new BindingDB logo
myBDB logout

BDBM50346276 CHEMBL1782549::sodium(3R,5R)-7-(4-(benzylcarbamoyl)-2-(4-fluorophenyl)-5-propyl-1H-imidazol-1-yl)-3,5-dihydroxyheptanoate

SMILES: CCCc1c(nc(-c2ccc(F)cc2)n1CC[C@@H](O)C[C@@H](O)CC([O-])=O)C(=O)NCc1ccccc1

InChI Key: InChIKey=JIVQMHYHCHVBAN-FGZHOGPDSA-M

Data: 1 IC50

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 = 50346276   
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
HMG-CoA reductase


(Rattus norvegicus (rat))
BDBM50346276
PNG
(CHEMBL1782549 | sodium(3R,5R)-7-(4-(benzylcarbamoy...)
Show SMILES CCCc1c(nc(-c2ccc(F)cc2)n1CC[C@@H](O)C[C@@H](O)CC([O-])=O)C(=O)NCc1ccccc1 |r|
Show InChI InChI=1S/C27H32FN3O5/c1-2-6-23-25(27(36)29-17-18-7-4-3-5-8-18)30-26(19-9-11-20(28)12-10-19)31(23)14-13-21(32)15-22(33)16-24(34)35/h3-5,7-12,21-22,32-33H,2,6,13-17H2,1H3,(H,29,36)(H,34,35)/p-1/t21-,22-/m1/s1
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

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

Patents

Article
PubMed
n/an/a 26n/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Inhibition of HMG-CoA reductase in Sprague-Dawley rat liver microsomes using using [14C]HMG-CoA as substrate preincubated for 0.5 hrs before substrat...


Bioorg Med Chem Lett 21: 2725-31 (2011)


Article DOI: 10.1016/j.bmcl.2010.11.103
BindingDB Entry DOI: 10.7270/Q2H995J1
More data for this
Ligand-Target Pair