Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = '3-hydroxy-3-methylglutaryl-coenzyme A reductase' and Ligand = 'BDBM50291256'   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/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 (Rattus norvegicus (rat))	BDBM50291256 (CHEMBL152129 | Sodium; (E)-(3R,5S)-7-[5-(4-chloro-...) Show SMILES CC(C)c1sc(c(c1\C=C\[C@@H](O)C[C@@H](O)CC([O-])=O)-c1ccc(F)cc1)-c1ccc(Cl)cc1 Show InChI InChI=1S/C26H26ClFO4S/c1-15(2)25-22(12-11-20(29)13-21(30)14-23(31)32)24(16-5-9-19(28)10-6-16)26(33-25)17-3-7-18(27)8-4-17/h3-12,15,20-21,29-30H,13-14H2,1-2H3,(H,31,32)/p-1/b12-11+/t20-,21-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	Article	n/a	n/a	21	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Tested in vitro for the HMG-CoA reductase inhibitory activity in a microsomal preparation				Bioorg Med Chem Lett 7: 549-554 (1997) Article DOI: 10.1016/S0960-894X(97)00065-6 BindingDB Entry DOI: 10.7270/Q2RB74NQ
					More data for this Ligand-Target Pair