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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Aldose reductase (ALR2)' and Ligand = 'BDBM50022490'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Aldose reductase (ALR2)


(Bos taurus (Cattle))
BDBM50022490
PNG
(CHEMBL81353 | cspiro[2,3-dihydro-1H-benzo[f]chrome...)
Show SMILES O=C1NC(=O)C2(CCOc3ccc4ccccc4c23)N1
Show InChI InChI=1S/C15H12N2O3/c18-13-15(17-14(19)16-13)7-8-20-11-6-5-9-3-1-2-4-10(9)12(11)15/h1-6H,7-8H2,(H2,16,17,18,19)
PDB

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 1.00E+4n/an/an/an/an/an/a



Pfizer Central Research

Curated by ChEMBL


Assay Description
In vitro inhibition of partially purified calf lens aldose reductase


J Med Chem 31: 230-43 (1988)


Article DOI: 10.1021/jm00396a037
BindingDB Entry DOI: 10.7270/Q27D2VQF
More data for this
Ligand-Target Pair