BDBM50452899 CHEMBL4215012

SMILES: [#6]\[#6](-[#6])=[#6]\[#6]-[#6]\[#6](-[#6])=[#6]\[#6]-[#6]-[#6]-1=[#6]-[#6@@H](-[#8]-[#6]-1=O)-c1ccccc1-[#8]

InChI Key: InChIKey=GQRGTIMUCZUFJO-NXZBIGBUSA-N

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 = 50452899   

Target/Host (Institution)	Ligand	Target/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	pH	Temp °C
3-hydroxy-3-methylglutaryl-coenzyme A reductase (Sus scrofa)	BDBM50452899 (CHEMBL4215012) Show SMILES [#6]\[#6](-[#6])=[#6]\[#6]-[#6]\[#6](-[#6])=[#6]\[#6]-[#6]-[#6]-1=[#6]-[#6@@H](-[#8]-[#6]-1=O)-c1ccccc1-[#8] |r,t:11| Show InChI InChI=1S/C21H26O3/c1-15(2)8-6-9-16(3)10-7-11-17-14-20(24-21(17)23)18-12-4-5-13-19(18)22/h4-5,8,10,12-14,20,22H,6-7,9,11H2,1-3H3/b16-10+/t20-/m1/s1	PDB UniProtKB/SwissProt UniProtKB/TrEMBL GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	6.76E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Chinese Academy of Sciences Curated by ChEMBL					Assay Description Inhibition of pig liver microsomal HMG-CoA reductase by colorimetric method				J Med Chem 61: 3609-3625 (2018) Article DOI: 10.1021/acs.jmedchem.8b00107 BindingDB Entry DOI: 10.7270/Q2ZS3045
					More data for this Ligand-Target Pair