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

InChI Key: InChIKey=QMPBQMYCTYCWCT-DGTKBQTJSA-M

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50296074   
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))		BDBM50296074
PNG
(CHEMBL557036 | sodium(3R,5S,E)-7-(4-(3-(3-fluoroph...)
Show SMILES CCC(CC)(c1cccc(F)c1)c1ccc(\C=C\[C@@H](O)C[C@@H](O)CC([O-])=O)c(c1)C(C)C |r|
Show InChI InChI=1S/C27H35FO4/c1-5-27(6-2,20-8-7-9-22(28)14-20)21-12-10-19(25(15-21)18(3)4)11-13-23(29)16-24(30)17-26(31)32/h7-15,18,23-24,29-30H,5-6,16-17H2,1-4H3,(H,31,32)/p-1/b13-11+/t23-,24-/m1/s1
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MMDB

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Article
PubMed
n/an/a 9.20E+4n/an/an/an/an/an/a



The University of Tokyo

Curated by ChEMBL


Assay Description
Inhibition of rat HMG-CoA reductase using 3.7 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