BindingDB logo
myBDB logout

null

SMILES: O[C@@H](CC(O)=O)CC(=O)CCc1ccccc1

InChI Key: InChIKey=AOBNEADIHQEJLV-GFCCVEGCSA-N

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 = 50020291   
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))		BDBM50020291
PNG
(3-Hydroxy-5-oxo-7-phenyl-heptanoic acid | CHEMBL60...)
Show SMILES O[C@@H](CC(O)=O)CC(=O)CCc1ccccc1
Show InChI InChI=1S/C13H16O4/c14-11(8-12(15)9-13(16)17)7-6-10-4-2-1-3-5-10/h1-5,12,15H,6-9H2,(H,16,17)/t12-/m1/s1
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

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

Similars
PubMed
n/an/a 1.30n/an/an/an/an/an/a



University of California

Curated by ChEMBL


Assay Description
Ability of compound to inhibit the activity of 3-hydroxy-3-methylglutarylcoenzyme A(HMGR) reductase in rat liver microsomes

J Med Chem 32: 197-202 (1989)


BindingDB Entry DOI: 10.7270/Q24T6HB3
More data for this
Ligand-Target Pair