logo
myBDB logout

1 similar compounds to monomer 50080464

Compile data set for download or QSAR
Wt: 302.3
BDBM50080465
Purchase

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50080465   
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)
BDBM50080465
PNG
(CHEMBL3422329)
Show SMILES CC(C)Sc1nnc2c3ccccc3n(CC(O)=O)c2n1
Show InChI InChI=1S/C14H14N4O2S/c1-8(2)21-14-15-13-12(16-17-14)9-5-3-4-6-10(9)18(13)7-11(19)20/h3-6,8H,7H2,1-2H3,(H,19,20)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
Purchase

CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 2.04E+3n/an/an/an/an/an/a



Slovak Academy of Sciences

Curated by ChEMBL


Assay Description
Inhibition of Wistar rat lens aldose reductase using D,L-glyceraldehyde as substrate incubated for 1 min measured for 4 mins by spectrophotometry


J Med Chem 58: 2649-57 (2015)


Article DOI: 10.1021/jm5015814
BindingDB Entry DOI: 10.7270/Q2WS8VZJ
More data for this
Ligand-Target Pair
Aldose reductase


(Rattus norvegicus)
BDBM50080465
PNG
(CHEMBL3422329)
Show SMILES CC(C)Sc1nnc2c3ccccc3n(CC(O)=O)c2n1
Show InChI InChI=1S/C14H14N4O2S/c1-8(2)21-14-15-13-12(16-17-14)9-5-3-4-6-10(9)18(13)7-11(19)20/h3-6,8H,7H2,1-2H3,(H,19,20)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
Purchase

CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 2.05E+3n/an/an/an/an/an/a



Slovak Academy of Sciences

Curated by ChEMBL


Assay Description
Inhibition of Wistar rat lens aldose reductase using D,L-glyceraldehyde as substrate incubated for 1 min measured for 4 mins by spectrophotometry


J Med Chem 58: 2649-57 (2015)


Article DOI: 10.1021/jm5015814
BindingDB Entry DOI: 10.7270/Q2WS8VZJ
More data for this
Ligand-Target Pair
Aldose reductase-related protein 1


(Rattus norvegicus)
BDBM50080465
PNG
(CHEMBL3422329)
Show SMILES CC(C)Sc1nnc2c3ccccc3n(CC(O)=O)c2n1
Show InChI InChI=1S/C14H14N4O2S/c1-8(2)21-14-15-13-12(16-17-14)9-5-3-4-6-10(9)18(13)7-11(19)20/h3-6,8H,7H2,1-2H3,(H,19,20)
PDB

UniProtKB/SwissProt

GoogleScholar
Purchase

CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 1.41E+4n/an/an/an/an/an/a



Slovak Academy of Sciences

Curated by ChEMBL


Assay Description
Inhibition of Wistar rat kidney aldehyde reductase using D-glucuronate as substrate by spectrophotometry


J Med Chem 58: 2649-57 (2015)


Article DOI: 10.1021/jm5015814
BindingDB Entry DOI: 10.7270/Q2WS8VZJ
More data for this
Ligand-Target Pair