BDBM50406569 CHEMBL319975

SMILES: CC(C)c1nc-2c(CCCc3ccccc-23)c(c1CCP(O)([O-])=CC(=O)CC([O-])=O)-c1ccc(F)cc1

InChI Key: InChIKey=WKAOMYRMDJPXFY-UHFFFAOYSA-L

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 = 50406569   

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
HMG-CoA reductase (Rattus norvegicus (rat))	BDBM50406569 (CHEMBL319975) Show SMILES CC(C)c1nc-2c(CCCc3ccccc-23)c(c1CCP(O)([O-])=CC(=O)CC([O-])=O)-c1ccc(F)cc1 Show InChI InChI=1S/C29H31FNO5P/c1-18(2)28-25(14-15-37(35,36)17-22(32)16-26(33)34)27(20-10-12-21(30)13-11-20)24-9-5-7-19-6-3-4-8-23(19)29(24)31-28/h3-4,6,8,10-13,17-18H,5,7,9,14-16H2,1-2H3,(H3,32,33,34,35,36)/p-2	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	PubMed	n/a	n/a	1.30	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Pharmaceutical Research Institute Curated by ChEMBL					Assay Description In vitro for inhibition of rat HMG-CoA reductase.				J Med Chem 34: 2804-15 (1991) BindingDB Entry DOI: 10.7270/Q2H1336P
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