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BDBM50478793 CHEMBL479175

SMILES: [Na;v0+].[H][C@]12[#6]-[#6]-[#7](-[#6]-c3ccccc3)-[#6][C@@]1([H])c1cc(-[#6]-[#6](-[#8-])=O)ccc1-[#7]2

InChI Key: InChIKey=VMLIMOJFSVSHPK-QQTWVUFVSA-M

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50478793   
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)		BDBM50478793
PNG
(CHEMBL479175)
Show SMILES [Na;v0+].[H][C@]12[#6]-[#6]-[#7](-[#6]-c3ccccc3)-[#6][C@@]1([H])c1cc(-[#6]-[#6](-[#8-])=O)ccc1-[#7]2 |r|
Show InChI InChI=1S/C20H22N2O2.Na/c23-20(24)11-15-6-7-18-16(10-15)17-13-22(9-8-19(17)21-18)12-14-4-2-1-3-5-14;/h1-7,10,17,19,21H,8-9,11-13H2,(H,23,24);/q;+1/p-1/t17-,19-;/m0./s1
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PC cid
PC sid
UniChem
Article
PubMed
n/an/a 2.66E+5n/an/an/an/an/an/a



Slovak Academy of Sciences

Curated by ChEMBL


Assay Description
Inhibition of Wistar rat lens aldose reductase 2

Bioorg Med Chem 16: 4908-20 (2008)


Article DOI: 10.1016/j.bmc.2008.03.039
BindingDB Entry DOI: 10.7270/Q2HQ42PT
More data for this
Ligand-Target Pair