BDBM50353742 CHEMBL486985

SMILES: C[C@@H]1CC[C@]2(C)[C@H](CCC=C2C)[C@@]1(C)CCC1=CC(=O)O[C@@H]1O

InChI Key: InChIKey=LVSCWEDTMWAASP-KXAOQFNBSA-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 = 50353742   

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 (HMG-CoA) (Homo sapiens (Human))	BDBM50353742 (CHEMBL486985) Show SMILES C[C@@H]1CC[C@]2(C)[C@H](CCC=C2C)[C@@]1(C)CCC1=CC(=O)O[C@@H]1O |r,c:9,t:18| Show InChI InChI=1S/C20H30O3/c1-13-6-5-7-16-19(13,3)10-8-14(2)20(16,4)11-9-15-12-17(21)23-18(15)22/h6,12,14,16,18,22H,5,7-11H2,1-4H3/t14-,16+,18+,19+,20+/m1/s1	PDB UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.02E+4	n/a	n/a	n/a	n/a	n/a	n/a
Central Drug Research Institute (CSIR) Curated by ChEMBL					Assay Description Inhibition of HMG-CoA reductase using HMG-CoA as substrate by spectrophotometry in presence of NADPH				Eur J Med Chem 46: 5206-11 (2011) Article DOI: 10.1016/j.ejmech.2011.08.012 BindingDB Entry DOI: 10.7270/Q2M32W50
					More data for this Ligand-Target Pair