BindingDB logo
myBDB logout

null

SMILES: CC(C)c1sc(C(C)C)c(c1\C=C\[C@@H](O)C[C@@H](O)CC([O-])=O)-c1ccc(F)cc1

InChI Key: InChIKey=TZFHDGAWYDEWTC-AQRBRUGDSA-M

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50291252   
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))		BDBM50291252
PNG
(CHEMBL152551 | Sodium; (E)-(3R,5S)-7-[4-(4-fluoro-...)
Show SMILES CC(C)c1sc(C(C)C)c(c1\C=C\[C@@H](O)C[C@@H](O)CC([O-])=O)-c1ccc(F)cc1
Show InChI InChI=1S/C23H29FO4S/c1-13(2)22-19(10-9-17(25)11-18(26)12-20(27)28)21(23(29-22)14(3)4)15-5-7-16(24)8-6-15/h5-10,13-14,17-18,25-26H,11-12H2,1-4H3,(H,27,28)/p-1/b10-9+/t17-,18-/m1/s1
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
KEGG
PC cid
PC sid
UniChem

Similars
Article
n/an/a 26n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Tested in vitro for the HMG-CoA reductase inhibitory activity in a microsomal preparation

Bioorg Med Chem Lett 7: 549-554 (1997)


Article DOI: 10.1016/S0960-894X(97)00065-6
BindingDB Entry DOI: 10.7270/Q2RB74NQ
More data for this
Ligand-Target Pair