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SMILES: CCC(CC)(c1ccccc1)c1ccc(\C=C\[C@@H](O)C[C@@H](O)CC([O-])=O)c(c1)-c1cccc(F)c1

InChI Key: InChIKey=WJLHSOZHUQVPDH-FBTBEWQISA-M

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50296078   
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
3-hydroxy-3-methylglutaryl-coenzyme A reductase


(Rattus norvegicus (rat))		BDBM50296078
PNG
(CHEMBL557852 | sodium(3R,5S,E)-7-(3'-fluoro-5-(3-p...)
Show SMILES CCC(CC)(c1ccccc1)c1ccc(\C=C\[C@@H](O)C[C@@H](O)CC([O-])=O)c(c1)-c1cccc(F)c1 |r|
Show InChI InChI=1S/C30H33FO4/c1-3-30(4-2,23-10-6-5-7-11-23)24-15-13-21(14-16-26(32)19-27(33)20-29(34)35)28(18-24)22-9-8-12-25(31)17-22/h5-18,26-27,32-33H,3-4,19-20H2,1-2H3,(H,34,35)/p-1/b16-14+/t26-,27-/m1/s1
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Article
PubMed
n/an/a 1.20E+3n/an/an/an/an/an/a



The University of Tokyo

Curated by ChEMBL


Assay Description
Inhibition of rat HMG-CoA reductase using 0.37 MBq DL-[3-14C]HMG-CoA

Bioorg Med Chem Lett 19: 4228-31 (2009)


Article DOI: 10.1016/j.bmcl.2009.05.100
BindingDB Entry DOI: 10.7270/Q22F7PCK
More data for this
Ligand-Target Pair