BDBM50231024 CHEMBL401949::sodium (3R,5R)-7-(2-(4-fluorophenyl)-5-isopropyl-4-(morpholinosulfonyl)-3-phenyl-1H-pyrrol-1-yl)-3,5-dihydroxyheptanoate

SMILES: CC(C)c1c(c(c(-c2ccc(F)cc2)n1CC[C@@H](O)C[C@@H](O)CC([O-])=O)-c1ccccc1)S(=O)(=O)N1CCOCC1

InChI Key: InChIKey=XLVZRBHNHHAPDT-JWQCQUIFSA-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 = 50231024   

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))	BDBM50231024 (CHEMBL401949 | sodium (3R,5R)-7-(2-(4-fluorophenyl...) Show SMILES CC(C)c1c(c(c(-c2ccc(F)cc2)n1CC[C@@H](O)C[C@@H](O)CC([O-])=O)-c1ccccc1)S(=O)(=O)N1CCOCC1 Show InChI InChI=1S/C30H37FN2O7S/c1-20(2)28-30(41(38,39)32-14-16-40-17-15-32)27(21-6-4-3-5-7-21)29(22-8-10-23(31)11-9-22)33(28)13-12-24(34)18-25(35)19-26(36)37/h3-11,20,24-25,34-35H,12-19H2,1-2H3,(H,36,37)/p-1/t24-,25-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4.5	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Global Research and Development Curated by ChEMBL					Assay Description Inhibition of rat microsomal HMGCoA reductase				Bioorg Med Chem Lett 18: 1151-6 (2008) Article DOI: 10.1016/j.bmcl.2007.11.124 BindingDB Entry DOI: 10.7270/Q2TQ6191
					More data for this Ligand-Target Pair